#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m8p s ILE 2 N 0.00 -0.46 0.23 4.25 1.01 -1.26 -4.17 121.20 120.80 3m8p s ILE 2 Ca 0.00 -0.40 -0.21 0.00 0.00 0.00 0.00 60.65 60.04 3m8p s ILE 2 Cb 0.00 -0.96 -0.13 0.00 0.01 0.00 0.00 42.46 41.38 3m8p s ILE 2 CO 0.00 -0.39 0.29 -0.24 0.00 0.00 0.00 174.94 174.59 3m8p n SER 3 N 5.32 -1.53 0.23 3.58 2.88 -0.78 -4.86 113.62 118.46 3m8p n SER 3 Ca -0.02 0.82 0.13 0.00 -1.33 0.00 0.00 58.87 58.47 3m8p n SER 3 Cb 0.47 -0.75 0.34 0.00 -0.75 0.00 0.00 64.21 63.52 3m8p n SER 3 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3m8p h PRO 4 N 0.60 0.00 -4.19 -1.46 0.13 -1.92 -3.41 132.00 121.76 3m8p h PRO 4 Ca -0.26 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.35 3m8p h PRO 4 Cb 1.17 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.35 3m8p h PRO 4 CO 0.43 0.04 -0.08 1.51 -0.23 0.00 0.00 178.00 179.67 3m8p n ILE 5 N -3.12 0.43 -1.66 -3.56 0.00 -1.26 -4.84 119.36 105.35 3m8p n ILE 5 Ca 0.03 -0.11 -0.37 0.00 0.00 0.00 0.00 62.75 62.30 3m8p n ILE 5 Cb 0.47 0.00 0.07 0.00 0.00 0.00 0.00 39.64 40.18 3m8p n ILE 5 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 3m8p n GLU 6 N 0.94 1.01 -1.11 9.51 0.28 -1.26 -4.84 120.64 125.16 3m8p n GLU 6 Ca 0.14 0.40 -0.29 0.00 -0.16 0.00 0.00 57.16 57.25 3m8p n GLU 6 Cb 0.09 -2.49 0.19 0.00 1.43 0.00 0.00 31.44 30.66 3m8p n GLU 6 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3m8p s THR 7 N -1.46 2.03 -0.16 3.84 -4.23 -1.26 -5.01 115.64 109.38 3m8p s THR 7 Ca 0.81 0.01 -0.01 0.00 -1.18 0.00 0.00 61.69 61.32 3m8p s THR 7 Cb -0.37 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 3m8p s THR 7 CO 0.42 -0.01 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.69 3m8p s VAL 8 N -2.93 3.14 0.63 2.29 1.01 -1.26 -4.99 120.40 118.29 3m8p s VAL 8 Ca 0.66 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 3m8p s VAL 8 Cb -0.19 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3m8p s VAL 8 CO 0.58 0.49 1.22 -2.16 0.00 0.00 0.00 175.10 175.23 3m8p s PRO 9 N 0.76 2.76 0.15 2.72 0.04 -1.26 -4.23 135.00 135.95 3m8p s PRO 9 Ca -0.04 1.84 -0.09 0.00 0.04 0.00 0.00 61.00 62.75 3m8p s PRO 9 Cb -0.15 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 3m8p s PRO 9 CO 0.01 -1.38 0.27 0.08 0.04 0.00 0.00 177.00 176.02 3m8p s VAL 10 N -1.65 0.08 -0.12 -0.36 1.01 -1.26 -5.03 120.40 113.06 3m8p s VAL 10 Ca 0.77 -1.36 -0.27 0.00 0.00 0.00 0.00 61.98 61.12 3m8p s VAL 10 Cb -0.31 -1.77 0.07 0.00 0.00 0.00 0.00 36.38 34.37 3m8p s VAL 10 CO 0.36 -0.35 0.66 -0.54 0.00 0.00 0.00 175.10 175.23 3m8p s LYS 11 N -3.95 0.95 0.90 2.72 1.02 -1.26 -4.81 119.74 115.30 3m8p s LYS 11 Ca 0.15 0.46 -0.13 0.00 0.02 0.00 0.00 55.97 56.47 3m8p s LYS 11 Cb 0.04 0.45 0.13 0.00 -0.52 0.00 0.00 37.83 37.93 3m8p s LYS 11 CO -0.02 -0.24 1.19 -0.51 -0.92 0.00 0.00 175.35 174.85 3m8p s LEU 12 N -0.68 2.26 0.34 3.17 1.43 -1.26 -1.48 118.68 122.46 3m8p s LEU 12 Ca -0.07 0.75 -0.29 0.00 -1.03 0.00 0.00 54.13 53.49 3m8p s LEU 12 Cb -0.02 -3.05 -0.11 0.00 0.03 0.00 0.00 46.19 43.04 3m8p s LEU 12 CO 0.07 -2.42 1.40 -0.54 0.23 0.00 0.00 176.35 175.09 3m8p s LYS 13 N -5.52 4.24 0.11 1.70 1.02 -1.03 -4.40 119.74 115.87 3m8p s LYS 13 Ca 0.65 2.38 -0.21 0.00 0.02 0.00 0.00 55.97 58.81 3m8p s LYS 13 Cb -0.11 -3.03 -0.05 0.00 -0.52 0.00 0.00 37.83 34.12 3m8p s LYS 13 CO 0.52 -0.36 1.14 -2.30 -0.92 0.00 0.00 175.35 173.43 3m8p n PRO 14 N 0.80 -0.30 -0.06 -1.68 -0.01 -1.26 -1.78 135.00 130.70 3m8p n PRO 14 Ca 0.01 1.12 -0.01 0.00 -0.01 0.00 0.00 63.50 64.61 3m8p n PRO 14 Cb 0.40 -1.64 0.01 0.00 -0.01 0.00 0.00 33.50 32.26 3m8p n PRO 14 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3m8p n GLY 15 N -1.17 1.99 3.01 -1.23 0.00 -1.26 -4.90 105.19 101.63 3m8p n GLY 15 Ca 0.01 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 3m8p n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3m8p s MET 16 N -0.43 0.64 0.18 1.61 -1.94 -0.73 -5.14 119.30 113.48 3m8p s MET 16 Ca 0.03 -0.31 0.05 0.00 -1.71 0.00 0.00 55.69 53.76 3m8p s MET 16 Cb 0.03 -0.61 -0.04 0.00 2.01 0.00 0.00 34.83 36.22 3m8p s MET 16 CO 0.01 0.17 0.15 0.34 -0.01 0.00 0.00 175.02 175.67 3m8p s ASP 17 N -0.26 5.53 1.13 3.03 2.15 -1.26 -4.72 116.67 122.26 3m8p s ASP 17 Ca 0.02 -0.14 -0.12 0.00 0.43 0.00 0.00 52.55 52.74 3m8p s ASP 17 Cb -0.03 -1.44 0.26 0.00 -0.30 0.00 0.00 42.92 41.41 3m8p s ASP 17 CO -0.00 0.05 1.05 -0.83 -0.17 0.00 0.00 175.17 175.27 3m8p s GLY 18 N -3.22 1.57 0.45 2.66 0.00 -1.26 -4.97 107.32 102.55 3m8p s GLY 18 Ca 0.31 0.06 -0.13 0.00 0.00 0.00 0.00 44.72 44.96 3m8p s GLY 18 CO 0.24 0.72 0.86 2.56 0.00 0.00 0.00 173.10 177.47 3m8p s PRO 19 N -4.46 3.83 -0.36 2.90 0.04 -1.26 -4.99 135.00 130.71 3m8p s PRO 19 Ca 0.68 0.65 0.13 0.00 0.04 0.00 0.00 61.00 62.51 3m8p s PRO 19 Cb -0.25 -2.29 0.38 0.00 0.04 0.00 0.00 34.50 32.38 3m8p s PRO 19 CO 0.64 -0.14 0.79 1.63 0.04 0.00 0.00 177.00 179.95 3m8p n LYS 20 N -1.45 1.04 -2.90 4.56 5.02 -1.25 -2.03 118.16 121.16 3m8p n LYS 20 Ca 0.04 -3.37 -0.32 0.00 -2.02 0.00 0.00 58.31 52.65 3m8p n LYS 20 Cb 0.54 -1.60 -0.05 0.00 -0.02 0.00 0.00 35.03 33.90 3m8p n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3m8p s VAL 21 N -2.63 4.68 0.03 -0.18 1.01 -0.89 -4.89 120.40 117.53 3m8p s VAL 21 Ca 0.37 0.90 -0.18 0.00 0.00 0.00 0.00 61.98 63.06 3m8p s VAL 21 Cb 0.38 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 3m8p s VAL 21 CO -0.05 -0.40 0.53 -0.75 0.00 0.00 0.00 175.10 174.43 3m8p s LYS 22 N -3.50 4.17 -0.39 2.72 2.20 -1.26 -4.37 119.74 119.31 3m8p s LYS 22 Ca 0.54 0.65 -0.24 0.00 -0.36 0.00 0.00 55.97 56.56 3m8p s LYS 22 Cb -0.10 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 32.97 3m8p s LYS 22 CO 0.24 0.58 0.83 -1.14 -0.36 0.00 0.00 175.35 175.50 3m8p s GLN 23 N -0.85 3.67 0.40 4.03 2.00 -1.26 -4.75 119.66 122.91 3m8p s GLN 23 Ca 0.28 0.26 -0.26 0.00 -2.00 0.00 0.00 55.36 53.64 3m8p s GLN 23 Cb -0.18 -3.85 -0.09 0.00 0.80 0.00 0.00 33.01 29.69 3m8p s GLN 23 CO 0.17 -0.97 1.28 -0.46 -0.50 0.00 0.00 175.29 174.81 3m8p s TRP 24 N 3.29 2.88 0.20 1.67 -0.11 -1.26 -4.92 118.94 120.68 3m8p s TRP 24 Ca 0.33 1.44 -0.31 0.00 1.22 0.00 0.00 56.10 58.78 3m8p s TRP 24 Cb -0.12 -3.62 -0.09 0.00 -1.50 0.00 0.00 33.47 28.13 3m8p s TRP 24 CO 0.20 -1.94 1.43 -2.14 -4.62 0.00 0.00 176.95 169.88 3m8p s PRO 25 N -2.22 4.29 0.33 5.86 0.02 -1.26 -4.93 135.00 137.09 3m8p s PRO 25 Ca 0.56 2.23 0.07 0.00 0.02 0.00 0.00 61.00 63.88 3m8p s PRO 25 Cb -0.37 -3.16 -0.01 0.00 0.02 0.00 0.00 34.50 30.98 3m8p s PRO 25 CO 0.47 -0.43 0.42 -0.51 -0.33 0.00 0.00 177.00 176.63 3m8p s LEU 26 N 0.27 3.93 0.76 -5.54 1.43 -1.26 -5.09 118.68 113.18 3m8p s LEU 26 Ca 0.62 -0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 53.38 3m8p s LEU 26 Cb -0.40 -2.66 0.05 0.00 0.03 0.00 0.00 46.19 43.21 3m8p s LEU 26 CO 0.37 -0.38 1.09 0.28 0.23 0.00 0.00 176.35 177.94 3m8p s THR 27 N -2.18 3.27 0.02 5.49 -1.32 -1.26 -4.62 115.64 115.04 3m8p s THR 27 Ca 0.43 0.41 -0.18 0.00 -1.21 0.00 0.00 61.69 61.15 3m8p s THR 27 Cb -0.09 -3.25 -0.28 0.00 -1.51 0.00 0.00 72.50 67.38 3m8p s THR 27 CO 0.30 -0.54 1.06 -0.33 -2.21 0.00 0.00 174.62 172.90 3m8p h GLU 28 N -0.91 0.51 -0.69 7.08 5.08 -1.99 0.21 114.58 123.86 3m8p h GLU 28 Ca -0.46 -0.67 0.08 0.00 -1.00 0.00 0.00 59.36 57.31 3m8p h GLU 28 Cb 1.26 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.63 3m8p h GLU 28 CO 0.61 1.28 -0.34 0.39 -1.00 0.00 0.00 179.01 179.95 3m8p n GLU 29 N -3.97 -0.23 -0.02 2.33 4.71 -1.26 0.13 120.64 122.33 3m8p n GLU 29 Ca -0.13 1.05 -0.16 0.00 -0.01 0.00 0.00 57.16 57.91 3m8p n GLU 29 Cb 0.87 -1.55 -0.10 0.00 -1.01 0.00 0.00 31.44 29.65 3m8p n GLU 29 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 3m8p h LYS 30 N 0.00 0.43 -0.58 3.49 1.57 -1.82 0.04 116.57 119.70 3m8p h LYS 30 Ca 0.18 -0.38 0.11 0.00 -1.87 0.00 0.00 60.65 58.69 3m8p h LYS 30 Cb 0.35 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.66 3m8p h LYS 30 CO -0.67 1.03 0.05 0.82 -0.57 0.00 0.00 179.45 180.11 3m8p h ILE 31 N -0.04 0.58 -0.21 1.86 2.04 0.03 -0.24 117.51 121.52 3m8p h ILE 31 Ca -0.04 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3m8p h ILE 31 Cb 1.15 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 3m8p h ILE 31 CO 0.10 0.03 0.06 0.50 0.00 0.00 0.00 178.15 178.83 3m8p h LYS 32 N 0.17 0.33 -0.44 2.37 3.64 0.17 -1.67 116.57 121.14 3m8p h LYS 32 Ca 0.30 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3m8p h LYS 32 Cb 0.46 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 3m8p h LYS 32 CO -0.45 0.44 0.25 0.00 -2.27 0.00 0.00 179.45 177.43 3m8p h ALA 33 N 0.87 1.62 -0.05 5.00 0.00 -0.26 -1.53 119.26 124.92 3m8p h ALA 33 Ca 0.07 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3m8p h ALA 33 Cb 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3m8p h ALA 33 CO -0.00 0.33 -0.13 -0.07 0.00 0.00 0.00 179.25 179.38 3m8p h LEU 34 N 0.60 0.19 -0.78 0.00 3.38 -0.59 0.34 115.31 118.46 3m8p h LEU 34 Ca 0.16 -0.61 0.15 0.00 0.09 0.00 0.00 57.88 57.68 3m8p h LEU 34 Cb -0.01 -0.06 -0.10 0.00 0.09 0.00 0.00 40.66 40.59 3m8p h LEU 34 CO -0.03 0.76 0.30 0.58 0.09 0.00 0.00 178.44 180.15 3m8p h VAL 35 N -0.37 0.62 0.26 1.22 2.07 -0.91 1.06 116.25 120.20 3m8p h VAL 35 Ca -0.00 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3m8p h VAL 35 Cb 0.74 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3m8p h VAL 35 CO 0.03 0.08 -0.13 -0.08 0.02 0.00 0.00 177.57 177.49 3m8p h GLU 36 N 0.42 -0.34 -0.48 1.57 4.81 -1.16 -0.85 114.58 118.55 3m8p h GLU 36 Ca 0.44 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.61 3m8p h GLU 36 Cb 0.70 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 3m8p h GLU 36 CO -0.43 -0.17 0.01 0.82 -0.73 0.00 0.00 179.01 178.51 3m8p h ILE 37 N -0.43 1.26 -0.66 2.32 2.04 0.74 -3.06 117.51 119.73 3m8p h ILE 37 Ca -0.04 -1.05 -0.06 0.00 1.00 0.00 0.00 64.86 64.72 3m8p h ILE 37 Cb 0.33 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3m8p h ILE 37 CO 0.06 0.37 0.19 0.00 0.00 0.00 0.00 178.15 178.76 3m8p h THR 39 N 0.98 0.36 -0.96 0.00 2.02 -1.09 0.31 112.91 114.54 3m8p h THR 39 Ca 0.21 -0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.59 3m8p h THR 39 Cb 0.30 0.36 -0.11 0.00 -1.74 0.00 0.00 68.15 66.96 3m8p h THR 39 CO -0.00 0.00 0.54 -0.33 0.37 0.00 0.00 175.52 176.09 3m8p h GLU 40 N -0.88 0.61 -0.31 6.66 5.08 -1.49 0.21 114.58 124.46 3m8p h GLU 40 Ca -0.09 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 3m8p h GLU 40 Cb 0.67 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 3m8p h GLU 40 CO 0.15 0.40 -0.24 0.52 -1.00 0.00 0.00 179.01 178.84 3m8p h MET 41 N 0.63 0.71 -0.55 2.33 2.86 -1.19 -2.72 114.93 117.00 3m8p h MET 41 Ca 0.57 -0.35 0.09 0.00 -2.06 0.00 0.00 59.70 57.95 3m8p h MET 41 Cb 0.96 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.55 3m8p h MET 41 CO -0.43 0.96 0.16 1.49 1.06 0.00 0.00 176.91 180.15 3m8p h GLU 42 N 0.46 0.30 0.00 1.72 4.81 0.24 -1.44 114.58 120.68 3m8p h GLU 42 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3m8p h GLU 42 Cb 0.80 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 3m8p h GLU 42 CO 0.06 0.20 -0.03 0.87 -0.73 0.00 0.00 179.01 179.39 3m8p h LYS 43 N 0.31 0.00 -0.47 1.92 1.57 -0.63 -1.52 116.57 117.75 3m8p h LYS 43 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3m8p h LYS 43 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3m8p h LYS 43 CO -0.32 0.03 0.00 0.39 -0.57 0.00 0.00 179.45 178.98 3m8p n GLU 44 N -3.39 2.52 -0.70 3.15 1.02 -0.63 -4.96 120.64 117.65 3m8p n GLU 44 Ca -0.02 -2.29 0.00 0.00 -0.02 0.00 0.00 57.16 54.83 3m8p n GLU 44 Cb 0.14 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 3m8p n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m8p n GLY 45 N 1.29 0.68 0.12 0.62 0.00 -0.57 -4.92 105.19 102.40 3m8p n GLY 45 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 3m8p n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m8p h LYS 46 N 2.15 0.26 -4.72 1.61 1.79 -1.52 -3.43 116.57 112.71 3m8p h LYS 46 Ca 0.00 -0.35 -0.27 0.00 -2.18 0.00 0.00 60.65 57.84 3m8p h LYS 46 Cb 0.00 0.12 -0.18 0.00 -1.58 0.00 0.00 32.23 30.58 3m8p h LYS 46 CO 0.00 1.11 -0.72 0.96 -1.08 0.00 0.00 179.45 179.71 3m8p s ILE 47 N -2.94 0.71 -0.01 1.86 -4.36 -1.24 -1.77 121.20 113.44 3m8p s ILE 47 Ca -0.04 -1.50 0.05 0.00 -0.26 0.00 0.00 60.65 58.91 3m8p s ILE 47 Cb 0.08 -1.15 -0.01 0.00 1.25 0.00 0.00 42.46 42.63 3m8p s ILE 47 CO 0.86 -0.58 -0.16 -0.44 0.24 0.00 0.00 174.94 174.86 3m8p s SER 48 N -2.26 1.94 0.43 4.36 0.01 -0.58 -4.29 113.70 113.31 3m8p s SER 48 Ca 0.01 -0.30 -0.26 0.00 1.31 0.00 0.00 55.95 56.71 3m8p s SER 48 Cb -0.03 -0.24 -0.09 0.00 0.21 0.00 0.00 66.02 65.87 3m8p s SER 48 CO -0.01 0.20 1.36 0.29 0.41 0.00 0.00 173.24 175.48 3m8p n LYS 49 N 2.71 2.11 -4.22 12.44 5.02 -1.26 -1.88 118.16 133.08 3m8p n LYS 49 Ca -0.15 0.75 -0.13 0.00 -2.02 0.00 0.00 58.31 56.76 3m8p n LYS 49 Cb 0.54 -2.51 -0.10 0.00 -0.02 0.00 0.00 35.03 32.94 3m8p n LYS 49 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3m8p s ILE 50 N -1.19 0.04 0.00 -0.18 -4.36 0.17 -4.89 121.20 110.79 3m8p s ILE 50 Ca 0.61 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.00 3m8p s ILE 50 Cb -0.48 -2.51 0.00 0.00 1.25 0.00 0.00 42.46 40.72 3m8p s ILE 50 CO 0.58 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.37 3m8p n GLY 51 N -0.32 0.57 0.13 6.27 0.00 -1.26 -4.40 105.19 106.18 3m8p n GLY 51 Ca 0.02 -1.56 0.02 0.00 0.00 0.00 0.00 46.02 44.50 3m8p n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3m8p n PRO 52 N 0.00 -0.27 0.13 1.61 -0.04 -1.26 -4.36 135.00 130.80 3m8p n PRO 52 Ca 0.00 -0.77 0.02 0.00 -0.04 0.00 0.00 63.50 62.72 3m8p n PRO 52 Cb 0.00 -1.06 0.39 0.00 -0.04 0.00 0.00 33.50 32.79 3m8p n PRO 52 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3m8p h GLU 53 N 0.59 0.21 -6.18 0.54 -0.00 -2.03 -3.41 114.58 104.30 3m8p h GLU 53 Ca 0.00 -0.05 -0.57 0.00 -0.00 0.00 0.00 59.36 58.74 3m8p h GLU 53 Cb 0.16 -0.03 -0.04 0.00 -0.00 0.00 0.00 28.75 28.84 3m8p h GLU 53 CO 0.00 0.38 0.77 1.21 -0.00 0.00 0.00 179.01 181.37 3m8p s ASN 54 N -6.89 7.07 0.00 3.06 3.84 -1.26 -4.88 114.94 115.88 3m8p s ASN 54 Ca -0.05 1.59 0.23 0.00 0.21 0.00 0.00 52.86 54.83 3m8p s ASN 54 Cb 0.15 -2.55 0.60 0.00 -0.55 0.00 0.00 41.25 38.91 3m8p s ASN 54 CO 0.73 -0.65 1.51 -0.81 -2.79 0.00 0.00 177.10 175.10 3m8p n PRO 55 N 5.98 2.69 -3.94 0.43 -0.04 -1.26 -4.97 135.00 133.88 3m8p n PRO 55 Ca 0.12 -2.59 -0.31 0.00 -0.04 0.00 0.00 63.50 60.67 3m8p n PRO 55 Cb 0.46 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 3m8p n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3m8p s TYR 56 N -1.09 3.47 -0.07 0.54 2.02 -1.26 -4.84 117.35 116.11 3m8p s TYR 56 Ca 0.47 0.24 -0.22 0.00 -0.37 0.00 0.00 57.07 57.19 3m8p s TYR 56 Cb 0.25 -1.75 0.05 0.00 -0.40 0.00 0.00 41.96 40.11 3m8p s TYR 56 CO 0.33 0.59 0.50 1.21 -1.57 0.00 0.00 175.55 176.61 3m8p s ASN 57 N -2.36 -0.45 0.13 2.29 2.47 -0.86 -4.50 114.94 111.65 3m8p s ASN 57 Ca 0.32 0.55 0.03 0.00 0.42 0.00 0.00 52.86 54.18 3m8p s ASN 57 Cb -0.13 0.57 -0.04 0.00 -1.45 0.00 0.00 41.25 40.20 3m8p s ASN 57 CO 0.25 -0.45 -0.06 -0.89 -3.72 0.00 0.00 177.10 172.23 3m8p s THR 58 N -0.92 0.84 0.35 -5.21 2.01 -0.84 -2.09 115.64 109.78 3m8p s THR 58 Ca -0.10 -1.98 -0.08 0.00 0.31 0.00 0.00 61.69 59.84 3m8p s THR 58 Cb -0.03 -1.83 -0.06 0.00 0.01 0.00 0.00 72.50 70.59 3m8p s THR 58 CO 0.06 -0.75 0.67 -2.84 -0.69 0.00 0.00 174.62 171.07 3m8p s PRO 59 N -3.83 3.71 0.05 4.92 0.02 -1.26 -4.03 135.00 134.58 3m8p s PRO 59 Ca 0.16 0.25 0.05 0.00 0.02 0.00 0.00 61.00 61.48 3m8p s PRO 59 Cb 0.05 -2.51 -0.02 0.00 0.02 0.00 0.00 34.50 32.04 3m8p s PRO 59 CO -0.01 0.08 -0.15 0.08 -0.33 0.00 0.00 177.00 176.67 3m8p s VAL 60 N -2.24 1.16 0.24 3.83 1.01 -1.26 -2.03 120.40 121.11 3m8p s VAL 60 Ca 0.48 -1.09 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 3m8p s VAL 60 Cb -0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 3m8p s VAL 60 CO 0.31 -0.03 0.32 0.12 0.00 0.00 0.00 175.10 175.82 3m8p s PHE 61 N -0.94 0.84 -0.07 5.22 2.19 -0.21 -4.94 117.98 120.08 3m8p s PHE 61 Ca 0.01 -1.11 -0.05 0.00 0.33 0.00 0.00 56.93 56.12 3m8p s PHE 61 Cb -0.08 -0.20 0.03 0.00 -1.31 0.00 0.00 43.02 41.46 3m8p s PHE 61 CO 0.02 -0.86 0.17 0.00 1.83 0.00 0.00 175.22 176.38 3m8p s ALA 62 N -3.93 -0.39 0.14 11.12 0.00 -1.26 -1.56 121.76 125.88 3m8p s ALA 62 Ca 0.31 0.62 0.10 0.00 0.00 0.00 0.00 51.96 53.00 3m8p s ALA 62 Cb 0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.72 3m8p s ALA 62 CO 0.13 -0.12 -0.24 -1.50 0.00 0.00 0.00 175.76 174.02 3m8p s ILE 63 N 0.62 2.08 0.00 0.00 2.07 -1.02 -4.96 121.20 119.99 3m8p s ILE 63 Ca -0.04 -1.76 0.00 0.00 -1.41 0.00 0.00 60.65 57.43 3m8p s ILE 63 Cb -0.06 -1.88 0.00 0.00 0.13 0.00 0.00 42.46 40.65 3m8p s ILE 63 CO -0.03 -0.03 0.00 0.29 -1.91 0.00 0.00 174.94 173.26 3m8p n LYS 64 N 0.78 0.16 0.00 3.50 4.76 -1.26 -1.71 118.16 124.39 3m8p n LYS 64 Ca -0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 3m8p n LYS 64 Cb 0.54 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.73 3m8p n LYS 64 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 3m8p n THR 69 N -1.63 0.00 -3.81 -0.18 -1.04 -1.26 -4.93 114.28 101.42 3m8p n THR 69 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 3m8p n THR 69 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 3m8p n THR 69 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3m8p s LYS 70 N -0.16 1.23 0.61 -2.82 -0.14 -1.26 -5.18 119.74 112.02 3m8p s LYS 70 Ca 0.00 -0.97 -0.19 0.00 -1.36 0.00 0.00 55.97 53.46 3m8p s LYS 70 Cb 0.00 0.45 -0.03 0.00 -1.68 0.00 0.00 37.83 36.57 3m8p s LYS 70 CO 0.00 -0.49 1.24 -1.58 -0.76 0.00 0.00 175.35 173.76 3m8p s TRP 71 N -3.90 2.30 -0.01 3.18 0.52 -1.26 -5.04 118.94 114.73 3m8p s TRP 71 Ca 0.11 1.50 -0.00 0.00 0.02 0.00 0.00 56.10 57.73 3m8p s TRP 71 Cb 0.01 -3.55 0.01 0.00 -1.15 0.00 0.00 33.47 28.79 3m8p s TRP 71 CO -0.03 -2.44 0.02 1.03 0.02 0.00 0.00 176.95 175.55 3m8p s ARG 72 N -3.32 -0.00 -0.08 4.98 0.52 -0.69 -5.01 118.95 115.34 3m8p s ARG 72 Ca 0.79 0.08 -0.29 0.00 -0.52 0.00 0.00 55.73 55.79 3m8p s ARG 72 Cb -0.33 -0.08 -0.02 0.00 0.52 0.00 0.00 34.95 35.04 3m8p s ARG 72 CO 0.35 -0.06 0.95 0.21 0.02 0.00 0.00 175.30 176.78 3m8p s LYS 73 N 0.38 4.44 -0.26 3.54 2.20 -1.26 -2.43 119.74 126.35 3m8p s LYS 73 Ca -0.03 1.31 0.01 0.00 -0.36 0.00 0.00 55.97 56.90 3m8p s LYS 73 Cb -0.05 -3.52 0.05 0.00 -1.51 0.00 0.00 37.83 32.81 3m8p s LYS 73 CO -0.01 -0.22 -0.08 -1.17 -0.36 0.00 0.00 175.35 173.51 3m8p s LEU 74 N 1.68 3.44 0.07 5.43 2.96 -0.60 -4.98 118.68 126.67 3m8p s LEU 74 Ca 0.47 -1.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.14 3m8p s LEU 74 Cb -0.19 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 3m8p s LEU 74 CO 0.20 -0.19 0.18 -0.69 -1.32 0.00 0.00 176.35 174.53 3m8p s VAL 75 N 1.18 5.20 -0.44 1.68 1.01 -1.26 -1.04 120.40 126.72 3m8p s VAL 75 Ca -0.06 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 3m8p s VAL 75 Cb -0.19 -3.53 0.12 0.00 0.00 0.00 0.00 36.38 32.77 3m8p s VAL 75 CO -0.04 0.13 0.28 -0.62 0.00 0.00 0.00 175.10 174.85 3m8p s ASP 76 N -2.49 5.47 -0.28 3.32 3.68 -0.86 -4.91 116.67 120.60 3m8p s ASP 76 Ca 0.34 -2.00 0.06 0.00 2.13 0.00 0.00 52.55 53.07 3m8p s ASP 76 Cb -0.13 -1.91 0.56 0.00 -1.45 0.00 0.00 42.92 39.99 3m8p s ASP 76 CO 0.27 -0.61 1.61 0.49 0.13 0.00 0.00 175.17 177.06 3m8p n PHE 77 N 4.71 2.08 0.09 -5.34 3.01 -1.26 -4.35 117.46 116.40 3m8p n PHE 77 Ca -0.04 -1.17 -0.12 0.00 1.01 0.00 0.00 57.45 57.12 3m8p n PHE 77 Cb 0.41 -0.65 -0.05 0.00 -0.01 0.00 0.00 39.48 39.18 3m8p n PHE 77 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3m8p h ARG 78 N 1.62 -0.48 -0.08 -1.08 3.08 -1.90 0.24 114.38 115.78 3m8p h ARG 78 Ca 0.31 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 3m8p h ARG 78 Cb 2.14 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 32.30 3m8p h ARG 78 CO 0.68 -0.32 0.05 0.93 -1.07 0.00 0.00 179.97 180.24 3m8p h GLU 79 N -0.49 0.12 -0.68 0.04 4.39 -1.99 -2.36 114.58 113.61 3m8p h GLU 79 Ca 0.05 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.69 3m8p h GLU 79 Cb 0.55 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 3m8p h GLU 79 CO -0.22 0.14 0.27 1.25 -1.16 0.00 0.00 179.01 179.29 3m8p h LEU 80 N 0.06 0.93 0.48 1.33 5.85 -1.81 -0.70 115.31 121.45 3m8p h LEU 80 Ca 0.03 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 3m8p h LEU 80 Cb 0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3m8p h LEU 80 CO -0.01 0.85 -0.37 0.78 -0.34 0.00 0.00 178.44 179.35 3m8p h ASN 81 N 0.96 -0.97 -0.54 1.25 4.21 -0.51 0.49 115.58 120.48 3m8p h ASN 81 Ca 0.23 0.07 0.16 0.00 1.21 0.00 0.00 56.30 57.96 3m8p h ASN 81 Cb 0.21 0.31 -0.02 0.00 -1.12 0.00 0.00 38.32 37.69 3m8p h ASN 81 CO -0.02 -0.54 0.69 0.50 -1.29 0.00 0.00 177.43 176.77 3m8p h LYS 82 N -0.84 0.00 -0.43 0.81 3.64 -1.34 -1.10 116.57 117.32 3m8p h LYS 82 Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3m8p h LYS 82 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 3m8p h LYS 82 CO 0.00 0.00 0.00 0.54 -2.27 0.00 0.00 179.45 177.72 3m8p n ARG 83 N -3.43 2.51 -4.27 1.90 1.74 -0.15 -4.96 116.66 110.00 3m8p n ARG 83 Ca 0.11 -2.17 -0.29 0.00 -0.77 0.00 0.00 57.85 54.73 3m8p n ARG 83 Cb 0.88 -1.39 -0.10 0.00 -1.02 0.00 0.00 32.46 30.83 3m8p n ARG 83 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 3m8p s THR 84 N -1.09 3.14 0.80 0.55 -1.32 -0.02 -2.45 115.64 115.24 3m8p s THR 84 Ca 0.32 -1.48 -0.16 0.00 -1.21 0.00 0.00 61.69 59.16 3m8p s THR 84 Cb 0.18 -2.49 -0.08 0.00 -1.51 0.00 0.00 72.50 68.60 3m8p s THR 84 CO 0.24 0.03 0.02 0.00 -2.21 0.00 0.00 174.62 172.69 3m8p n GLN 85 N 0.50 0.06 -1.85 7.08 10.64 -0.55 -4.51 117.38 128.75 3m8p n GLN 85 Ca -0.13 0.04 -0.30 0.00 -1.83 0.00 0.00 57.00 54.79 3m8p n GLN 85 Cb 0.53 -1.45 0.07 0.00 -0.86 0.00 0.00 30.24 28.53 3m8p n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3m8p s ASP 86 N -1.35 4.98 0.22 2.61 1.01 -1.26 -4.96 116.67 117.92 3m8p s ASP 86 Ca 0.55 1.02 0.00 0.00 0.71 0.00 0.00 52.55 54.83 3m8p s ASP 86 Cb -0.31 -1.70 -0.04 0.00 1.01 0.00 0.00 42.92 41.88 3m8p s ASP 86 CO 0.68 -1.63 0.11 -0.36 0.21 0.00 0.00 175.17 174.18 3m8p s PHE 87 N -3.42 1.30 0.30 4.23 0.08 -1.26 -5.09 117.98 114.12 3m8p s PHE 87 Ca 0.60 -1.28 -0.29 0.00 0.12 0.00 0.00 56.93 56.08 3m8p s PHE 87 Cb -0.11 -0.70 -0.10 0.00 -0.57 0.00 0.00 43.02 41.54 3m8p s PHE 87 CO 0.51 -0.50 1.19 -0.46 -0.10 0.00 0.00 175.22 175.86 3m8p s TRP 88 N -3.97 3.35 0.34 0.36 -0.00 -1.26 -4.95 118.94 112.81 3m8p s TRP 88 Ca 0.37 1.58 -0.29 0.00 -0.00 0.00 0.00 56.10 57.76 3m8p s TRP 88 Cb 0.07 -3.45 -0.11 0.00 -0.00 0.00 0.00 33.47 29.98 3m8p s TRP 88 CO 0.12 -1.11 1.52 -1.21 -0.00 0.00 0.00 176.95 176.28 3m8p s GLU 89 N -1.60 4.12 0.00 5.86 8.01 -1.26 -4.90 118.70 128.93 3m8p s GLU 89 Ca 0.46 2.57 0.00 0.00 0.01 0.00 0.00 54.97 58.01 3m8p s GLU 89 Cb -0.35 -2.99 0.00 0.00 -4.31 0.00 0.00 34.13 26.48 3m8p s GLU 89 CO 0.46 -0.56 0.00 0.28 0.01 0.00 0.00 175.26 175.45 3m8p n VAL 90 N 1.13 0.00 -4.11 2.63 0.31 -1.26 -4.75 118.33 112.28 3m8p n VAL 90 Ca 0.04 0.29 -0.36 0.00 -0.01 0.00 0.00 64.34 64.29 3m8p n VAL 90 Cb 0.39 -1.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.24 3m8p n VAL 90 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3m8p s GLN 91 N 0.00 3.26 0.20 5.55 -1.52 -1.26 -4.98 119.66 120.90 3m8p s GLN 91 Ca 0.00 -0.26 0.26 0.00 -1.95 0.00 0.00 55.36 53.41 3m8p s GLN 91 Cb 0.00 -3.01 0.73 0.00 -0.22 0.00 0.00 33.01 30.50 3m8p s GLN 91 CO 0.00 0.73 1.70 1.28 -0.25 0.00 0.00 175.29 178.75 3m8p n LEU 92 N 2.11 0.81 0.00 2.90 4.77 -1.26 -4.95 117.00 121.38 3m8p n LEU 92 Ca -0.19 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3m8p n LEU 92 Cb 0.54 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3m8p n LEU 92 CO 0.30 -0.16 0.02 0.61 -1.33 0.00 0.00 177.39 176.83 3m8p n GLY 93 N 1.31 0.88 2.99 -0.72 0.00 -1.26 -5.16 105.19 103.23 3m8p n GLY 93 Ca 0.05 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 3m8p n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m8p s ILE 94 N -2.31 0.84 0.75 -0.61 1.01 -1.26 -5.12 121.20 114.51 3m8p s ILE 94 Ca 0.01 -0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.16 3m8p s ILE 94 Cb -0.00 -0.77 0.05 0.00 0.01 0.00 0.00 42.46 41.75 3m8p s ILE 94 CO 0.00 0.27 1.16 -2.84 0.00 0.00 0.00 174.94 173.53 3m8p s PRO 95 N 0.42 2.11 -0.09 2.79 0.02 -1.26 -5.01 135.00 133.97 3m8p s PRO 95 Ca -0.07 1.57 0.00 0.00 0.02 0.00 0.00 61.00 62.51 3m8p s PRO 95 Cb -0.11 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 3m8p s PRO 95 CO 0.01 -1.82 -0.08 -1.58 -0.33 0.00 0.00 177.00 173.20 3m8p s HIS 96 N -2.30 2.91 0.28 6.54 2.46 -1.26 -5.02 115.29 118.90 3m8p s HIS 96 Ca 0.70 -0.16 0.02 0.00 0.47 0.00 0.00 55.06 56.08 3m8p s HIS 96 Cb -0.25 -1.77 0.61 0.00 -0.13 0.00 0.00 32.58 31.04 3m8p s HIS 96 CO 0.48 0.16 1.79 -1.35 -2.47 0.00 0.00 174.74 173.35 3m8p h PRO 97 N 5.76 0.75 -0.33 2.88 0.11 -1.96 0.63 132.00 139.84 3m8p h PRO 97 Ca -0.41 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 65.75 3m8p h PRO 97 Cb 1.18 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3m8p h PRO 97 CO 0.55 0.49 0.58 0.00 -0.21 0.00 0.00 178.00 179.41 3m8p h ALA 98 N 1.58 1.98 -0.01 -0.75 0.00 -1.82 0.26 119.26 120.50 3m8p h ALA 98 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 3m8p h ALA 98 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3m8p h ALA 98 CO -0.34 -0.75 -0.54 0.41 0.00 0.00 0.00 179.25 178.03 3m8p n GLY 99 N -1.44 -0.77 3.88 0.00 0.00 0.22 -3.87 105.19 103.21 3m8p n GLY 99 Ca 0.06 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 3m8p n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m8p s LEU 100 N -2.76 3.88 0.25 0.99 1.43 0.91 -4.73 118.68 118.65 3m8p s LEU 100 Ca 0.15 1.10 -0.03 0.00 -1.03 0.00 0.00 54.13 54.32 3m8p s LEU 100 Cb 0.18 -3.96 -0.05 0.00 0.03 0.00 0.00 46.19 42.39 3m8p s LEU 100 CO 0.66 -0.35 0.48 -0.54 0.23 0.00 0.00 176.35 176.83 3m8p s LYS 101 N -3.71 3.59 0.61 1.70 1.02 -1.26 -0.33 119.74 121.35 3m8p s LYS 101 Ca 0.51 -0.14 -0.15 0.00 0.02 0.00 0.00 55.97 56.21 3m8p s LYS 101 Cb -0.10 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 3m8p s LYS 101 CO 0.30 0.30 1.05 -1.59 -0.92 0.00 0.00 175.35 174.49 3m8p s LYS 102 N -3.40 3.29 0.01 1.68 -2.85 -1.26 -4.89 119.74 112.32 3m8p s LYS 102 Ca 0.42 1.14 0.01 0.00 -1.00 0.00 0.00 55.97 56.53 3m8p s LYS 102 Cb -0.11 -2.03 -0.01 0.00 -2.06 0.00 0.00 37.83 33.62 3m8p s LYS 102 CO 0.29 -0.82 -0.04 0.15 0.10 0.00 0.00 175.35 175.03 3m8p s LYS 103 N -4.26 0.28 -0.03 1.78 -0.14 -0.83 -4.90 119.74 111.64 3m8p s LYS 103 Ca 0.62 -0.32 -0.19 0.00 -1.36 0.00 0.00 55.97 54.72 3m8p s LYS 103 Cb -0.15 -0.15 -0.33 0.00 -1.68 0.00 0.00 37.83 35.53 3m8p s LYS 103 CO 0.40 0.03 0.90 -0.22 -0.76 0.00 0.00 175.35 175.70 3m8p h LYS 104 N 5.50 0.38 -3.44 1.68 3.64 -1.70 -3.41 116.57 119.22 3m8p h LYS 104 Ca -0.29 -0.64 -0.16 0.00 -1.27 0.00 0.00 60.65 58.29 3m8p h LYS 104 Cb 1.20 0.24 -0.22 0.00 -0.41 0.00 0.00 32.23 33.04 3m8p h LYS 104 CO 0.47 1.31 -0.49 -1.54 -2.27 0.00 0.00 179.45 176.92 3m8p s SER 105 N -7.18 -0.04 0.05 4.20 1.04 -0.59 -4.94 113.70 106.23 3m8p s SER 105 Ca -0.13 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.29 3m8p s SER 105 Cb 0.02 0.25 -0.03 0.00 0.10 0.00 0.00 66.02 66.37 3m8p s SER 105 CO 0.86 -0.28 -0.06 0.68 0.98 0.00 0.00 173.24 175.43 3m8p s VAL 106 N -0.93 0.42 -0.11 5.02 -7.23 -1.26 -1.85 120.40 114.45 3m8p s VAL 106 Ca -0.10 -1.33 -0.08 0.00 -1.81 0.00 0.00 61.98 58.67 3m8p s VAL 106 Cb -0.06 -0.89 0.04 0.00 0.56 0.00 0.00 36.38 36.04 3m8p s VAL 106 CO 0.01 -0.61 0.28 -0.89 -0.31 0.00 0.00 175.10 173.58 3m8p s THR 107 N -2.25 -0.02 -0.31 5.32 2.01 0.73 -4.91 115.64 116.21 3m8p s THR 107 Ca -0.04 0.08 -0.02 0.00 0.31 0.00 0.00 61.69 62.01 3m8p s THR 107 Cb -0.04 -0.41 0.05 0.00 0.01 0.00 0.00 72.50 72.11 3m8p s THR 107 CO -0.03 0.03 0.02 -0.69 -0.69 0.00 0.00 174.62 173.27 3m8p s VAL 108 N 0.80 3.05 0.01 3.82 1.01 -1.26 0.13 120.40 127.95 3m8p s VAL 108 Ca -0.05 -1.42 -0.01 0.00 0.00 0.00 0.00 61.98 60.49 3m8p s VAL 108 Cb -0.06 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 3m8p s VAL 108 CO -0.05 -0.15 0.15 -0.76 0.00 0.00 0.00 175.10 174.28 3m8p s LEU 109 N 1.25 4.20 -0.13 3.92 1.43 -0.62 -4.63 118.68 124.10 3m8p s LEU 109 Ca -0.04 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 3m8p s LEU 109 Cb -0.20 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.47 3m8p s LEU 109 CO -0.01 0.24 -0.21 -0.62 0.23 0.00 0.00 176.35 175.98 3m8p s ASP 110 N -2.01 2.97 -0.06 2.29 3.68 -1.26 -0.80 116.67 121.49 3m8p s ASP 110 Ca 0.27 -0.56 -0.26 0.00 2.13 0.00 0.00 52.55 54.13 3m8p s ASP 110 Cb -0.12 -1.37 -0.03 0.00 -1.45 0.00 0.00 42.92 39.95 3m8p s ASP 110 CO 0.19 0.08 0.84 -0.69 0.13 0.00 0.00 175.17 175.72 3m8p s VAL 111 N 0.78 4.95 0.14 1.11 1.01 0.53 -3.99 120.40 124.93 3m8p s VAL 111 Ca -0.09 1.73 -0.19 0.00 0.00 0.00 0.00 61.98 63.43 3m8p s VAL 111 Cb -0.16 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 31.98 3m8p s VAL 111 CO -0.00 0.18 0.63 -0.83 0.00 0.00 0.00 175.10 175.08 3m8p s GLY 112 N 0.94 2.64 -0.60 4.51 0.00 -0.92 -4.15 107.32 109.74 3m8p s GLY 112 Ca 0.44 0.08 -0.10 0.00 0.00 0.00 0.00 44.72 45.13 3m8p s GLY 112 CO 0.21 0.46 0.37 1.22 0.00 0.00 0.00 173.10 175.37 3m8p n ASP 113 N 1.22 -2.61 0.19 1.64 9.92 -1.26 -4.64 116.55 121.01 3m8p n ASP 113 Ca -0.06 -0.67 -0.15 0.00 -0.53 0.00 0.00 54.79 53.38 3m8p n ASP 113 Cb 0.51 -0.93 -0.08 0.00 -0.64 0.00 0.00 41.12 39.98 3m8p n ASP 113 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3m8p h ALA 114 N 1.71 -0.42 -0.36 2.24 0.00 -1.98 -2.18 119.26 118.26 3m8p h ALA 114 Ca -0.40 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 3m8p h ALA 114 Cb 0.83 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3m8p h ALA 114 CO 0.26 -0.73 -0.00 1.88 0.00 0.00 0.00 179.25 180.66 3m8p h TYR 115 N -0.45 0.70 0.00 0.00 0.99 -1.88 -2.56 116.97 113.77 3m8p h TYR 115 Ca -0.04 -0.12 0.00 0.00 2.00 0.00 0.00 58.73 60.56 3m8p h TYR 115 Cb 0.34 -0.18 0.00 0.00 1.00 0.00 0.00 36.73 37.89 3m8p h TYR 115 CO -0.05 0.74 0.00 0.74 -0.00 0.00 0.00 178.16 179.59 3m8p h PHE 116 N 0.46 0.00 -0.18 4.88 0.04 -1.66 -1.00 116.94 119.49 3m8p h PHE 116 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3m8p h PHE 116 Cb 0.46 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.61 3m8p h PHE 116 CO 0.04 0.00 0.00 0.43 -0.60 0.00 0.00 178.31 178.18 3m8p n SER 117 N -2.68 1.25 -3.90 2.17 7.64 -0.84 -4.78 113.62 112.49 3m8p n SER 117 Ca -0.00 -2.05 -0.19 0.00 1.01 0.00 0.00 58.87 57.64 3m8p n SER 117 Cb 0.16 -0.21 -0.16 0.00 -1.01 0.00 0.00 64.21 62.99 3m8p n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3m8p s VAL 118 N -1.69 0.47 0.47 0.44 1.01 -0.38 -1.87 120.40 118.85 3m8p s VAL 118 Ca 0.13 -0.11 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 3m8p s VAL 118 Cb 0.07 -0.49 -0.09 0.00 0.00 0.00 0.00 36.38 35.88 3m8p s VAL 118 CO 0.07 0.20 1.04 -2.16 0.00 0.00 0.00 175.10 174.25 3m8p s PRO 119 N 0.74 3.88 -0.07 2.72 0.04 -1.26 -1.70 135.00 139.36 3m8p s PRO 119 Ca -0.09 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.18 3m8p s PRO 119 Cb -0.13 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 3m8p s PRO 119 CO -0.00 -0.36 0.37 -1.17 0.04 0.00 0.00 177.00 175.88 3m8p s LEU 120 N -3.32 4.38 -0.46 -3.56 2.96 -0.58 -4.66 118.68 113.44 3m8p s LEU 120 Ca 0.65 0.79 -0.45 0.00 -0.22 0.00 0.00 54.13 54.91 3m8p s LEU 120 Cb -0.17 -2.51 -0.19 0.00 0.50 0.00 0.00 46.19 43.82 3m8p s LEU 120 CO 0.21 0.22 1.80 -0.67 -1.32 0.00 0.00 176.35 176.59 3m8p n ASP 121 N 2.55 1.32 -0.36 3.68 2.03 -1.26 -4.79 116.55 119.72 3m8p n ASP 121 Ca -0.13 1.00 0.02 0.00 0.52 0.00 0.00 54.79 56.20 3m8p n ASP 121 Cb 0.52 -0.95 0.09 0.00 -0.72 0.00 0.00 41.12 40.07 3m8p n ASP 121 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3m8p h GLU 122 N 6.79 -0.01 -0.08 -0.67 5.08 -1.95 0.47 114.58 124.22 3m8p h GLU 122 Ca -0.35 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.04 3m8p h GLU 122 Cb 1.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 3m8p h GLU 122 CO 1.01 -0.00 0.30 -0.44 -1.00 0.00 0.00 179.01 178.87 3m8p h ASP 123 N -0.01 0.00 0.03 1.42 3.45 -1.96 -1.66 116.42 117.69 3m8p h ASP 123 Ca 0.41 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.87 3m8p h ASP 123 Cb 0.66 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.43 3m8p h ASP 123 CO -0.99 0.00 -1.78 0.33 -1.57 0.00 0.00 179.24 175.24 3m8p n PHE 124 N -3.11 0.03 -0.35 4.55 -0.00 0.16 -4.49 117.46 114.25 3m8p n PHE 124 Ca -0.00 0.01 0.01 0.00 -0.00 0.00 0.00 57.45 57.46 3m8p n PHE 124 Cb 0.37 -0.42 0.15 0.00 -0.00 0.00 0.00 39.48 39.58 3m8p n PHE 124 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3m8p h ARG 125 N 0.00 1.10 -0.94 -4.13 3.08 -0.97 -1.21 114.38 111.32 3m8p h ARG 125 Ca 0.00 -0.07 0.21 0.00 0.07 0.00 0.00 59.98 60.20 3m8p h ARG 125 Cb 0.90 -0.25 -0.18 0.00 0.08 0.00 0.00 29.97 30.53 3m8p h ARG 125 CO 0.00 0.73 -0.13 1.57 -1.07 0.00 0.00 179.97 181.07 3m8p h LYS 126 N 1.14 0.01 0.00 0.04 2.10 -1.79 -0.05 116.57 118.02 3m8p h LYS 126 Ca 0.39 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.04 3m8p h LYS 126 Cb 0.09 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 3m8p h LYS 126 CO -0.15 0.01 0.00 0.66 -2.00 0.00 0.00 179.45 177.97 3m8p n TYR 127 N -5.54 0.00 0.85 0.07 4.01 -0.45 -1.98 117.16 114.11 3m8p n TYR 127 Ca 0.17 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 58.00 3m8p n TYR 127 Cb 0.57 -0.43 0.25 0.00 -0.31 0.00 0.00 39.34 39.41 3m8p n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3m8p n THR 128 N -1.43 0.43 -1.74 -0.72 -2.24 -0.03 -4.73 114.28 103.82 3m8p n THR 128 Ca 0.05 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 3m8p n THR 128 Cb 0.17 0.35 -0.01 0.00 -2.10 0.00 0.00 70.33 68.74 3m8p n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m8p n ALA 129 N 0.62 2.08 -2.30 6.98 0.00 -0.84 -4.43 120.51 122.62 3m8p n ALA 129 Ca 0.15 0.36 -0.18 0.00 0.00 0.00 0.00 53.44 53.76 3m8p n ALA 129 Cb 0.36 -2.38 -0.09 0.00 0.00 0.00 0.00 19.45 17.34 3m8p n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3m8p s PHE 130 N -0.79 1.59 -0.03 0.00 -0.71 0.16 -1.98 117.98 116.20 3m8p s PHE 130 Ca 0.57 -1.47 -0.01 0.00 -1.04 0.00 0.00 56.93 54.98 3m8p s PHE 130 Cb -0.51 -0.77 0.03 0.00 -1.21 0.00 0.00 43.02 40.55 3m8p s PHE 130 CO 0.59 -0.65 0.03 0.99 -1.34 0.00 0.00 175.22 174.84 3m8p s THR 131 N -3.63 0.01 -0.32 -4.49 2.01 -1.26 -2.87 115.64 105.10 3m8p s THR 131 Ca 0.37 0.27 -0.22 0.00 0.31 0.00 0.00 61.69 62.42 3m8p s THR 131 Cb 0.04 -0.19 -0.00 0.00 0.01 0.00 0.00 72.50 72.36 3m8p s THR 131 CO 0.20 0.15 0.71 -0.63 -0.69 0.00 0.00 174.62 174.36 3m8p s ILE 132 N 1.59 4.86 0.41 1.82 1.01 -0.06 -4.74 121.20 126.08 3m8p s ILE 132 Ca -0.02 0.97 -0.23 0.00 0.00 0.00 0.00 60.65 61.37 3m8p s ILE 132 Cb -0.13 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 3m8p s ILE 132 CO -0.03 -0.23 1.01 -2.16 0.00 0.00 0.00 174.94 173.53 3m8p s PRO 133 N 2.80 4.17 0.69 2.79 0.04 -1.26 -1.59 135.00 142.64 3m8p s PRO 133 Ca 0.29 1.36 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 3m8p s PRO 133 Cb -0.14 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.00 3m8p s PRO 133 CO 0.13 -0.11 1.06 -1.54 0.04 0.00 0.00 177.00 176.58 3m8p s SER 134 N -1.81 5.47 -0.02 6.66 1.04 -1.26 -4.88 113.70 118.90 3m8p s SER 134 Ca 0.60 1.48 -0.30 0.00 0.48 0.00 0.00 55.95 58.20 3m8p s SER 134 Cb -0.17 -2.37 -0.07 0.00 0.10 0.00 0.00 66.02 63.51 3m8p s SER 134 CO 0.22 -1.37 1.68 -0.63 0.98 0.00 0.00 173.24 174.12 3m8p s ILE 135 N -3.12 3.41 -1.86 -1.02 1.01 -1.26 -0.43 121.20 117.92 3m8p s ILE 135 Ca 0.58 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.82 3m8p s ILE 135 Cb -0.13 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.96 3m8p s ILE 135 CO 0.54 -0.04 0.00 0.59 0.00 0.00 0.00 174.94 176.03 3m8p n ASN 136 N 6.79 -5.46 -2.15 3.58 3.02 -1.26 -3.72 115.26 116.05 3m8p n ASN 136 Ca 0.17 0.23 -0.12 0.00 -0.03 0.00 0.00 54.58 54.83 3m8p n ASN 136 Cb 0.42 -4.59 -0.02 0.00 -0.61 0.00 0.00 39.78 34.98 3m8p n ASN 136 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3m8p n ASN 137 N -1.43 -3.71 0.51 6.41 4.13 0.43 -4.88 115.26 116.72 3m8p n ASN 137 Ca -0.21 0.23 -0.20 0.00 1.68 0.00 0.00 54.58 56.07 3m8p n ASN 137 Cb 0.66 -3.24 -0.09 0.00 -1.54 0.00 0.00 39.78 35.56 3m8p n ASN 137 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 3m8p h GLU 138 N 0.00 -1.25 -6.16 3.52 4.39 -1.78 -3.46 114.58 109.84 3m8p h GLU 138 Ca -0.28 0.09 -0.53 0.00 0.34 0.00 0.00 59.36 58.97 3m8p h GLU 138 Cb 1.10 0.28 -0.07 0.00 -0.10 0.00 0.00 28.75 29.97 3m8p h GLU 138 CO 0.35 -0.83 -0.55 0.95 -1.16 0.00 0.00 179.01 177.77 3m8p s THR 139 N -5.80 3.51 0.09 1.13 -4.23 -1.26 -5.06 115.64 104.02 3m8p s THR 139 Ca -0.19 -1.63 -0.36 0.00 -1.18 0.00 0.00 61.69 58.33 3m8p s THR 139 Cb 0.02 -3.07 -0.17 0.00 1.34 0.00 0.00 72.50 70.62 3m8p s THR 139 CO 0.57 -0.26 1.21 -2.65 -0.54 0.00 0.00 174.62 172.94 3m8p n PRO 140 N -1.13 0.86 -0.99 3.99 -0.02 -1.26 -4.21 135.00 132.24 3m8p n PRO 140 Ca -0.05 0.31 -0.29 0.00 -2.02 0.00 0.00 63.50 61.45 3m8p n PRO 140 Cb 0.60 -1.86 0.22 0.00 -0.02 0.00 0.00 33.50 32.44 3m8p n PRO 140 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3m8p s GLY 141 N 0.20 1.55 -0.10 -1.23 0.00 -1.26 -4.70 107.32 101.79 3m8p s GLY 141 Ca 0.82 -0.60 -0.16 0.00 0.00 0.00 0.00 44.72 44.78 3m8p s GLY 141 CO 0.51 0.17 0.42 -0.42 0.00 0.00 0.00 173.10 173.77 3m8p s ILE 142 N -2.86 5.17 -0.12 0.90 1.01 -0.62 -4.89 121.20 119.79 3m8p s ILE 142 Ca 0.68 0.83 0.00 0.00 0.00 0.00 0.00 60.65 62.17 3m8p s ILE 142 Cb -0.16 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 3m8p s ILE 142 CO 0.58 0.40 -0.13 -0.13 0.00 0.00 0.00 174.94 175.66 3m8p s ARG 143 N 0.16 3.30 0.11 2.79 1.81 -1.26 -0.88 118.95 124.98 3m8p s ARG 143 Ca 0.23 -0.69 0.02 0.00 -1.72 0.00 0.00 55.73 53.58 3m8p s ARG 143 Cb -0.15 -2.60 -0.04 0.00 -0.45 0.00 0.00 34.95 31.70 3m8p s ARG 143 CO 0.10 0.25 -0.08 0.71 -0.68 0.00 0.00 175.30 175.60 3m8p s TYR 144 N 0.25 0.97 0.11 -0.53 1.51 -1.14 0.41 117.35 118.92 3m8p s TYR 144 Ca -0.09 -0.85 -0.02 0.00 -1.01 0.00 0.00 57.07 55.09 3m8p s TYR 144 Cb -0.15 -0.54 -0.03 0.00 -0.11 0.00 0.00 41.96 41.12 3m8p s TYR 144 CO 0.05 -0.09 0.06 1.14 -1.11 0.00 0.00 175.55 175.60 3m8p s GLN 145 N -3.67 0.84 0.19 -0.62 -2.07 -0.79 -0.67 119.66 112.88 3m8p s GLN 145 Ca 0.12 -1.31 -0.21 0.00 -1.82 0.00 0.00 55.36 52.14 3m8p s GLN 145 Cb 0.04 0.25 -0.08 0.00 -1.09 0.00 0.00 33.01 32.13 3m8p s GLN 145 CO -0.03 -0.23 0.72 0.71 -1.32 0.00 0.00 175.29 175.14 3m8p s TYR 146 N -3.99 3.75 -0.85 9.60 2.02 -1.26 -1.53 117.35 125.09 3m8p s TYR 146 Ca 0.17 1.45 0.11 0.00 -0.37 0.00 0.00 57.07 58.42 3m8p s TYR 146 Cb 0.07 -2.65 -0.04 0.00 -0.40 0.00 0.00 41.96 38.94 3m8p s TYR 146 CO -0.03 0.42 0.60 0.09 -1.57 0.00 0.00 175.55 175.06 3m8p n ASN 147 N 1.12 1.02 -4.13 2.29 3.02 -0.73 -4.65 115.26 113.19 3m8p n ASN 147 Ca -0.04 -1.01 -0.14 0.00 -0.03 0.00 0.00 54.58 53.35 3m8p n ASN 147 Cb 0.50 0.66 -0.10 0.00 -0.61 0.00 0.00 39.78 40.23 3m8p n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3m8p s VAL 148 N -1.67 0.16 -0.48 2.41 -7.23 -1.25 -1.53 120.40 110.83 3m8p s VAL 148 Ca 0.07 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 57.89 3m8p s VAL 148 Cb 0.09 -2.53 -0.14 0.00 0.56 0.00 0.00 36.38 34.36 3m8p s VAL 148 CO 0.34 0.00 2.27 0.18 -0.31 0.00 0.00 175.10 177.58 3m8p n LEU 149 N -0.38 1.64 -4.88 1.32 4.77 -0.69 -4.57 117.00 114.21 3m8p n LEU 149 Ca 0.02 0.34 -0.30 0.00 -0.03 0.00 0.00 56.01 56.04 3m8p n LEU 149 Cb 0.66 -1.18 0.02 0.00 -2.33 0.00 0.00 43.42 40.59 3m8p n LEU 149 CO 0.34 -0.82 0.70 -2.16 -1.33 0.00 0.00 177.39 174.12 3m8p s PRO 150 N 6.75 3.34 -0.15 3.23 0.05 -1.26 -4.11 135.00 142.84 3m8p s PRO 150 Ca 1.14 0.58 -0.20 0.00 0.05 0.00 0.00 61.00 62.57 3m8p s PRO 150 Cb -0.97 -2.10 -0.03 0.00 0.05 0.00 0.00 34.50 31.45 3m8p s PRO 150 CO 0.50 -0.69 0.59 -1.14 0.05 0.00 0.00 177.00 176.31 3m8p s GLN 151 N -5.19 4.29 0.00 4.56 2.00 -1.26 -3.24 119.66 120.81 3m8p s GLN 151 Ca 0.55 0.60 0.00 0.00 -2.00 0.00 0.00 55.36 54.51 3m8p s GLN 151 Cb -0.11 -3.51 0.00 0.00 0.80 0.00 0.00 33.01 30.19 3m8p s GLN 151 CO 0.52 -0.06 0.00 0.41 -0.50 0.00 0.00 175.29 175.66 3m8p n GLY 152 N 3.53 0.75 3.90 2.59 0.00 -1.26 -4.75 105.19 109.94 3m8p n GLY 152 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3m8p n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3m8p s TRP 153 N -2.48 3.47 0.38 1.61 -0.00 -1.20 -4.63 118.94 116.09 3m8p s TRP 153 Ca 0.00 0.56 0.11 0.00 -0.00 0.00 0.00 56.10 56.76 3m8p s TRP 153 Cb 0.00 -2.02 0.77 0.00 -0.00 0.00 0.00 33.47 32.22 3m8p s TRP 153 CO 0.00 0.34 1.88 -0.22 -0.00 0.00 0.00 176.95 178.96 3m8p h LYS 154 N 2.33 0.15 0.00 5.86 3.64 -1.92 -3.00 116.57 123.63 3m8p h LYS 154 Ca -0.47 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3m8p h LYS 154 Cb 1.18 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3m8p h LYS 154 CO 0.70 0.37 -0.62 0.41 -2.27 0.00 0.00 179.45 178.04 3m8p n GLY 155 N -0.73 -1.30 0.29 5.01 0.00 -1.26 -4.56 105.19 102.64 3m8p n GLY 155 Ca -0.01 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 3m8p n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3m8p h SER 156 N 0.00 -0.56 -0.75 1.61 0.02 -1.81 -1.89 113.55 110.17 3m8p h SER 156 Ca 0.00 -0.07 0.11 0.00 -0.84 0.00 0.00 61.79 61.00 3m8p h SER 156 Cb 0.61 0.15 -0.13 0.00 0.14 0.00 0.00 62.40 63.17 3m8p h SER 156 CO 0.00 -0.24 -0.41 -0.65 -1.14 0.00 0.00 176.83 174.38 3m8p h PRO 157 N -0.89 -0.12 0.90 3.45 0.11 -1.80 0.24 132.00 133.88 3m8p h PRO 157 Ca -0.07 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 3m8p h PRO 157 Cb 0.59 0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.74 3m8p h PRO 157 CO 0.11 -0.08 -0.43 0.00 -0.21 0.00 0.00 178.00 177.39 3m8p h ALA 158 N 0.93 -1.24 -0.96 -0.75 0.00 -1.83 -2.96 119.26 112.46 3m8p h ALA 158 Ca 0.24 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.99 3m8p h ALA 158 Cb 0.56 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 3m8p h ALA 158 CO -0.80 -1.15 0.59 0.82 0.00 0.00 0.00 179.25 178.71 3m8p h ILE 159 N -1.29 0.94 -0.57 0.00 2.04 -0.99 0.52 117.51 118.17 3m8p h ILE 159 Ca -0.12 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.49 3m8p h ILE 159 Cb 0.92 -0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 3m8p h ILE 159 CO 0.20 0.18 0.38 0.15 0.00 0.00 0.00 178.15 179.06 3m8p h PHE 160 N 0.97 0.42 0.16 1.37 3.57 -0.51 -1.22 116.94 121.71 3m8p h PHE 160 Ca 0.46 0.01 -0.35 0.00 3.53 0.00 0.00 57.97 61.62 3m8p h PHE 160 Cb 0.41 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.01 3m8p h PHE 160 CO -0.02 0.21 -1.79 1.96 -2.23 0.00 0.00 178.31 176.44 3m8p h GLN 161 N 0.40 0.35 -0.54 1.11 1.08 0.18 -0.85 115.11 116.84 3m8p h GLN 161 Ca 0.26 -0.59 0.03 0.00 -1.45 0.00 0.00 58.65 56.90 3m8p h GLN 161 Cb 0.50 0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 28.11 3m8p h GLN 161 CO -0.07 1.26 0.32 1.03 -0.95 0.00 0.00 178.83 180.42 3m8p h SER 162 N 0.09 0.52 0.55 1.46 0.87 -1.20 -0.82 113.55 115.02 3m8p h SER 162 Ca -0.35 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 3m8p h SER 162 Cb 2.08 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 63.93 3m8p h SER 162 CO 0.16 0.36 -0.34 0.28 -0.53 0.00 0.00 176.83 176.75 3m8p h SER 163 N 0.64 -0.87 -0.57 6.23 0.02 -1.09 -0.03 113.55 117.88 3m8p h SER 163 Ca 0.22 0.05 0.12 0.00 -0.84 0.00 0.00 61.79 61.34 3m8p h SER 163 Cb 0.03 0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 3m8p h SER 163 CO -0.10 -0.54 0.39 -0.03 -1.14 0.00 0.00 176.83 175.41 3m8p h MET 164 N -0.85 0.22 -0.24 3.45 -1.53 -0.98 -0.61 114.93 114.38 3m8p h MET 164 Ca -0.06 -0.01 -0.20 0.00 -3.44 0.00 0.00 59.70 55.98 3m8p h MET 164 Cb 0.69 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.70 3m8p h MET 164 CO 0.06 0.14 -0.63 1.15 0.14 0.00 0.00 176.91 177.77 3m8p h THR 165 N 0.22 1.28 -0.68 -0.77 2.02 -0.04 -1.48 112.91 113.46 3m8p h THR 165 Ca 0.27 -1.82 -0.08 0.00 0.77 0.00 0.00 66.41 65.55 3m8p h THR 165 Cb 0.76 1.76 -0.03 0.00 -1.74 0.00 0.00 68.15 68.90 3m8p h THR 165 CO -0.05 0.59 0.12 0.11 0.37 0.00 0.00 175.52 176.66 3m8p h LYS 166 N 0.62 1.11 0.00 6.66 1.57 0.43 -1.67 116.57 125.29 3m8p h LYS 166 Ca -0.01 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.39 3m8p h LYS 166 Cb 1.25 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 3m8p h LYS 166 CO 0.14 1.01 -0.41 0.82 -0.57 0.00 0.00 179.45 180.43 3m8p h ILE 167 N 1.05 1.18 0.00 1.86 2.04 -1.21 -2.89 117.51 119.54 3m8p h ILE 167 Ca 0.21 -1.47 -0.08 0.00 1.00 0.00 0.00 64.86 64.51 3m8p h ILE 167 Cb 0.42 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3m8p h ILE 167 CO 0.01 0.40 -0.95 -0.07 0.00 0.00 0.00 178.15 177.54 3m8p h LEU 168 N 0.00 0.00 -0.62 1.44 3.38 -0.78 -3.40 115.31 115.33 3m8p h LEU 168 Ca -0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3m8p h LEU 168 Cb 0.79 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.42 3m8p h LEU 168 CO 0.05 0.32 -0.36 -0.08 0.09 0.00 0.00 178.44 178.46 3m8p h GLU 169 N 0.00 -0.16 -0.18 1.13 4.81 -1.09 0.21 114.58 119.30 3m8p h GLU 169 Ca -0.06 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3m8p h GLU 169 Cb 1.30 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.71 3m8p h GLU 169 CO 0.03 -0.11 0.07 -1.00 -0.73 0.00 0.00 179.01 177.27 3m8p h PRO 170 N -0.17 0.27 -0.80 0.92 0.13 -1.77 -2.81 132.00 127.77 3m8p h PRO 170 Ca 0.23 -0.05 0.11 0.00 -0.87 0.00 0.00 66.00 65.42 3m8p h PRO 170 Cb 0.56 -0.04 -0.06 0.00 0.13 0.00 0.00 31.00 31.59 3m8p h PRO 170 CO -0.70 0.36 0.53 0.35 -0.23 0.00 0.00 178.00 178.30 3m8p h PHE 171 N 0.13 0.74 0.45 1.56 3.04 -0.85 -0.36 116.94 121.65 3m8p h PHE 171 Ca 0.06 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.01 3m8p h PHE 171 Cb 0.19 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 38.47 3m8p h PHE 171 CO -0.01 0.32 -0.21 0.00 -2.02 0.00 0.00 178.31 176.39 3m8p h ARG 172 N 0.67 -0.58 -0.92 1.11 3.08 -1.21 -0.91 114.38 115.61 3m8p h ARG 172 Ca 0.38 0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.61 3m8p h ARG 172 Cb 0.57 0.13 -0.15 0.00 0.08 0.00 0.00 29.97 30.60 3m8p h ARG 172 CO -0.15 -0.27 -0.41 0.87 -1.07 0.00 0.00 179.97 178.94 3m8p h LYS 173 N -0.96 -0.03 0.00 0.04 1.57 -1.16 0.24 116.57 116.26 3m8p h LYS 173 Ca -0.06 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3m8p h LYS 173 Cb 0.57 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 3m8p h LYS 173 CO 0.10 -0.02 -0.03 1.96 -0.57 0.00 0.00 179.45 180.89 3m8p h GLN 174 N -0.03 0.00 -2.11 3.15 1.08 -0.92 -3.32 115.11 112.95 3m8p h GLN 174 Ca 0.30 0.00 -0.55 0.00 -1.45 0.00 0.00 58.65 56.95 3m8p h GLN 174 Cb 0.57 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.59 3m8p h GLN 174 CO -0.93 0.03 -0.91 0.09 -0.95 0.00 0.00 178.83 176.16 3m8p n ASN 175 N -3.28 2.16 0.28 1.46 3.02 0.83 -4.96 115.26 114.76 3m8p n ASN 175 Ca -0.02 -3.18 0.13 0.00 -0.03 0.00 0.00 54.58 51.49 3m8p n ASN 175 Cb 0.18 -0.62 0.80 0.00 -0.61 0.00 0.00 39.78 39.53 3m8p n ASN 175 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3m8p h PRO 176 N 3.52 0.00 0.69 3.52 0.11 -1.64 -2.82 132.00 135.37 3m8p h PRO 176 Ca 0.12 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.20 3m8p h PRO 176 Cb 0.77 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 3m8p h PRO 176 CO 0.64 0.07 -0.40 -0.44 -0.21 0.00 0.00 178.00 177.66 3m8p h ASP 177 N 0.00 -0.99 -3.85 -2.05 3.32 -1.93 -3.45 116.42 107.48 3m8p h ASP 177 Ca -0.00 0.05 -0.55 0.00 0.02 0.00 0.00 57.03 56.55 3m8p h ASP 177 Cb 0.19 0.28 0.18 0.00 0.22 0.00 0.00 39.33 40.20 3m8p h ASP 177 CO 0.01 -0.63 0.15 0.00 -1.72 0.00 0.00 179.24 177.06 3m8p n ILE 178 N -4.93 2.79 -4.13 0.35 0.13 -1.07 -4.88 119.36 107.62 3m8p n ILE 178 Ca -0.12 -0.35 -0.16 0.00 -1.10 0.00 0.00 62.75 61.02 3m8p n ILE 178 Cb 0.41 -1.13 -0.12 0.00 -0.84 0.00 0.00 39.64 37.96 3m8p n ILE 178 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 3m8p s VAL 179 N -1.84 0.77 -0.02 9.51 0.11 0.63 -5.01 120.40 124.55 3m8p s VAL 179 Ca 0.74 -1.09 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 3m8p s VAL 179 Cb -0.34 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 33.76 3m8p s VAL 179 CO 0.50 -0.26 0.01 -0.63 -3.33 0.00 0.00 175.10 171.39 3m8p s ILE 180 N -1.21 0.04 -0.15 7.04 1.01 -1.26 -1.28 121.20 125.39 3m8p s ILE 180 Ca -0.06 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.72 3m8p s ILE 180 Cb -0.09 -0.12 0.02 0.00 0.01 0.00 0.00 42.46 42.27 3m8p s ILE 180 CO 0.01 0.08 -0.18 -0.47 0.00 0.00 0.00 174.94 174.39 3m8p s TYR 181 N 0.74 2.39 -0.37 3.97 5.04 0.44 -4.92 117.35 124.64 3m8p s TYR 181 Ca -0.07 -1.29 -0.17 0.00 -2.44 0.00 0.00 57.07 53.11 3m8p s TYR 181 Cb -0.10 -1.69 0.00 0.00 0.35 0.00 0.00 41.96 40.53 3m8p s TYR 181 CO -0.02 -0.65 0.44 -1.14 -1.34 0.00 0.00 175.55 172.84 3m8p s GLN 182 N 1.18 3.41 -0.07 4.97 0.74 -1.26 -0.55 119.66 128.09 3m8p s GLN 182 Ca -0.00 -0.46 -0.01 0.00 0.05 0.00 0.00 55.36 54.93 3m8p s GLN 182 Cb -0.14 -3.86 0.03 0.00 1.10 0.00 0.00 33.01 30.13 3m8p s GLN 182 CO -0.07 -0.68 0.01 -0.47 -0.55 0.00 0.00 175.29 173.53 3m8p s TYR 183 N 2.19 0.58 0.00 1.67 5.04 -0.90 -5.03 117.35 120.89 3m8p s TYR 183 Ca 0.14 -0.10 0.00 0.00 -2.44 0.00 0.00 57.07 54.67 3m8p s TYR 183 Cb -0.16 -0.75 0.00 0.00 0.35 0.00 0.00 41.96 41.40 3m8p s TYR 183 CO 0.13 -0.30 0.00 -1.33 -1.34 0.00 0.00 175.55 172.71 3m8p n MET 184 N 5.14 0.00 0.00 4.97 2.81 -1.26 -1.05 117.12 127.73 3m8p n MET 184 Ca -0.07 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.92 3m8p n MET 184 Cb 0.50 0.00 0.53 0.00 -0.71 0.00 0.00 33.22 33.54 3m8p n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3m8p n ASP 185 N 3.37 0.00 -4.78 7.83 8.00 -1.26 -4.84 116.55 124.87 3m8p n ASP 185 Ca 0.00 -0.12 -0.29 0.00 0.71 0.00 0.00 54.79 55.09 3m8p n ASP 185 Cb 0.00 -0.24 -0.06 0.00 -0.02 0.00 0.00 41.12 40.80 3m8p n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3m8p s ASP 186 N -2.47 5.51 -0.02 -2.24 -0.00 -0.22 -0.35 116.67 116.88 3m8p s ASP 186 Ca 0.21 -0.05 0.06 0.00 -0.00 0.00 0.00 52.55 52.77 3m8p s ASP 186 Cb 0.14 -1.46 -0.01 0.00 -0.00 0.00 0.00 42.92 41.58 3m8p s ASP 186 CO 0.30 0.14 -0.20 -0.76 -0.00 0.00 0.00 175.17 174.66 3m8p s LEU 187 N -2.58 2.02 -0.24 1.23 1.02 0.02 -2.13 118.68 118.03 3m8p s LEU 187 Ca 0.30 -0.36 0.01 0.00 0.02 0.00 0.00 54.13 54.10 3m8p s LEU 187 Cb -0.12 -1.02 0.06 0.00 0.02 0.00 0.00 46.19 45.13 3m8p s LEU 187 CO 0.22 0.23 -0.08 -0.31 0.02 0.00 0.00 176.35 176.43 3m8p s TYR 188 N -0.37 2.67 -0.05 0.29 1.51 0.29 -1.58 117.35 120.11 3m8p s TYR 188 Ca 0.05 -1.91 0.02 0.00 -1.01 0.00 0.00 57.07 54.22 3m8p s TYR 188 Cb -0.08 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.04 3m8p s TYR 188 CO -0.00 -0.80 -0.10 0.08 -1.11 0.00 0.00 175.55 173.61 3m8p s VAL 189 N 1.31 3.41 0.05 0.71 1.01 0.12 -0.42 120.40 126.59 3m8p s VAL 189 Ca -0.06 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 3m8p s VAL 189 Cb -0.19 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.83 3m8p s VAL 189 CO -0.06 0.57 0.30 -0.83 0.00 0.00 0.00 175.10 175.08 3m8p s GLY 190 N -0.86 -0.12 0.20 4.51 0.00 -0.41 -0.19 107.32 110.45 3m8p s GLY 190 Ca 0.13 -0.02 -0.23 0.00 0.00 0.00 0.00 44.72 44.60 3m8p s GLY 190 CO 0.02 -0.24 0.67 -1.35 0.00 0.00 0.00 173.10 172.20 3m8p s SER 191 N -2.13 -0.44 -0.74 1.64 1.04 -0.77 -0.27 113.70 112.03 3m8p s SER 191 Ca -0.04 -0.23 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 3m8p s SER 191 Cb -0.00 0.63 0.38 0.00 0.10 0.00 0.00 66.02 67.13 3m8p s SER 191 CO -0.04 -1.09 1.87 0.47 0.98 0.00 0.00 173.24 175.43 3m8p n ASP 192 N -0.41 7.06 -4.92 7.02 8.00 -1.26 -1.54 116.55 130.50 3m8p n ASP 192 Ca -0.12 -3.81 -0.20 0.00 0.71 0.00 0.00 54.79 51.37 3m8p n ASP 192 Cb 0.63 -0.94 -0.02 0.00 -0.02 0.00 0.00 41.12 40.76 3m8p n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3m8p s LEU 193 N -3.95 3.90 0.21 0.64 1.43 -1.26 -4.89 118.68 114.76 3m8p s LEU 193 Ca 0.53 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.35 3m8p s LEU 193 Cb 0.44 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 3m8p s LEU 193 CO -0.31 -0.28 0.44 -1.61 0.23 0.00 0.00 176.35 174.83 3m8p s GLU 194 N -4.03 3.61 0.55 1.70 8.01 -1.26 -4.28 118.70 122.99 3m8p s GLU 194 Ca 0.40 -0.10 0.30 0.00 0.01 0.00 0.00 54.97 55.57 3m8p s GLU 194 Cb -0.08 -2.77 1.46 0.00 -4.31 0.00 0.00 34.13 28.43 3m8p s GLU 194 CO 0.28 0.37 1.91 0.97 0.01 0.00 0.00 175.26 178.80 3m8p h ILE 195 N 1.71 0.55 0.08 -1.63 2.10 -1.99 0.94 117.51 119.25 3m8p h ILE 195 Ca -0.47 0.00 -0.32 0.00 1.08 0.00 0.00 64.86 65.15 3m8p h ILE 195 Cb 1.18 0.60 -0.03 0.00 -1.09 0.00 0.00 36.82 37.48 3m8p h ILE 195 CO 0.69 0.00 -1.75 1.23 -1.08 0.00 0.00 178.15 177.24 3m8p h GLY 196 N 0.00 0.19 2.00 8.18 0.00 -1.98 -2.43 103.07 109.03 3m8p h GLY 196 Ca 0.35 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 3m8p h GLY 196 CO -0.00 0.42 -0.29 1.46 0.00 0.00 0.00 176.54 178.13 3m8p h GLN 197 N 0.04 0.00 0.41 4.80 4.20 -1.22 -2.91 115.11 120.44 3m8p h GLN 197 Ca -0.32 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.37 3m8p h GLN 197 Cb 2.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.80 3m8p h GLN 197 CO 0.11 0.29 -0.20 1.25 -0.67 0.00 0.00 178.83 179.61 3m8p h HIS 198 N 0.00 -0.51 -0.73 2.96 2.76 -1.49 -3.16 115.15 114.98 3m8p h HIS 198 Ca -0.00 -0.01 0.21 0.00 -2.20 0.00 0.00 60.37 58.37 3m8p h HIS 198 Cb 0.63 0.17 -0.03 0.00 1.55 0.00 0.00 27.41 29.73 3m8p h HIS 198 CO 0.00 -0.32 0.64 0.00 -1.30 0.00 0.00 177.93 176.95 3m8p h ARG 199 N -1.15 0.00 -0.01 5.26 3.08 -1.44 0.43 114.38 120.55 3m8p h ARG 199 Ca -0.06 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 3m8p h ARG 199 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 3m8p h ARG 199 CO 0.09 0.00 -0.11 1.15 -1.07 0.00 0.00 179.97 180.03 3m8p h THR 200 N 0.00 1.55 0.00 2.04 2.02 -1.59 -2.90 112.91 114.03 3m8p h THR 200 Ca 0.35 -1.78 -0.00 0.00 0.77 0.00 0.00 66.41 65.75 3m8p h THR 200 Cb 1.62 2.70 -0.00 0.00 -1.74 0.00 0.00 68.15 70.73 3m8p h THR 200 CO -0.00 0.47 -0.01 0.50 0.37 0.00 0.00 175.52 176.85 3m8p h LYS 201 N -0.59 0.00 -0.19 6.66 1.63 -0.20 0.35 116.57 124.23 3m8p h LYS 201 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3m8p h LYS 201 Cb 0.84 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.45 3m8p h LYS 201 CO 0.02 0.01 0.12 0.82 -3.45 0.00 0.00 179.45 176.98 3m8p h ILE 202 N 0.00 1.04 -0.71 2.00 1.08 -0.98 -2.75 117.51 117.19 3m8p h ILE 202 Ca -0.00 -0.08 -0.00 0.00 -0.39 0.00 0.00 64.86 64.38 3m8p h ILE 202 Cb 0.03 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 34.51 3m8p h ILE 202 CO 0.00 0.05 0.43 -0.33 -0.69 0.00 0.00 178.15 177.61 3m8p h GLU 203 N 0.25 0.96 -0.88 2.37 4.39 -0.13 0.17 114.58 121.71 3m8p h GLU 203 Ca 0.07 -0.08 0.08 0.00 0.34 0.00 0.00 59.36 59.77 3m8p h GLU 203 Cb -0.02 -0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 28.37 3m8p h GLU 203 CO -0.02 0.68 0.57 0.93 -1.16 0.00 0.00 179.01 180.00 3m8p h GLU 204 N 0.97 0.91 0.75 2.33 5.08 -1.08 -1.07 114.58 122.46 3m8p h GLU 204 Ca 0.26 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 3m8p h GLU 204 Cb -0.04 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.01 3m8p h GLU 204 CO -0.05 0.60 -0.36 1.25 -1.00 0.00 0.00 179.01 179.45 3m8p h LEU 205 N 0.93 -0.85 -0.87 1.33 5.85 -0.87 0.83 115.31 121.66 3m8p h LEU 205 Ca 0.39 0.01 0.17 0.00 0.84 0.00 0.00 57.88 59.30 3m8p h LEU 205 Cb 0.30 0.22 -0.11 0.00 0.37 0.00 0.00 40.66 41.44 3m8p h LEU 205 CO -0.15 -0.55 0.42 0.03 -0.34 0.00 0.00 178.44 177.85 3m8p h ARG 206 N -1.11 0.53 -0.45 1.25 3.08 0.22 0.97 114.38 118.88 3m8p h ARG 206 Ca -0.10 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.86 3m8p h ARG 206 Cb 0.79 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 3m8p h ARG 206 CO 0.17 0.35 0.07 0.37 -1.07 0.00 0.00 179.97 179.86 3m8p h GLN 207 N 0.54 0.74 -1.00 0.04 -0.00 -1.25 0.08 115.11 114.26 3m8p h GLN 207 Ca 0.50 -0.20 0.08 0.00 -0.00 0.00 0.00 58.65 59.03 3m8p h GLN 207 Cb 0.81 -0.09 -0.07 0.00 0.00 0.00 0.00 27.48 28.13 3m8p h GLN 207 CO -0.42 0.76 0.64 1.25 0.00 0.00 0.00 178.83 181.06 3m8p h HIS 208 N 0.60 1.18 -0.05 3.99 2.76 0.30 0.37 115.15 124.31 3m8p h HIS 208 Ca 0.14 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.31 3m8p h HIS 208 Cb 0.38 -0.38 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 3m8p h HIS 208 CO 0.03 0.57 -0.06 -0.07 -1.30 0.00 0.00 177.93 177.10 3m8p h LEU 209 N 1.12 0.14 -0.92 0.26 3.38 0.97 -2.85 115.31 117.40 3m8p h LEU 209 Ca 0.45 -0.52 0.23 0.00 0.09 0.00 0.00 57.88 58.12 3m8p h LEU 209 Cb 0.25 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.84 3m8p h LEU 209 CO -0.20 0.63 0.45 -0.07 0.09 0.00 0.00 178.44 179.34 3m8p h LEU 210 N -0.36 0.42 0.00 1.67 3.38 -0.03 0.21 115.31 120.61 3m8p h LEU 210 Ca 0.01 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3m8p h LEU 210 Cb 0.60 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3m8p h LEU 210 CO 0.01 0.03 0.07 -1.14 0.09 0.00 0.00 178.44 177.50 3m8p n ARG 211 N -5.00 0.00 -0.08 1.13 0.63 0.13 -1.33 116.66 112.13 3m8p n ARG 211 Ca 0.23 0.40 0.02 0.00 -0.92 0.00 0.00 57.85 57.58 3m8p n ARG 211 Cb 0.68 -1.57 0.03 0.00 0.45 0.00 0.00 32.46 32.04 3m8p n ARG 211 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 3m8p n TRP 212 N -1.39 0.00 0.00 -0.14 7.02 0.71 -4.92 117.44 118.72 3m8p n TRP 212 Ca 0.00 -0.38 0.00 0.00 -1.02 0.00 0.00 57.50 56.10 3m8p n TRP 212 Cb 0.07 -0.06 0.00 0.00 -2.42 0.00 0.00 31.31 28.91 3m8p n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3m8p n GLY 213 N -0.47 1.01 3.08 6.99 0.00 -0.44 -3.90 105.19 111.46 3m8p n GLY 213 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3m8p n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m8p s LEU 214 N 0.00 2.64 0.19 0.99 1.43 -1.02 -4.09 118.68 118.83 3m8p s LEU 214 Ca 0.00 -0.97 0.01 0.00 -1.03 0.00 0.00 54.13 52.14 3m8p s LEU 214 Cb 0.00 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 3m8p s LEU 214 CO 0.00 -0.10 0.36 0.28 0.23 0.00 0.00 176.35 177.12 3m8p s THR 215 N 1.24 5.25 0.27 5.49 -1.32 -1.26 -1.65 115.64 123.66 3m8p s THR 215 Ca -0.01 -0.53 -0.01 0.00 -1.21 0.00 0.00 61.69 59.93 3m8p s THR 215 Cb -0.16 -3.75 -0.02 0.00 -1.51 0.00 0.00 72.50 67.05 3m8p s THR 215 CO -0.09 -0.17 0.30 0.42 -2.21 0.00 0.00 174.62 172.86 3m8p s THR 216 N -1.85 0.00 0.53 5.08 -4.23 -1.26 -2.17 115.64 111.73 3m8p s THR 216 Ca 0.37 -1.82 -0.06 0.00 -1.18 0.00 0.00 61.69 58.99 3m8p s THR 216 Cb -0.11 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.22 3m8p s THR 216 CO 0.29 0.00 0.85 -2.16 -0.54 0.00 0.00 174.62 173.06 3m8p s PRO 217 N -3.72 3.39 0.82 3.99 0.04 -1.26 -4.96 135.00 133.30 3m8p s PRO 217 Ca 0.35 0.22 -0.11 0.00 0.04 0.00 0.00 61.00 61.50 3m8p s PRO 217 Cb 0.03 -2.31 0.08 0.00 0.04 0.00 0.00 34.50 32.35 3m8p s PRO 217 CO 0.17 -0.39 1.09 0.34 0.04 0.00 0.00 177.00 178.26 3m8p s ASP 218 N -4.17 4.25 0.07 6.66 3.68 -1.26 -4.85 116.67 121.05 3m8p s ASP 218 Ca 0.50 1.44 0.03 0.00 2.13 0.00 0.00 52.55 56.65 3m8p s ASP 218 Cb -0.10 -2.17 0.15 0.00 -1.45 0.00 0.00 42.92 39.34 3m8p s ASP 218 CO 0.46 -2.14 0.89 1.17 0.13 0.00 0.00 175.17 175.69 3m8p n LYS 219 N -3.56 0.02 -2.64 4.34 0.00 -1.26 -0.48 118.16 114.58 3m8p n LYS 219 Ca 0.07 0.35 -0.07 0.00 0.00 0.00 0.00 58.31 58.66 3m8p n LYS 219 Cb 0.55 -1.80 0.04 0.00 0.00 0.00 0.00 35.03 33.82 3m8p n LYS 219 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3m8p n LYS 220 N -1.45 2.10 -2.32 1.64 5.02 -1.26 -4.84 118.16 117.04 3m8p n LYS 220 Ca -0.00 -3.65 -0.21 0.00 -2.02 0.00 0.00 58.31 52.43 3m8p n LYS 220 Cb 0.24 -1.72 0.02 0.00 -0.02 0.00 0.00 35.03 33.55 3m8p n LYS 220 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3m8p n HIS 221 N -0.55 2.65 -3.86 2.13 8.25 0.36 -5.08 115.22 119.13 3m8p n HIS 221 Ca 0.16 -2.55 -0.12 0.00 -0.26 0.00 0.00 57.72 54.94 3m8p n HIS 221 Cb 0.83 -0.24 -0.14 0.00 1.12 0.00 0.00 29.99 31.56 3m8p n HIS 221 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3m8p s GLN 222 N -3.56 0.01 0.99 -0.41 -0.21 -1.26 -4.85 119.66 110.37 3m8p s GLN 222 Ca 0.45 0.03 -0.12 0.00 0.02 0.00 0.00 55.36 55.74 3m8p s GLN 222 Cb 0.40 -0.00 0.18 0.00 1.00 0.00 0.00 33.01 34.59 3m8p s GLN 222 CO -0.05 -0.01 1.09 0.15 -2.12 0.00 0.00 175.29 174.35 3m8p s LYS 223 N 0.06 0.51 0.09 2.91 1.02 -1.26 -5.05 119.74 118.03 3m8p s LYS 223 Ca -0.00 0.65 0.04 0.00 0.02 0.00 0.00 55.97 56.67 3m8p s LYS 223 Cb -0.01 -1.74 -0.03 0.00 -0.52 0.00 0.00 37.83 35.53 3m8p s LYS 223 CO -0.00 -2.71 -0.10 -2.00 -0.92 0.00 0.00 175.35 169.62 3m8p s GLU 224 N -4.90 0.83 0.81 1.68 2.12 -1.26 -4.86 118.70 113.12 3m8p s GLU 224 Ca 0.65 -1.12 -0.13 0.00 0.36 0.00 0.00 54.97 54.73 3m8p s GLU 224 Cb -0.19 -0.54 0.07 0.00 0.26 0.00 0.00 34.13 33.72 3m8p s GLU 224 CO 0.58 0.09 1.06 -0.35 -0.54 0.00 0.00 175.26 176.10 3m8p n PRO 225 N 0.66 0.14 -2.68 4.30 -0.04 -1.26 -4.53 135.00 131.59 3m8p n PRO 225 Ca -0.17 0.12 -0.42 0.00 -0.04 0.00 0.00 63.50 62.99 3m8p n PRO 225 Cb 0.57 -2.32 -0.03 0.00 -0.04 0.00 0.00 33.50 31.68 3m8p n PRO 225 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3m8p s PRO 226 N -3.93 4.58 0.21 0.54 0.04 -1.26 -5.15 135.00 130.03 3m8p s PRO 226 Ca 0.71 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.92 3m8p s PRO 226 Cb -0.29 -3.42 -0.08 0.00 0.04 0.00 0.00 34.50 30.74 3m8p s PRO 226 CO 0.53 0.00 1.17 -0.06 0.04 0.00 0.00 177.00 178.69 3m8p s PHE 227 N 0.72 3.45 -0.26 0.56 0.08 0.01 -4.81 117.98 117.73 3m8p s PHE 227 Ca 0.51 1.50 -0.09 0.00 0.12 0.00 0.00 56.93 58.97 3m8p s PHE 227 Cb -0.23 -3.40 -0.04 0.00 -0.57 0.00 0.00 43.02 38.78 3m8p s PHE 227 CO 0.29 -1.04 0.14 -0.51 -0.10 0.00 0.00 175.22 173.99 3m8p s LEU 228 N -0.58 3.78 -0.19 -0.37 1.43 -1.26 -0.23 118.68 121.27 3m8p s LEU 228 Ca 0.51 -0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 53.48 3m8p s LEU 228 Cb -0.33 -2.04 0.09 0.00 0.03 0.00 0.00 46.19 43.95 3m8p s LEU 228 CO 0.38 -0.04 0.26 0.86 0.23 0.00 0.00 176.35 178.05 3m8p s TRP 229 N 1.65 -0.42 -1.51 0.29 -0.00 -0.45 -4.92 118.94 113.58 3m8p s TRP 229 Ca 0.07 0.56 -0.11 0.00 -0.00 0.00 0.00 56.10 56.61 3m8p s TRP 229 Cb -0.15 -0.19 0.07 0.00 -0.00 0.00 0.00 33.47 33.20 3m8p s TRP 229 CO 0.08 -0.55 0.90 -0.12 -0.00 0.00 0.00 176.95 177.26 3m8p n MET 230 N 5.34 -5.15 -1.07 5.86 1.56 -1.26 0.15 117.12 122.54 3m8p n MET 230 Ca -0.05 0.57 -0.02 0.00 -0.27 0.00 0.00 57.70 57.93 3m8p n MET 230 Cb 0.50 -5.37 -0.01 0.00 2.15 0.00 0.00 33.22 30.49 3m8p n MET 230 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3m8p n GLY 231 N -1.67 0.51 3.66 -5.12 0.00 -1.26 -5.04 105.19 96.27 3m8p n GLY 231 Ca -0.03 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 3m8p n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3m8p s TYR 232 N -1.80 2.60 -0.31 1.61 2.02 0.12 -1.49 117.35 120.10 3m8p s TYR 232 Ca 0.00 -0.42 0.03 0.00 -0.37 0.00 0.00 57.07 56.31 3m8p s TYR 232 Cb 0.00 -1.54 0.09 0.00 -0.40 0.00 0.00 41.96 40.11 3m8p s TYR 232 CO 0.00 0.43 -0.00 -2.00 -1.57 0.00 0.00 175.55 172.41 3m8p s GLU 233 N -3.76 1.75 -0.19 -0.62 2.12 -0.21 -1.34 118.70 116.45 3m8p s GLU 233 Ca 0.36 -1.70 -0.09 0.00 0.36 0.00 0.00 54.97 53.90 3m8p s GLU 233 Cb -0.01 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.22 3m8p s GLU 233 CO 0.20 -0.82 0.11 -0.51 -0.54 0.00 0.00 175.26 173.71 3m8p s LEU 234 N 0.97 4.09 0.38 2.70 1.43 0.68 -2.13 118.68 126.81 3m8p s LEU 234 Ca 0.04 0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.38 3m8p s LEU 234 Cb -0.19 -2.05 -0.07 0.00 0.03 0.00 0.00 46.19 43.90 3m8p s LEU 234 CO -0.07 0.18 0.03 -1.00 0.23 0.00 0.00 176.35 175.71 3m8p s HIS 235 N 0.37 2.34 0.24 0.29 3.76 -0.48 -0.81 115.29 121.00 3m8p s HIS 235 Ca 0.06 -0.76 -0.03 0.00 -0.15 0.00 0.00 55.06 54.18 3m8p s HIS 235 Cb -0.11 -1.62 0.27 0.00 1.11 0.00 0.00 32.58 32.22 3m8p s HIS 235 CO -0.01 0.31 1.70 -1.35 -0.85 0.00 0.00 174.74 174.54 3m8p h PRO 236 N 1.88 0.78 0.00 8.40 0.11 -1.93 -3.10 132.00 138.14 3m8p h PRO 236 Ca -0.43 -0.25 -0.01 0.00 0.11 0.00 0.00 66.00 65.42 3m8p h PRO 236 Cb 1.24 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3m8p h PRO 236 CO 0.77 0.85 -0.18 -0.40 -0.21 0.00 0.00 178.00 178.84 3m8p n ASP 237 N -4.17 1.79 -2.91 -2.05 5.75 -1.26 -1.97 116.55 111.73 3m8p n ASP 237 Ca 0.01 -2.93 -0.04 0.00 -0.01 0.00 0.00 54.79 51.83 3m8p n ASP 237 Cb 0.36 -0.39 0.02 0.00 -1.03 0.00 0.00 41.12 40.08 3m8p n ASP 237 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 3m8p n LYS 238 N -1.07 0.69 -3.51 0.11 2.85 -1.17 -4.62 118.16 111.43 3m8p n LYS 238 Ca 0.13 -1.49 -0.09 0.00 -1.05 0.00 0.00 58.31 55.81 3m8p n LYS 238 Cb 0.67 1.96 -0.03 0.00 -0.65 0.00 0.00 35.03 36.98 3m8p n LYS 238 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 3m8p s TRP 239 N -2.68 -0.36 0.00 5.58 1.48 -0.73 -1.38 118.94 120.85 3m8p s TRP 239 Ca 0.19 0.30 0.00 0.00 -1.06 0.00 0.00 56.10 55.52 3m8p s TRP 239 Cb -0.03 0.52 0.00 0.00 -1.16 0.00 0.00 33.47 32.80 3m8p s TRP 239 CO 0.06 -0.52 0.00 -2.37 -4.06 0.00 0.00 176.95 170.07 3m8p n THR 240 N -0.08 0.00 -4.30 0.66 5.66 -0.91 0.26 114.28 115.57 3m8p n THR 240 Ca -0.09 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.59 3m8p n THR 240 Cb 0.61 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.30 3m8p n THR 240 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 3m8p s VAL 241 N -2.71 3.92 0.67 1.08 -7.23 -1.26 -1.05 120.40 113.82 3m8p s VAL 241 Ca 0.00 -0.78 -0.17 0.00 -1.81 0.00 0.00 61.98 59.22 3m8p s VAL 241 Cb 0.00 -2.77 -0.07 0.00 0.56 0.00 0.00 36.38 34.10 3m8p s VAL 241 CO 0.00 0.31 0.36 0.00 -0.31 0.00 0.00 175.10 175.46 3m8p n GLN 242 N 1.22 0.30 -2.15 4.82 6.02 -0.56 -4.62 117.38 122.42 3m8p n GLN 242 Ca -0.14 0.13 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 3m8p n GLN 242 Cb 0.52 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 3m8p n GLN 242 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 3m8p s PRO 243 N -2.28 4.32 -0.29 -1.09 0.02 -1.26 -4.96 135.00 129.46 3m8p s PRO 243 Ca 0.64 2.12 -0.13 0.00 0.02 0.00 0.00 61.00 63.65 3m8p s PRO 243 Cb -0.39 -3.21 -0.04 0.00 0.02 0.00 0.00 34.50 30.89 3m8p s PRO 243 CO 0.60 -0.40 0.27 0.42 -0.33 0.00 0.00 177.00 177.56 3m8p s ILE 244 N 0.70 5.25 -0.25 2.83 -1.09 -1.26 -5.06 121.20 122.32 3m8p s ILE 244 Ca 0.62 0.23 -0.04 0.00 -2.23 0.00 0.00 60.65 59.23 3m8p s ILE 244 Cb -0.38 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 3m8p s ILE 244 CO 0.34 0.15 -0.00 0.54 -1.23 0.00 0.00 174.94 174.74 3m8p s VAL 245 N 1.88 3.49 -0.34 2.92 0.11 -1.26 -5.08 120.40 122.12 3m8p s VAL 245 Ca 0.10 -0.67 -0.24 0.00 -2.93 0.00 0.00 61.98 58.24 3m8p s VAL 245 Cb -0.16 -2.70 0.01 0.00 -1.53 0.00 0.00 36.38 31.99 3m8p s VAL 245 CO 0.11 0.25 0.81 -0.76 -3.33 0.00 0.00 175.10 172.18 3m8p s LEU 246 N 1.45 4.09 0.46 2.54 1.43 -1.26 -5.02 118.68 122.38 3m8p s LEU 246 Ca 0.03 0.55 -0.24 0.00 -1.03 0.00 0.00 54.13 53.44 3m8p s LEU 246 Cb -0.16 -3.09 -0.08 0.00 0.03 0.00 0.00 46.19 42.89 3m8p s LEU 246 CO -0.01 -0.69 1.25 -0.81 0.23 0.00 0.00 176.35 176.32 3m8p n PRO 247 N 6.37 1.78 -3.03 1.29 -0.04 -1.26 -4.98 135.00 135.13 3m8p n PRO 247 Ca 0.04 0.64 -0.42 0.00 -0.04 0.00 0.00 63.50 63.72 3m8p n PRO 247 Cb 0.48 -2.40 -0.06 0.00 -0.04 0.00 0.00 33.50 31.49 3m8p n PRO 247 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3m8p s GLU 248 N -2.38 3.83 -0.03 0.54 8.01 -1.26 -5.04 118.70 122.36 3m8p s GLU 248 Ca 0.64 0.31 0.00 0.00 0.01 0.00 0.00 54.97 55.94 3m8p s GLU 248 Cb -0.48 -3.77 0.03 0.00 -4.31 0.00 0.00 34.13 25.60 3m8p s GLU 248 CO 0.55 -0.71 0.00 0.15 0.01 0.00 0.00 175.26 175.27 3m8p s LYS 249 N 2.84 0.31 0.33 1.61 1.02 -1.26 -5.01 119.74 119.58 3m8p s LYS 249 Ca 0.28 0.08 0.25 0.00 0.02 0.00 0.00 55.97 56.60 3m8p s LYS 249 Cb -0.14 -0.51 0.61 0.00 -0.52 0.00 0.00 37.83 37.27 3m8p s LYS 249 CO 0.14 -0.15 1.70 -0.44 -0.92 0.00 0.00 175.35 175.69 3m8p h ASP 250 N 7.33 0.00 -3.40 2.83 3.32 -2.05 -3.44 116.42 121.02 3m8p h ASP 250 Ca -0.41 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.30 3m8p h ASP 250 Cb 1.13 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 40.32 3m8p h ASP 250 CO 0.46 0.00 -0.74 -0.44 -1.72 0.00 0.00 179.24 176.80 3m8p s SER 251 N -5.35 0.70 -0.29 6.45 0.01 -1.26 -5.08 113.70 108.87 3m8p s SER 251 Ca 0.08 0.05 -0.09 0.00 1.31 0.00 0.00 55.95 57.31 3m8p s SER 251 Cb 0.09 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.18 3m8p s SER 251 CO 0.62 -0.19 0.12 0.26 0.41 0.00 0.00 173.24 174.46 3m8p s TRP 252 N 1.67 3.15 0.57 2.43 0.52 -1.26 -5.04 118.94 120.97 3m8p s TRP 252 Ca -0.01 -0.61 -0.07 0.00 0.02 0.00 0.00 56.10 55.43 3m8p s TRP 252 Cb -0.12 -2.31 -0.02 0.00 -1.15 0.00 0.00 33.47 29.87 3m8p s TRP 252 CO -0.03 -0.45 0.90 0.95 0.02 0.00 0.00 176.95 178.34 3m8p s THR 253 N 1.59 4.34 0.18 2.01 -4.23 -1.26 0.72 115.64 119.00 3m8p s THR 253 Ca 0.05 0.31 -0.21 0.00 -1.18 0.00 0.00 61.69 60.66 3m8p s THR 253 Cb -0.17 -3.70 0.11 0.00 1.34 0.00 0.00 72.50 70.08 3m8p s THR 253 CO 0.05 -0.77 1.60 0.58 -0.54 0.00 0.00 174.62 175.53 3m8p h VAL 254 N -0.10 0.23 -0.63 2.29 2.07 -0.90 1.00 116.25 120.21 3m8p h VAL 254 Ca -0.46 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.17 3m8p h VAL 254 Cb 1.22 0.23 -0.08 0.00 -1.52 0.00 0.00 31.29 31.14 3m8p h VAL 254 CO 0.62 0.00 0.20 -1.13 0.02 0.00 0.00 177.57 177.27 3m8p h ASN 255 N -0.18 0.14 -0.39 0.57 -1.24 -1.47 0.61 115.58 113.62 3m8p h ASN 255 Ca 0.22 0.10 0.03 0.00 0.71 0.00 0.00 56.30 57.35 3m8p h ASN 255 Cb 0.53 0.10 -0.03 0.00 0.73 0.00 0.00 38.32 39.65 3m8p h ASN 255 CO -0.61 0.07 0.20 0.44 -1.29 0.00 0.00 177.43 176.24 3m8p h ASP 256 N 0.35 0.29 -0.14 1.15 3.32 -1.28 0.12 116.42 120.23 3m8p h ASP 256 Ca 0.33 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.38 3m8p h ASP 256 Cb 0.46 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 3m8p h ASP 256 CO -0.36 0.21 0.01 0.40 -1.72 0.00 0.00 179.24 177.78 3m8p h ILE 257 N 0.40 1.24 -0.59 0.35 2.04 -0.07 -1.56 117.51 119.33 3m8p h ILE 257 Ca 0.17 -0.78 0.10 0.00 1.00 0.00 0.00 64.86 65.34 3m8p h ILE 257 Cb 0.07 1.49 -0.11 0.00 -0.74 0.00 0.00 36.82 37.53 3m8p h ILE 257 CO -0.11 0.23 -0.37 1.56 0.00 0.00 0.00 178.15 179.46 3m8p h GLN 258 N -0.01 -0.18 -0.11 2.37 4.20 0.44 -0.41 115.11 121.41 3m8p h GLN 258 Ca 0.04 0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 3m8p h GLN 258 Cb 0.34 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 3m8p h GLN 258 CO 0.01 -0.12 -0.24 0.87 -0.67 0.00 0.00 178.83 178.68 3m8p h LYS 259 N -0.18 0.19 -0.06 1.46 1.57 -0.69 -2.10 116.57 116.76 3m8p h LYS 259 Ca 0.22 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 3m8p h LYS 259 Cb 0.56 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 3m8p h LYS 259 CO -0.68 0.43 -0.03 1.25 -0.57 0.00 0.00 179.45 179.85 3m8p h LEU 260 N 0.18 0.13 -0.80 2.94 6.46 -0.66 -2.01 115.31 121.54 3m8p h LEU 260 Ca 0.03 -0.41 0.09 0.00 -0.12 0.00 0.00 57.88 57.46 3m8p h LEU 260 Cb 0.53 -0.04 -0.07 0.00 -0.73 0.00 0.00 40.66 40.35 3m8p h LEU 260 CO 0.04 0.52 0.46 0.58 -0.62 0.00 0.00 178.44 179.41 3m8p h VAL 261 N -0.25 0.92 -0.56 1.05 2.07 -0.95 0.13 116.25 118.65 3m8p h VAL 261 Ca 0.01 -0.27 0.11 0.00 0.82 0.00 0.00 66.70 67.38 3m8p h VAL 261 Cb 0.47 0.07 -0.11 0.00 -1.52 0.00 0.00 31.29 30.20 3m8p h VAL 261 CO 0.01 0.14 -0.13 1.23 0.02 0.00 0.00 177.57 178.84 3m8p h GLY 262 N 0.78 0.41 0.83 2.17 0.00 -1.00 0.48 103.07 106.75 3m8p h GLY 262 Ca 0.38 0.18 -0.09 0.00 0.00 0.00 0.00 47.33 47.81 3m8p h GLY 262 CO -0.24 -0.21 -0.22 0.50 0.00 0.00 0.00 176.54 176.37 3m8p h LYS 263 N 0.00 0.49 0.00 4.80 1.57 -0.66 0.52 116.57 123.30 3m8p h LYS 263 Ca 0.27 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3m8p h LYS 263 Cb 0.41 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3m8p h LYS 263 CO -0.57 0.85 -0.00 -0.07 -0.57 0.00 0.00 179.45 179.08 3m8p h LEU 264 N 0.16 -0.00 -0.48 2.94 3.38 -0.53 0.15 115.31 120.93 3m8p h LEU 264 Ca 0.03 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.06 3m8p h LEU 264 Cb 0.77 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.43 3m8p h LEU 264 CO 0.05 0.03 -0.07 0.78 0.09 0.00 0.00 178.44 179.33 3m8p h ASN 265 N -0.04 -0.34 -0.72 -0.43 2.35 0.01 0.15 115.58 116.56 3m8p h ASN 265 Ca -0.00 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 3m8p h ASN 265 Cb 0.04 0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 3m8p h ASN 265 CO 0.00 -0.12 0.41 -0.25 -1.65 0.00 0.00 177.43 175.82 3m8p h TRP 266 N 0.05 0.98 -0.09 1.19 2.91 -0.58 -2.11 115.95 118.30 3m8p h TRP 266 Ca 0.24 -0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.19 3m8p h TRP 266 Cb 0.37 -0.32 -0.01 0.00 -0.51 0.00 0.00 29.16 28.69 3m8p h TRP 266 CO -0.36 0.67 -0.21 0.00 -1.03 0.00 0.00 178.44 177.51 3m8p h ALA 267 N 1.44 1.50 0.00 2.65 0.00 0.18 -2.82 119.26 122.21 3m8p h ALA 267 Ca 0.26 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3m8p h ALA 267 Cb 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3m8p h ALA 267 CO -0.04 0.36 0.00 -1.13 0.00 0.00 0.00 179.25 178.44 3m8p n SER 268 N -4.24 0.00 0.09 0.00 3.41 0.16 -2.29 113.62 110.75 3m8p n SER 268 Ca -0.01 -0.19 0.12 0.00 -0.26 0.00 0.00 58.87 58.52 3m8p n SER 268 Cb 0.30 -0.10 0.45 0.00 -0.26 0.00 0.00 64.21 64.60 3m8p n SER 268 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m8p n GLN 269 N -1.10 0.17 0.00 4.33 6.02 -1.07 -3.14 117.38 122.60 3m8p n GLN 269 Ca 0.08 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 3m8p n GLN 269 Cb 0.06 -1.77 0.00 0.00 1.02 0.00 0.00 30.24 29.55 3m8p n GLN 269 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 3m8p n ILE 270 N -2.09 0.00 -2.74 5.09 0.13 -0.97 -1.06 119.36 117.73 3m8p n ILE 270 Ca 0.04 0.00 -0.43 0.00 -1.10 0.00 0.00 62.75 61.26 3m8p n ILE 270 Cb 0.29 0.00 -0.03 0.00 -0.84 0.00 0.00 39.64 39.06 3m8p n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 3m8p s TYR 271 N -0.97 2.95 0.51 9.51 2.02 -0.99 -4.70 117.35 125.68 3m8p s TYR 271 Ca 0.00 0.66 -0.20 0.00 -0.37 0.00 0.00 57.07 57.15 3m8p s TYR 271 Cb 0.00 -4.00 -0.07 0.00 -0.40 0.00 0.00 41.96 37.49 3m8p s TYR 271 CO 0.00 -1.05 1.09 -2.14 -1.57 0.00 0.00 175.55 171.88 3m8p s PRO 272 N 3.88 3.61 0.00 -1.71 0.02 -1.26 -3.68 135.00 135.85 3m8p s PRO 272 Ca 0.41 1.52 0.00 0.00 0.02 0.00 0.00 61.00 62.95 3m8p s PRO 272 Cb -0.10 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.32 3m8p s PRO 272 CO 0.25 -0.62 0.00 0.41 -0.33 0.00 0.00 177.00 176.71 3m8p n GLY 273 N 0.03 0.41 3.67 0.52 0.00 -1.26 -5.00 105.19 103.55 3m8p n GLY 273 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3m8p n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3m8p n ILE 274 N -2.66 2.17 -4.06 -0.61 2.08 -1.24 -4.93 119.36 110.09 3m8p n ILE 274 Ca 0.00 -0.50 -0.13 0.00 0.56 0.00 0.00 62.75 62.68 3m8p n ILE 274 Cb 0.12 -1.41 -0.12 0.00 -0.75 0.00 0.00 39.64 37.48 3m8p n ILE 274 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3m8p s LYS 275 N -1.90 0.50 0.00 0.38 1.02 -1.26 -4.99 119.74 113.49 3m8p s LYS 275 Ca 0.58 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.89 3m8p s LYS 275 Cb -0.58 -0.28 0.00 0.00 -0.52 0.00 0.00 37.83 36.46 3m8p s LYS 275 CO 0.60 0.05 0.22 1.55 -0.92 0.00 0.00 175.35 176.86 3m8p n VAL 276 N 1.63 0.02 0.00 3.17 3.14 -1.26 -4.92 118.33 120.12 3m8p n VAL 276 Ca -0.22 -0.04 -0.12 0.00 -2.96 0.00 0.00 64.34 61.00 3m8p n VAL 276 Cb 0.55 1.56 -0.08 0.00 -1.06 0.00 0.00 33.84 34.82 3m8p n VAL 276 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 3m8p h ARG 277 N 0.00 0.04 0.00 1.45 2.43 -1.98 -0.45 114.38 115.87 3m8p h ARG 277 Ca 0.00 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 3m8p h ARG 277 Cb 0.66 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 3m8p h ARG 277 CO 0.00 0.26 -0.33 1.96 -1.51 0.00 0.00 179.97 180.35 3m8p h GLN 278 N -0.18 0.00 -0.14 0.20 1.08 -1.92 -0.71 115.11 113.44 3m8p h GLN 278 Ca 0.01 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.98 3m8p h GLN 278 Cb 0.24 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.68 3m8p h GLN 278 CO 0.00 0.33 -0.79 -0.07 -0.95 0.00 0.00 178.83 177.35 3m8p h LEU 279 N 0.00 0.91 -0.36 1.46 3.38 -1.84 -3.31 115.31 115.55 3m8p h LEU 279 Ca -0.00 -0.61 -0.14 0.00 0.09 0.00 0.00 57.88 57.22 3m8p h LEU 279 Cb 0.97 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3m8p h LEU 279 CO 0.04 1.40 -0.31 0.00 0.09 0.00 0.00 178.44 179.67 3m8p h LYS 281 N 0.64 0.19 0.00 0.00 1.57 -1.27 0.27 116.57 117.97 3m8p h LYS 281 Ca 0.06 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3m8p h LYS 281 Cb 0.89 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.15 3m8p h LYS 281 CO 0.08 0.13 -0.05 -0.07 -0.57 0.00 0.00 179.45 178.97 3m8p h LEU 282 N 0.20 0.00 -0.01 2.94 3.38 -1.54 -2.75 115.31 117.52 3m8p h LEU 282 Ca 0.75 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.72 3m8p h LEU 282 Cb 2.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.90 3m8p h LEU 282 CO -0.42 0.05 -0.13 0.18 0.09 0.00 0.00 178.44 178.21 3m8p n LEU 283 N -3.55 0.15 -4.77 1.67 4.77 0.94 -4.85 117.00 111.37 3m8p n LEU 283 Ca -0.02 0.35 -0.39 0.00 -0.03 0.00 0.00 56.01 55.91 3m8p n LEU 283 Cb 0.16 -0.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.79 3m8p n LEU 283 CO 0.27 0.04 0.79 -0.13 -1.33 0.00 0.00 177.39 177.03 3m8p s ARG 284 N -2.97 4.43 0.00 3.23 0.52 -1.04 -4.64 118.95 118.49 3m8p s ARG 284 Ca 0.14 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.12 3m8p s ARG 284 Cb 0.19 -2.96 0.00 0.00 0.52 0.00 0.00 34.95 32.69 3m8p s ARG 284 CO 0.57 0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.34 3m8p n GLY 285 N 0.90 -0.90 3.59 -3.53 0.00 -1.26 -4.96 105.19 99.04 3m8p n GLY 285 Ca 0.01 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 3m8p n GLY 285 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m8p s THR 286 N 0.00 3.33 0.26 2.61 2.01 -1.26 -4.98 115.64 117.61 3m8p s THR 286 Ca 0.00 0.31 0.12 0.00 0.31 0.00 0.00 61.69 62.43 3m8p s THR 286 Cb 0.00 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.95 3m8p s THR 286 CO 0.00 -0.37 -0.21 -0.54 -0.69 0.00 0.00 174.62 172.81 3m8p s LYS 287 N 6.21 1.65 0.72 4.92 3.01 -1.26 -5.13 119.74 129.87 3m8p s LYS 287 Ca 0.84 -1.70 -0.15 0.00 -1.01 0.00 0.00 55.97 53.94 3m8p s LYS 287 Cb -0.23 -1.80 0.03 0.00 -1.01 0.00 0.00 37.83 34.83 3m8p s LYS 287 CO 0.31 0.35 1.23 0.00 0.51 0.00 0.00 175.35 177.75 3m8p s ALA 288 N -2.30 2.13 0.51 5.17 0.00 -1.26 -4.91 121.76 121.10 3m8p s ALA 288 Ca 0.28 0.97 0.30 0.00 0.00 0.00 0.00 51.96 53.51 3m8p s ALA 288 Cb -0.06 -3.50 1.71 0.00 0.00 0.00 0.00 23.12 21.27 3m8p s ALA 288 CO 0.14 -1.89 2.18 -0.07 0.00 0.00 0.00 175.76 176.11 3m8p h LEU 289 N -0.19 0.00 0.00 0.00 4.07 -2.00 -2.63 115.31 114.57 3m8p h LEU 289 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.48 3m8p h LEU 289 Cb 1.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.05 3m8p h LEU 289 CO 0.50 0.05 -1.05 0.35 -1.08 0.00 0.00 178.44 177.21 3m8p n THR 290 N -3.66 0.39 -1.65 0.22 -2.24 -1.26 -1.23 114.28 104.84 3m8p n THR 290 Ca -0.02 -0.42 -0.47 0.00 -2.27 0.00 0.00 64.05 60.87 3m8p n THR 290 Cb 0.15 -0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 3m8p n THR 290 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3m8p n GLU 291 N -2.35 1.95 -2.83 -0.78 2.13 -0.99 -4.68 120.64 113.09 3m8p n GLU 291 Ca 0.01 0.70 -0.42 0.00 0.66 0.00 0.00 57.16 58.11 3m8p n GLU 291 Cb 0.50 -2.43 -0.04 0.00 0.27 0.00 0.00 31.44 29.74 3m8p n GLU 291 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3m8p s VAL 292 N 0.69 4.88 -0.29 6.31 1.01 -1.26 -0.92 120.40 130.82 3m8p s VAL 292 Ca 0.78 1.77 -0.09 0.00 0.00 0.00 0.00 61.98 64.44 3m8p s VAL 292 Cb -0.72 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 31.44 3m8p s VAL 292 CO 0.41 0.07 0.13 -0.63 0.00 0.00 0.00 175.10 175.08 3m8p s ILE 293 N 1.77 4.59 0.09 2.22 -1.09 0.22 -4.96 121.20 124.04 3m8p s ILE 293 Ca 0.43 -0.28 -0.36 0.00 -2.23 0.00 0.00 60.65 58.21 3m8p s ILE 293 Cb -0.18 -3.26 -0.16 0.00 -1.58 0.00 0.00 42.46 37.28 3m8p s ILE 293 CO 0.17 0.17 1.45 -2.65 -1.23 0.00 0.00 174.94 172.85 3m8p n PRO 294 N 4.97 1.49 -2.51 2.79 -0.02 -1.26 -4.44 135.00 136.02 3m8p n PRO 294 Ca -0.15 0.54 -0.40 0.00 -2.02 0.00 0.00 63.50 61.47 3m8p n PRO 294 Cb 0.50 -2.23 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 3m8p n PRO 294 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m8p s LEU 295 N 0.86 4.54 0.84 2.45 1.02 -1.26 -5.05 118.68 122.09 3m8p s LEU 295 Ca 0.84 2.20 -0.13 0.00 0.02 0.00 0.00 54.13 57.05 3m8p s LEU 295 Cb -0.87 -3.62 0.11 0.00 0.02 0.00 0.00 46.19 41.83 3m8p s LEU 295 CO 0.45 -0.14 1.21 0.42 0.02 0.00 0.00 176.35 178.31 3m8p s THR 296 N -0.91 2.00 0.18 5.49 -4.23 -1.26 -4.92 115.64 111.99 3m8p s THR 296 Ca 0.46 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.86 3m8p s THR 296 Cb -0.31 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.61 3m8p s THR 296 CO 0.39 0.00 1.67 -0.08 -0.54 0.00 0.00 174.62 176.06 3m8p h GLU 297 N -1.19 1.02 -0.06 3.99 4.57 -1.98 -2.12 114.58 118.81 3m8p h GLU 297 Ca -0.46 -0.27 -0.17 0.00 -1.18 0.00 0.00 59.36 57.28 3m8p h GLU 297 Cb 1.31 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 3m8p h GLU 297 CO 0.60 0.95 -0.71 0.93 -1.18 0.00 0.00 179.01 179.60 3m8p h GLU 298 N 0.93 0.30 -0.45 1.92 3.07 -1.96 0.68 114.58 119.06 3m8p h GLU 298 Ca 0.19 -0.24 -0.08 0.00 -0.50 0.00 0.00 59.36 58.72 3m8p h GLU 298 Cb 0.42 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 3m8p h GLU 298 CO 0.01 0.89 -0.06 0.00 -1.40 0.00 0.00 179.01 178.45 3m8p h ALA 299 N 1.04 1.04 -0.17 3.43 0.00 -1.79 0.35 119.26 123.16 3m8p h ALA 299 Ca -0.02 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 3m8p h ALA 299 Cb 1.27 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.89 3m8p h ALA 299 CO 0.12 0.59 -0.54 1.49 0.00 0.00 0.00 179.25 180.91 3m8p h GLU 300 N 0.72 0.66 -0.65 0.00 4.57 -0.54 0.40 114.58 119.75 3m8p h GLU 300 Ca 0.13 -0.49 0.14 0.00 -1.18 0.00 0.00 59.36 57.96 3m8p h GLU 300 Cb 0.53 0.08 -0.11 0.00 -0.16 0.00 0.00 28.75 29.10 3m8p h GLU 300 CO 0.03 1.11 0.05 -0.07 -1.18 0.00 0.00 179.01 178.95 3m8p h LEU 301 N 0.34 -0.19 -0.45 1.64 4.07 0.37 -2.49 115.31 118.60 3m8p h LEU 301 Ca -0.02 0.15 -0.15 0.00 0.08 0.00 0.00 57.88 57.94 3m8p h LEU 301 Cb 1.16 0.25 -0.01 0.00 1.08 0.00 0.00 40.66 43.14 3m8p h LEU 301 CO 0.11 -0.09 -0.35 -0.08 -1.08 0.00 0.00 178.44 176.96 3m8p h GLU 302 N 0.16 0.92 -0.41 1.13 4.81 -0.40 -3.06 114.58 117.73 3m8p h GLU 302 Ca 0.35 -0.46 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 3m8p h GLU 302 Cb 0.57 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 3m8p h GLU 302 CO -0.52 1.12 -0.02 1.25 -0.73 0.00 0.00 179.01 180.10 3m8p h LEU 303 N 0.76 0.63 -0.47 1.64 5.85 -0.65 -2.47 115.31 120.60 3m8p h LEU 303 Ca 0.07 -0.14 -0.17 0.00 0.84 0.00 0.00 57.88 58.48 3m8p h LEU 303 Cb 0.93 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 3m8p h LEU 303 CO 0.09 0.71 -0.66 0.00 -0.34 0.00 0.00 178.44 178.24 3m8p h ALA 304 N 1.36 0.66 -0.16 1.25 0.00 -1.47 -2.10 119.26 118.80 3m8p h ALA 304 Ca 0.12 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 3m8p h ALA 304 Cb 0.42 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3m8p h ALA 304 CO 0.02 0.74 -0.24 1.49 0.00 0.00 0.00 179.25 181.25 3m8p h GLU 305 N 0.30 0.29 -0.23 0.00 4.81 -1.35 -1.19 114.58 117.21 3m8p h GLU 305 Ca -0.02 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.04 3m8p h GLU 305 Cb 1.22 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 3m8p h GLU 305 CO 0.12 0.52 -0.17 -0.91 -0.73 0.00 0.00 179.01 177.83 3m8p h ASN 306 N 0.26 0.54 -0.86 1.04 2.35 -1.40 -2.77 115.58 114.74 3m8p h ASN 306 Ca 0.04 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 55.36 3m8p h ASN 306 Cb 0.57 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.74 3m8p h ASN 306 CO 0.04 0.88 0.57 0.03 -1.65 0.00 0.00 177.43 177.29 3m8p h ARG 307 N 0.21 1.09 -0.86 0.81 3.08 -0.77 -1.81 114.38 116.12 3m8p h ARG 307 Ca 0.04 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.04 3m8p h ARG 307 Cb 0.70 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 30.46 3m8p h ARG 307 CO 0.05 0.72 0.57 0.93 -1.07 0.00 0.00 179.97 181.17 3m8p h GLU 308 N 1.12 1.13 0.00 0.04 4.39 -1.16 -0.99 114.58 119.11 3m8p h GLU 308 Ca 0.33 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.88 3m8p h GLU 308 Cb -0.06 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.32 3m8p h GLU 308 CO -0.08 0.75 -0.37 0.82 -1.16 0.00 0.00 179.01 178.96 3m8p h ILE 309 N 1.16 0.96 0.00 3.13 2.04 -1.07 -3.16 117.51 120.57 3m8p h ILE 309 Ca 0.32 -1.45 -0.29 0.00 1.00 0.00 0.00 64.86 64.44 3m8p h ILE 309 Cb -0.13 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 3m8p h ILE 309 CO -0.07 0.37 -1.91 0.18 0.00 0.00 0.00 178.15 176.72 3m8p n LEU 310 N -3.65 0.56 -0.37 1.44 4.77 -0.75 -4.57 117.00 114.43 3m8p n LEU 310 Ca -0.01 0.26 0.04 0.00 -0.03 0.00 0.00 56.01 56.27 3m8p n LEU 310 Cb 0.48 0.26 0.11 0.00 -2.33 0.00 0.00 43.42 41.94 3m8p n LEU 310 CO 0.37 0.38 0.64 2.29 -1.33 0.00 0.00 177.39 179.74 3m8p n LYS 311 N -2.90 -0.14 -3.93 3.23 2.85 -0.41 -4.19 118.16 112.67 3m8p n LYS 311 Ca -0.21 1.55 -0.36 0.00 -1.05 0.00 0.00 58.31 58.25 3m8p n LYS 311 Cb 1.05 -2.31 -0.08 0.00 -0.65 0.00 0.00 35.03 33.04 3m8p n LYS 311 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3m8p s GLU 312 N -6.16 3.66 0.52 -1.58 0.41 -1.26 -5.08 118.70 109.21 3m8p s GLU 312 Ca -0.15 -0.23 -0.22 0.00 -0.41 0.00 0.00 54.97 53.97 3m8p s GLU 312 Cb 0.25 -3.20 -0.06 0.00 -1.78 0.00 0.00 34.13 29.35 3m8p s GLU 312 CO 0.76 0.56 1.26 -2.14 -0.49 0.00 0.00 175.26 175.20 3m8p s PRO 313 N -0.41 3.35 0.01 0.39 0.02 -1.26 -4.99 135.00 132.11 3m8p s PRO 313 Ca 0.11 1.98 0.06 0.00 0.02 0.00 0.00 61.00 63.17 3m8p s PRO 313 Cb -0.12 -2.26 -0.02 0.00 0.02 0.00 0.00 34.50 32.12 3m8p s PRO 313 CO 0.02 -0.94 -0.19 0.08 -0.33 0.00 0.00 177.00 175.63 3m8p s VAL 314 N -1.45 1.53 0.32 3.83 1.01 -1.26 -5.15 120.40 119.23 3m8p s VAL 314 Ca 0.69 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.77 3m8p s VAL 314 Cb -0.34 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 3m8p s VAL 314 CO 0.40 0.31 -0.01 -1.00 0.00 0.00 0.00 175.10 174.81 3m8p s HIS 315 N -0.60 2.09 0.28 5.22 3.76 -1.26 -4.75 115.29 120.03 3m8p s HIS 315 Ca 0.07 -0.77 0.05 0.00 -0.15 0.00 0.00 55.06 54.26 3m8p s HIS 315 Cb -0.08 -1.31 -0.06 0.00 1.11 0.00 0.00 32.58 32.24 3m8p s HIS 315 CO 0.00 0.24 -0.02 0.20 -0.85 0.00 0.00 174.74 174.31 3m8p s GLY 316 N -3.52 1.81 0.40 -2.22 0.00 0.14 -4.83 107.32 99.11 3m8p s GLY 316 Ca 0.33 -1.90 0.08 0.00 0.00 0.00 0.00 44.72 43.22 3m8p s GLY 316 CO 0.15 -1.80 0.34 0.54 0.00 0.00 0.00 173.10 172.33 3m8p s VAL 317 N -3.16 2.73 0.54 1.40 0.11 -0.49 -1.78 120.40 119.75 3m8p s VAL 317 Ca 0.30 -1.40 0.06 0.00 -2.93 0.00 0.00 61.98 58.02 3m8p s VAL 317 Cb 0.05 -3.02 0.06 0.00 -1.53 0.00 0.00 36.38 31.94 3m8p s VAL 317 CO 0.12 -0.03 0.49 -1.22 -3.33 0.00 0.00 175.10 171.13 3m8p n TYR 318 N -1.48 -1.02 -3.96 1.54 0.53 -1.26 -4.57 117.16 106.93 3m8p n TYR 318 Ca 0.02 -2.20 -0.34 0.00 -1.02 0.00 0.00 57.90 54.36 3m8p n TYR 318 Cb 0.62 -0.46 -0.06 0.00 -1.03 0.00 0.00 39.34 38.41 3m8p n TYR 318 CO 0.00 0.00 0.00 -0.47 -1.02 0.00 0.00 176.86 175.37 3m8p s TYR 319 N -2.61 3.49 -0.28 -0.72 5.04 0.56 -4.92 117.35 117.90 3m8p s TYR 319 Ca 0.37 0.35 0.03 0.00 -2.44 0.00 0.00 57.07 55.38 3m8p s TYR 319 Cb -0.03 -1.83 0.07 0.00 0.35 0.00 0.00 41.96 40.52 3m8p s TYR 319 CO 0.24 0.64 -0.05 0.34 -1.34 0.00 0.00 175.55 175.37 3m8p s ASP 320 N -1.69 4.41 0.00 4.32 3.68 -1.26 -4.47 116.67 121.66 3m8p s ASP 320 Ca 0.24 -1.56 0.20 0.00 2.13 0.00 0.00 52.55 53.56 3m8p s ASP 320 Cb -0.12 -1.48 0.97 0.00 -1.45 0.00 0.00 42.92 40.83 3m8p s ASP 320 CO 0.14 -0.25 1.62 -0.81 0.13 0.00 0.00 175.17 176.00 3m8p n PRO 321 N 4.44 0.23 0.01 4.34 -0.04 -1.26 -2.29 135.00 140.42 3m8p n PRO 321 Ca -0.09 0.11 -0.18 0.00 -0.04 0.00 0.00 63.50 63.31 3m8p n PRO 321 Cb 0.42 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.27 3m8p n PRO 321 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3m8p h SER 322 N 0.00 0.53 -4.28 3.54 4.64 -2.05 -3.47 113.55 112.47 3m8p h SER 322 Ca 0.00 -0.78 -0.48 0.00 -0.47 0.00 0.00 61.79 60.06 3m8p h SER 322 Cb 0.21 -0.16 0.08 0.00 -0.31 0.00 0.00 62.40 62.22 3m8p h SER 322 CO 0.00 1.24 0.35 -0.54 -0.87 0.00 0.00 176.83 177.02 3m8p s LYS 323 N -3.14 2.74 0.31 4.77 1.02 -0.97 -5.09 119.74 119.38 3m8p s LYS 323 Ca -0.13 0.28 -0.09 0.00 0.02 0.00 0.00 55.97 56.05 3m8p s LYS 323 Cb 0.03 -2.08 -0.07 0.00 -0.52 0.00 0.00 37.83 35.20 3m8p s LYS 323 CO 0.82 -1.03 0.64 -0.51 -0.92 0.00 0.00 175.35 174.35 3m8p s ASP 324 N -4.38 6.57 0.06 2.83 -0.00 -1.26 -4.91 116.67 115.59 3m8p s ASP 324 Ca 0.58 0.98 -0.24 0.00 -0.00 0.00 0.00 52.55 53.87 3m8p s ASP 324 Cb -0.11 -2.25 -0.06 0.00 -0.00 0.00 0.00 42.92 40.50 3m8p s ASP 324 CO 0.50 -0.21 0.72 -0.76 -0.00 0.00 0.00 175.17 175.41 3m8p s LEU 325 N -3.31 4.48 -0.05 1.23 1.02 -1.26 -4.39 118.68 116.40 3m8p s LEU 325 Ca 0.49 1.41 0.07 0.00 0.02 0.00 0.00 54.13 56.11 3m8p s LEU 325 Cb -0.11 -3.15 -0.01 0.00 0.02 0.00 0.00 46.19 42.94 3m8p s LEU 325 CO 0.25 0.09 -0.25 -0.63 0.02 0.00 0.00 176.35 175.84 3m8p s ILE 326 N -0.38 2.03 -0.10 -0.59 1.09 0.35 -1.57 121.20 122.03 3m8p s ILE 326 Ca 0.36 -1.06 0.01 0.00 -1.10 0.00 0.00 60.65 58.85 3m8p s ILE 326 Cb -0.20 -1.71 0.02 0.00 -1.06 0.00 0.00 42.46 39.51 3m8p s ILE 326 CO 0.22 0.57 -0.11 0.00 -0.10 0.00 0.00 174.94 175.52 3m8p s ALA 327 N -0.27 1.42 -0.07 9.38 0.00 0.28 -1.88 121.76 130.64 3m8p s ALA 327 Ca -0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 3m8p s ALA 327 Cb -0.13 -0.80 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 3m8p s ALA 327 CO 0.02 -0.18 -0.01 -1.21 0.00 0.00 0.00 175.76 174.38 3m8p s GLU 328 N 1.23 2.92 0.07 0.00 2.02 -0.82 -1.30 118.70 122.81 3m8p s GLU 328 Ca -0.03 -0.46 0.09 0.00 0.02 0.00 0.00 54.97 54.59 3m8p s GLU 328 Cb -0.14 -2.74 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 3m8p s GLU 328 CO -0.04 0.68 -0.26 0.42 0.02 0.00 0.00 175.26 176.09 3m8p s ILE 329 N -0.91 2.10 0.06 -1.63 1.01 -1.12 -1.85 121.20 118.87 3m8p s ILE 329 Ca 0.14 -1.47 0.04 0.00 0.00 0.00 0.00 60.65 59.37 3m8p s ILE 329 Cb -0.11 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 3m8p s ILE 329 CO 0.04 0.27 -0.12 -1.10 0.00 0.00 0.00 174.94 174.02 3m8p s GLN 330 N -1.45 0.73 -0.25 2.79 1.11 0.07 -4.39 119.66 118.28 3m8p s GLN 330 Ca 0.12 -0.88 -0.20 0.00 0.01 0.00 0.00 55.36 54.41 3m8p s GLN 330 Cb -0.10 -0.67 -0.02 0.00 -1.01 0.00 0.00 33.01 31.21 3m8p s GLN 330 CO 0.03 0.14 0.61 0.21 0.01 0.00 0.00 175.29 176.29 3m8p s LYS 331 N -1.65 4.11 0.00 2.91 2.20 -1.26 -1.16 119.74 124.89 3m8p s LYS 331 Ca -0.04 0.51 0.14 0.00 -0.36 0.00 0.00 55.97 56.21 3m8p s LYS 331 Cb -0.10 -3.64 0.18 0.00 -1.51 0.00 0.00 37.83 32.76 3m8p s LYS 331 CO 0.02 -0.38 1.04 0.00 -0.36 0.00 0.00 175.35 175.67 3m8p n GLN 332 N 5.61 1.44 -3.80 4.03 10.64 0.16 -4.54 117.38 130.92 3m8p n GLN 332 Ca -0.01 -1.56 0.00 0.00 -1.83 0.00 0.00 57.00 53.60 3m8p n GLN 332 Cb 0.49 -1.28 0.00 0.00 -0.86 0.00 0.00 30.24 28.59 3m8p n GLN 332 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3m8p n GLY 333 N 0.77 -0.87 3.69 2.61 0.00 -1.12 -4.95 105.19 105.32 3m8p n GLY 333 Ca 0.10 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 3m8p n GLY 333 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m8p s GLN 334 N -1.61 4.38 0.00 1.61 -1.52 -1.26 -2.81 119.66 118.45 3m8p s GLN 334 Ca 0.00 1.56 0.00 0.00 -1.95 0.00 0.00 55.36 54.97 3m8p s GLN 334 Cb 0.00 -3.55 0.00 0.00 -0.22 0.00 0.00 33.01 29.24 3m8p s GLN 334 CO 0.00 -0.40 0.00 0.41 -0.25 0.00 0.00 175.29 175.05 3m8p n GLY 335 N 3.26 0.48 3.25 3.09 0.00 -1.26 -4.95 105.19 109.06 3m8p n GLY 335 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 3m8p n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m8p s GLN 336 N -0.56 3.25 0.03 1.61 -0.21 -1.12 -4.16 119.66 118.50 3m8p s GLN 336 Ca 0.00 -0.70 0.08 0.00 0.02 0.00 0.00 55.36 54.76 3m8p s GLN 336 Cb 0.00 -2.82 -0.02 0.00 1.00 0.00 0.00 33.01 31.17 3m8p s GLN 336 CO 0.00 -0.15 -0.22 -1.58 -2.12 0.00 0.00 175.29 171.22 3m8p s TRP 337 N 1.28 1.97 0.02 0.91 0.52 -0.61 0.39 118.94 123.42 3m8p s TRP 337 Ca 0.03 -0.38 0.03 0.00 0.02 0.00 0.00 56.10 55.80 3m8p s TRP 337 Cb -0.14 -1.20 -0.02 0.00 -1.15 0.00 0.00 33.47 30.97 3m8p s TRP 337 CO -0.05 0.07 -0.09 -0.08 0.02 0.00 0.00 176.95 176.82 3m8p s THR 338 N -0.74 0.70 0.07 2.01 -1.32 -0.31 -1.66 115.64 114.40 3m8p s THR 338 Ca 0.09 -0.72 -0.00 0.00 -1.21 0.00 0.00 61.69 59.84 3m8p s THR 338 Cb -0.09 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.21 3m8p s THR 338 CO 0.01 -0.05 -0.02 -0.72 -2.21 0.00 0.00 174.62 171.63 3m8p s TYR 339 N -0.72 0.66 -0.02 9.09 1.13 0.02 -0.75 117.35 126.76 3m8p s TYR 339 Ca -0.01 -1.07 -0.03 0.00 -1.41 0.00 0.00 57.07 54.54 3m8p s TYR 339 Cb -0.06 -0.43 0.00 0.00 -1.10 0.00 0.00 41.96 40.37 3m8p s TYR 339 CO 0.00 -0.36 0.08 -0.65 -2.51 0.00 0.00 175.55 172.11 3m8p s GLN 340 N -3.93 0.19 -0.06 -3.49 1.11 -0.77 -0.89 119.66 111.83 3m8p s GLN 340 Ca 0.11 -0.06 0.03 0.00 0.01 0.00 0.00 55.36 55.45 3m8p s GLN 340 Cb 0.07 0.08 0.01 0.00 -1.01 0.00 0.00 33.01 32.16 3m8p s GLN 340 CO -0.07 -0.03 -0.14 0.42 0.01 0.00 0.00 175.29 175.48 3m8p s ILE 341 N -0.38 1.24 0.29 1.08 1.01 0.65 -1.95 121.20 123.14 3m8p s ILE 341 Ca -0.04 -0.57 -0.06 0.00 0.00 0.00 0.00 60.65 59.98 3m8p s ILE 341 Cb -0.03 -1.10 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 3m8p s ILE 341 CO 0.00 0.37 0.43 -0.72 0.00 0.00 0.00 174.94 175.03 3m8p s TYR 342 N 0.42 0.84 0.00 3.97 -0.85 -0.79 -0.14 117.35 120.80 3m8p s TYR 342 Ca -0.11 -1.12 0.00 0.00 -0.52 0.00 0.00 57.07 55.33 3m8p s TYR 342 Cb -0.14 -0.05 0.00 0.00 0.38 0.00 0.00 41.96 42.15 3m8p s TYR 342 CO 0.03 -1.03 0.00 1.04 -1.52 0.00 0.00 175.55 174.07 3m8p n GLN 343 N -0.47 0.00 -4.40 -3.49 6.02 -1.26 -0.50 117.38 113.30 3m8p n GLN 343 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.65 3m8p n GLN 343 Cb 0.62 -0.82 -0.11 0.00 1.02 0.00 0.00 30.24 30.95 3m8p n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3m8p s GLU 344 N -1.85 3.26 -0.01 -1.09 0.41 -1.26 -4.77 118.70 113.38 3m8p s GLU 344 Ca 0.00 -0.46 -0.35 0.00 -0.41 0.00 0.00 54.97 53.74 3m8p s GLU 344 Cb 0.00 -2.83 -0.14 0.00 -1.78 0.00 0.00 34.13 29.38 3m8p s GLU 344 CO 0.00 0.51 1.69 -2.30 -0.49 0.00 0.00 175.26 174.67 3m8p n PRO 345 N 2.73 1.87 -0.99 0.39 -0.02 -1.26 -1.12 135.00 136.60 3m8p n PRO 345 Ca -0.18 0.68 -0.06 0.00 -2.02 0.00 0.00 63.50 61.92 3m8p n PRO 345 Cb 0.53 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 3m8p n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3m8p n PHE 346 N 4.83 -0.25 -2.86 6.00 3.01 -1.26 -4.99 117.46 121.94 3m8p n PHE 346 Ca 0.21 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.23 3m8p n PHE 346 Cb 0.25 -1.91 -0.03 0.00 -0.01 0.00 0.00 39.48 37.79 3m8p n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3m8p s LYS 347 N -2.14 3.53 0.13 -1.08 -0.14 -0.28 -4.99 119.74 114.78 3m8p s LYS 347 Ca 0.00 -1.54 -0.30 0.00 -1.36 0.00 0.00 55.97 52.77 3m8p s LYS 347 Cb 0.00 -4.89 -0.07 0.00 -1.68 0.00 0.00 37.83 31.19 3m8p s LYS 347 CO 0.00 -1.85 1.16 -0.80 -0.76 0.00 0.00 175.35 173.11 3m8p s ASN 348 N 3.84 7.15 -0.16 2.83 0.01 -1.26 -4.00 114.94 123.35 3m8p s ASN 348 Ca 0.33 2.10 -0.23 0.00 -0.71 0.00 0.00 52.86 54.35 3m8p s ASN 348 Cb -0.06 -2.59 -0.23 0.00 0.41 0.00 0.00 41.25 38.77 3m8p s ASN 348 CO -0.07 -0.36 0.49 -0.07 -1.51 0.00 0.00 177.10 175.59 3m8p h LEU 349 N 5.79 0.09 -8.18 0.60 4.07 -0.79 -1.29 115.31 115.61 3m8p h LEU 349 Ca -0.43 -0.76 -0.09 0.00 0.08 0.00 0.00 57.88 56.68 3m8p h LEU 349 Cb 1.21 -0.03 -0.04 0.00 1.08 0.00 0.00 40.66 42.89 3m8p h LEU 349 CO 0.76 1.35 0.09 -1.59 -1.08 0.00 0.00 178.44 177.97 3m8p s LYS 350 N -2.34 2.03 0.21 1.13 -2.85 -1.03 -4.35 119.74 112.53 3m8p s LYS 350 Ca -0.23 -1.46 0.01 0.00 -1.00 0.00 0.00 55.97 53.28 3m8p s LYS 350 Cb 0.02 0.56 -0.05 0.00 -2.06 0.00 0.00 37.83 36.30 3m8p s LYS 350 CO 0.67 -0.91 0.08 0.99 0.10 0.00 0.00 175.35 176.28 3m8p s THR 351 N -2.88 0.41 -0.60 3.79 2.01 -0.22 -0.25 115.64 117.90 3m8p s THR 351 Ca 0.20 -1.99 0.00 0.00 0.31 0.00 0.00 61.69 60.22 3m8p s THR 351 Cb -0.03 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 70.05 3m8p s THR 351 CO 0.13 -0.16 0.00 0.61 -0.69 0.00 0.00 174.62 174.51 3m8p n GLY 352 N -0.33 -1.30 3.09 4.40 0.00 -0.07 -4.26 105.19 106.73 3m8p n GLY 352 Ca -0.02 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.89 3m8p n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m8p s LYS 353 N -1.80 0.62 -0.01 1.61 -2.85 -1.26 -0.80 119.74 115.25 3m8p s LYS 353 Ca 0.00 -1.14 0.01 0.00 -1.00 0.00 0.00 55.97 53.84 3m8p s LYS 353 Cb 0.00 0.08 -0.00 0.00 -2.06 0.00 0.00 37.83 35.85 3m8p s LYS 353 CO 0.00 -0.07 -0.05 -0.47 0.10 0.00 0.00 175.35 174.86 3m8p s TYR 354 N -3.40 0.44 -0.50 1.78 5.04 -0.66 -4.99 117.35 115.06 3m8p s TYR 354 Ca 0.04 -0.08 0.06 0.00 -2.44 0.00 0.00 57.07 54.65 3m8p s TYR 354 Cb 0.04 -0.30 0.22 0.00 0.35 0.00 0.00 41.96 42.27 3m8p s TYR 354 CO -0.07 -0.02 0.82 0.00 -1.34 0.00 0.00 175.55 174.95 3m8p n ALA 355 N 3.04 -1.55 -3.84 3.97 0.00 -1.26 -1.57 120.51 119.30 3m8p n ALA 355 Ca -0.14 -1.28 -0.25 0.00 0.00 0.00 0.00 53.44 51.77 3m8p n ALA 355 Cb 0.58 -1.39 -0.17 0.00 0.00 0.00 0.00 19.45 18.46 3m8p n ALA 355 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3m8p s ARG 356 N 0.75 1.15 -0.45 0.00 3.52 -1.26 -4.99 118.95 117.68 3m8p s ARG 356 Ca 0.31 -0.11 -0.28 0.00 -0.13 0.00 0.00 55.73 55.52 3m8p s ARG 356 Cb 0.14 -1.33 0.01 0.00 -1.56 0.00 0.00 34.95 32.21 3m8p s ARG 356 CO -0.17 -0.27 1.44 -1.64 -0.81 0.00 0.00 175.30 173.84 3m8p s MET 357 N 1.79 3.48 -0.38 5.12 -1.94 -1.26 -5.01 119.30 121.09 3m8p s MET 357 Ca 0.05 0.85 -0.21 0.00 -1.71 0.00 0.00 55.69 54.66 3m8p s MET 357 Cb -0.12 -4.06 0.01 0.00 2.01 0.00 0.00 34.83 32.66 3m8p s MET 357 CO -0.07 -1.69 0.65 1.03 -0.01 0.00 0.00 175.02 174.94 3m8p s ARG 358 N 5.14 3.57 1.94 2.03 0.52 -1.26 -4.91 118.95 125.98 3m8p s ARG 358 Ca 0.60 -0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.76 3m8p s ARG 358 Cb -0.13 -3.85 0.00 0.00 0.52 0.00 0.00 34.95 31.49 3m8p s ARG 358 CO 0.31 -0.83 0.00 0.41 0.02 0.00 0.00 175.30 175.21 3m8p n GLY 359 N 4.77 -1.41 0.13 -3.53 0.00 -1.26 -4.67 105.19 99.23 3m8p n GLY 359 Ca -0.01 -1.29 -0.19 0.00 0.00 0.00 0.00 46.02 44.53 3m8p n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m8p n ALA 360 N 1.74 1.23 -2.45 4.61 0.00 -1.26 -4.95 120.51 119.43 3m8p n ALA 360 Ca 0.00 -0.91 -0.14 0.00 0.00 0.00 0.00 53.44 52.39 3m8p n ALA 360 Cb 0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 19.45 19.00 3m8p n ALA 360 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3m8p s HIS 361 N -2.54 1.04 0.08 0.00 3.76 -1.26 -2.21 115.29 114.16 3m8p s HIS 361 Ca -0.28 -0.69 -0.27 0.00 -0.15 0.00 0.00 55.06 53.67 3m8p s HIS 361 Cb 0.08 -0.57 0.08 0.00 1.11 0.00 0.00 32.58 33.28 3m8p s HIS 361 CO 0.68 -0.02 0.94 -0.08 -0.85 0.00 0.00 174.74 175.42 3m8p s THR 362 N -2.59 0.00 0.16 1.30 -1.32 -0.84 -4.99 115.64 107.35 3m8p s THR 362 Ca 0.06 -0.37 0.07 0.00 -1.21 0.00 0.00 61.69 60.24 3m8p s THR 362 Cb -0.02 -1.58 -0.04 0.00 -1.51 0.00 0.00 72.50 69.35 3m8p s THR 362 CO -0.01 0.00 -0.14 0.54 -2.21 0.00 0.00 174.62 172.80 3m8p s ASN 363 N -2.75 2.25 0.31 8.08 2.20 -1.26 -1.00 114.94 122.77 3m8p s ASN 363 Ca 0.09 -0.91 0.07 0.00 -0.94 0.00 0.00 52.86 51.17 3m8p s ASN 363 Cb -0.01 -0.09 0.83 0.00 -2.00 0.00 0.00 41.25 39.98 3m8p s ASN 363 CO -0.03 -0.16 1.69 0.44 -2.94 0.00 0.00 177.10 176.11 3m8p h ASP 364 N 3.09 0.42 -0.08 3.54 3.32 -1.92 -1.45 116.42 123.33 3m8p h ASP 364 Ca -0.39 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 3m8p h ASP 364 Cb 1.20 0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.87 3m8p h ASP 364 CO 0.56 -0.02 0.01 0.58 -1.72 0.00 0.00 179.24 178.65 3m8p h VAL 365 N 0.41 1.23 -0.76 -1.35 2.07 -1.96 -0.21 116.25 115.68 3m8p h VAL 365 Ca 0.61 -0.71 0.11 0.00 0.82 0.00 0.00 66.70 67.53 3m8p h VAL 365 Cb 1.22 1.54 -0.08 0.00 -1.52 0.00 0.00 31.29 32.45 3m8p h VAL 365 CO -0.54 0.20 0.38 0.11 0.02 0.00 0.00 177.57 177.74 3m8p h LYS 366 N -0.11 0.61 -0.61 1.57 1.57 -1.87 -2.15 116.57 115.58 3m8p h LYS 366 Ca 0.03 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3m8p h LYS 366 Cb 0.30 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 3m8p h LYS 366 CO 0.00 0.40 0.10 1.96 -0.57 0.00 0.00 179.45 181.34 3m8p h GLN 367 N 0.63 0.99 -0.79 3.15 4.20 -0.88 -1.66 115.11 120.74 3m8p h GLN 367 Ca 0.38 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 3m8p h GLN 367 Cb 0.44 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3m8p h GLN 367 CO -0.29 0.91 0.34 1.25 -0.67 0.00 0.00 178.83 180.37 3m8p h LEU 368 N 0.93 1.06 -0.74 1.46 5.85 -0.40 -0.68 115.31 122.80 3m8p h LEU 368 Ca 0.19 -0.16 -0.13 0.00 0.84 0.00 0.00 57.88 58.63 3m8p h LEU 368 Cb 0.40 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3m8p h LEU 368 CO 0.01 0.93 -0.39 0.74 -0.34 0.00 0.00 178.44 179.38 3m8p h THR 369 N 1.13 1.30 -0.10 1.05 2.02 -1.11 0.12 112.91 117.33 3m8p h THR 369 Ca 0.27 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 3m8p h THR 369 Cb 0.17 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 3m8p h THR 369 CO -0.03 0.48 0.02 -0.33 0.37 0.00 0.00 175.52 176.04 3m8p h GLU 370 N 0.41 0.16 -0.62 6.66 5.08 -0.95 0.02 114.58 125.33 3m8p h GLU 370 Ca 0.04 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 3m8p h GLU 370 Cb 0.87 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.03 3m8p h GLU 370 CO 0.07 0.34 0.25 0.00 -1.00 0.00 0.00 179.01 178.67 3m8p h ALA 371 N 0.82 0.81 -0.71 3.43 0.00 -0.72 -1.19 119.26 121.70 3m8p h ALA 371 Ca 0.03 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3m8p h ALA 371 Cb 0.25 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3m8p h ALA 371 CO 0.00 -0.16 0.35 0.28 0.00 0.00 0.00 179.25 179.71 3m8p h VAL 372 N 0.45 1.23 -0.81 0.00 2.07 -0.42 -2.10 116.25 116.68 3m8p h VAL 372 Ca 0.31 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 3m8p h VAL 372 Cb 0.37 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 3m8p h VAL 372 CO -0.29 0.27 0.34 -0.61 0.02 0.00 0.00 177.57 177.29 3m8p h GLN 373 N 0.99 1.20 0.09 1.57 5.75 -0.03 0.96 115.11 125.64 3m8p h GLN 373 Ca 0.24 -0.21 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 3m8p h GLN 373 Cb 0.11 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.46 3m8p h GLN 373 CO -0.03 0.96 -0.04 -0.22 -2.65 0.00 0.00 178.83 176.84 3m8p h LYS 374 N 1.17 -0.12 -0.24 1.69 3.11 -0.87 -2.36 116.57 118.95 3m8p h LYS 374 Ca 0.27 0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 58.08 3m8p h LYS 374 Cb 0.20 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.44 3m8p h LYS 374 CO -0.02 -0.06 -0.02 0.82 -2.81 0.00 0.00 179.45 177.36 3m8p h ILE 375 N -0.15 1.16 -0.43 2.00 2.04 -1.15 -1.05 117.51 119.93 3m8p h ILE 375 Ca -0.01 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 3m8p h ILE 375 Cb 0.12 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 3m8p h ILE 375 CO 0.02 0.21 0.08 0.74 0.00 0.00 0.00 178.15 179.20 3m8p h THR 376 N 0.34 1.24 -0.31 -0.27 2.02 -0.58 -0.40 112.91 114.96 3m8p h THR 376 Ca 0.08 -0.87 -0.07 0.00 0.77 0.00 0.00 66.41 66.32 3m8p h THR 376 Cb 0.26 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 3m8p h THR 376 CO 0.01 0.30 -0.09 0.74 0.37 0.00 0.00 175.52 176.85 3m8p h THR 377 N 0.57 1.28 -0.91 3.16 2.02 -1.19 -2.18 112.91 115.66 3m8p h THR 377 Ca 0.13 -1.14 0.09 0.00 0.77 0.00 0.00 66.41 66.26 3m8p h THR 377 Cb 0.36 1.38 -0.07 0.00 -1.74 0.00 0.00 68.15 68.08 3m8p h THR 377 CO 0.01 0.37 0.56 -0.08 0.37 0.00 0.00 175.52 176.74 3m8p h GLU 378 N 0.38 0.92 -0.28 6.66 4.81 -1.10 -1.80 114.58 124.16 3m8p h GLU 378 Ca 0.08 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.13 3m8p h GLU 378 Cb 0.58 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3m8p h GLU 378 CO 0.03 0.61 -0.31 0.77 -0.73 0.00 0.00 179.01 179.38 3m8p h SER 379 N 0.95 0.62 -0.92 1.04 0.02 -0.82 -2.06 113.55 112.38 3m8p h SER 379 Ca 0.43 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 61.17 3m8p h SER 379 Cb 0.33 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 3m8p h SER 379 CO -0.23 0.90 0.60 0.40 -1.14 0.00 0.00 176.83 177.36 3m8p h ILE 380 N 0.51 1.14 0.36 3.27 2.04 -0.71 0.31 117.51 124.44 3m8p h ILE 380 Ca 0.06 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 3m8p h ILE 380 Cb 0.80 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3m8p h ILE 380 CO 0.07 0.21 -0.17 0.58 0.00 0.00 0.00 178.15 178.83 3m8p h VAL 381 N 1.13 0.53 -0.14 1.67 2.07 -0.88 -1.74 116.25 118.89 3m8p h VAL 381 Ca 0.37 -0.64 -0.15 0.00 0.82 0.00 0.00 66.70 67.10 3m8p h VAL 381 Cb 0.05 0.80 0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3m8p h VAL 381 CO -0.12 0.10 -0.50 0.40 0.02 0.00 0.00 177.57 177.47 3m8p h ILE 382 N -0.89 1.34 -0.00 4.57 2.04 -1.21 -3.38 117.51 119.98 3m8p h ILE 382 Ca -0.05 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.04 3m8p h ILE 382 Cb 0.53 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 3m8p h ILE 382 CO 0.08 0.54 -0.24 0.79 0.00 0.00 0.00 178.15 179.32 3m8p n TRP 383 N -4.20 0.00 -0.90 1.37 8.01 0.11 -4.69 117.44 117.14 3m8p n TRP 383 Ca -0.07 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.12 3m8p n TRP 383 Cb 0.60 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.90 3m8p n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3m8p n GLY 384 N 1.00 0.54 3.08 6.99 0.00 -0.65 -4.97 105.19 111.17 3m8p n GLY 384 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3m8p n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m8p s LYS 385 N -0.45 0.48 0.30 1.61 -2.85 -1.24 -4.89 119.74 112.70 3m8p s LYS 385 Ca 0.00 -0.63 -0.08 0.00 -1.00 0.00 0.00 55.97 54.26 3m8p s LYS 385 Cb 0.00 0.19 -0.06 0.00 -2.06 0.00 0.00 37.83 35.89 3m8p s LYS 385 CO 0.00 -0.11 0.61 0.95 0.10 0.00 0.00 175.35 176.90 3m8p s THR 386 N -1.99 4.92 0.80 3.79 -4.23 -1.26 -3.93 115.64 113.73 3m8p s THR 386 Ca -0.10 0.38 -0.05 0.00 -1.18 0.00 0.00 61.69 60.74 3m8p s THR 386 Cb -0.05 -3.69 0.16 0.00 1.34 0.00 0.00 72.50 70.26 3m8p s THR 386 CO -0.02 -0.27 1.09 -2.16 -0.54 0.00 0.00 174.62 172.72 3m8p s PRO 387 N -3.34 1.32 -0.15 3.99 0.04 -1.26 -4.85 135.00 130.74 3m8p s PRO 387 Ca 0.47 -1.00 -0.06 0.00 0.04 0.00 0.00 61.00 60.45 3m8p s PRO 387 Cb -0.11 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 3m8p s PRO 387 CO 0.26 -1.76 0.07 0.15 0.04 0.00 0.00 177.00 175.76 3m8p s LYS 388 N -5.36 3.70 0.28 4.56 3.01 -0.61 -4.72 119.74 120.60 3m8p s LYS 388 Ca 0.69 -0.30 0.04 0.00 -1.01 0.00 0.00 55.97 55.39 3m8p s LYS 388 Cb -0.04 -3.15 -0.03 0.00 -1.01 0.00 0.00 37.83 33.60 3m8p s LYS 388 CO 0.47 0.46 0.42 -0.06 0.51 0.00 0.00 175.35 177.15 3m8p s PHE 389 N -0.15 3.44 -0.31 3.18 0.08 -0.92 0.10 117.98 123.42 3m8p s PHE 389 Ca 0.08 0.08 -0.03 0.00 0.12 0.00 0.00 56.93 57.18 3m8p s PHE 389 Cb -0.12 -1.69 0.11 0.00 -0.57 0.00 0.00 43.02 40.75 3m8p s PHE 389 CO 0.01 0.32 0.16 0.15 -0.10 0.00 0.00 175.22 175.76 3m8p s LYS 390 N -4.09 0.30 0.02 0.44 -0.14 -0.42 -2.63 119.74 113.22 3m8p s LYS 390 Ca 0.36 -0.72 0.03 0.00 -1.36 0.00 0.00 55.97 54.29 3m8p s LYS 390 Cb -0.09 -1.16 -0.04 0.00 -1.68 0.00 0.00 37.83 34.86 3m8p s LYS 390 CO 0.31 -1.07 -0.04 -0.51 -0.76 0.00 0.00 175.35 173.28 3m8p s LEU 391 N 1.83 3.30 -0.98 3.17 1.43 0.54 -2.80 118.68 125.18 3m8p s LEU 391 Ca 0.12 -0.13 -0.05 0.00 -1.03 0.00 0.00 54.13 53.03 3m8p s LEU 391 Cb -0.18 -1.93 0.05 0.00 0.03 0.00 0.00 46.19 44.16 3m8p s LEU 391 CO -0.26 0.26 2.66 -0.81 0.23 0.00 0.00 176.35 178.43 3m8p n PRO 392 N 1.28 3.62 -3.82 1.29 -0.04 -1.26 -0.78 135.00 135.29 3m8p n PRO 392 Ca -0.14 -2.80 -0.12 0.00 -0.04 0.00 0.00 63.50 60.40 3m8p n PRO 392 Cb 0.52 -2.45 -0.11 0.00 -0.04 0.00 0.00 33.50 31.43 3m8p n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3m8p s ILE 393 N -1.01 0.04 0.40 0.52 2.07 -1.26 -0.28 121.20 121.68 3m8p s ILE 393 Ca 0.58 -0.30 -0.24 0.00 -1.41 0.00 0.00 60.65 59.29 3m8p s ILE 393 Cb 0.26 -0.37 -0.09 0.00 0.13 0.00 0.00 42.46 42.38 3m8p s ILE 393 CO -0.13 -0.17 1.01 -1.10 -1.91 0.00 0.00 174.94 172.65 3m8p s GLN 394 N -0.58 4.23 0.54 3.50 -1.52 -1.26 -4.53 119.66 120.04 3m8p s GLN 394 Ca -0.07 1.40 0.24 0.00 -1.95 0.00 0.00 55.36 54.98 3m8p s GLN 394 Cb -0.04 -2.50 1.43 0.00 -0.22 0.00 0.00 33.01 31.69 3m8p s GLN 394 CO 0.01 -0.07 2.06 0.87 -0.25 0.00 0.00 175.29 177.92 3m8p h LYS 395 N 2.46 0.00 0.05 2.91 1.79 -1.99 -1.57 116.57 120.23 3m8p h LYS 395 Ca -0.48 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 57.74 3m8p h LYS 395 Cb 1.21 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.84 3m8p h LYS 395 CO 0.62 0.00 -1.17 1.49 -1.08 0.00 0.00 179.45 179.32 3m8p h GLU 396 N 0.00 0.11 -0.60 3.15 4.81 -1.98 -0.44 114.58 119.62 3m8p h GLU 396 Ca 0.14 -0.18 -0.07 0.00 -0.13 0.00 0.00 59.36 59.12 3m8p h GLU 396 Cb 0.61 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 3m8p h GLU 396 CO -0.00 1.05 0.09 1.15 -0.73 0.00 0.00 179.01 180.56 3m8p h THR 397 N 0.03 1.26 -0.47 0.32 2.02 -1.68 -2.07 112.91 112.32 3m8p h THR 397 Ca -0.09 -1.02 -0.11 0.00 0.77 0.00 0.00 66.41 65.97 3m8p h THR 397 Cb 1.87 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 3m8p h THR 397 CO 0.15 0.37 -0.13 -0.25 0.37 0.00 0.00 175.52 176.04 3m8p h TRP 398 N 0.91 0.98 -0.20 3.16 2.91 -1.20 -2.45 115.95 120.05 3m8p h TRP 398 Ca 0.18 -0.20 -0.02 0.00 1.13 0.00 0.00 58.89 59.98 3m8p h TRP 398 Cb 0.44 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 28.84 3m8p h TRP 398 CO 0.03 0.95 0.03 1.49 -1.03 0.00 0.00 178.44 179.91 3m8p h GLU 399 N 0.78 0.34 -0.61 2.65 4.81 -1.02 -2.21 114.58 119.31 3m8p h GLU 399 Ca 0.12 -0.09 0.05 0.00 -0.13 0.00 0.00 59.36 59.31 3m8p h GLU 399 Cb 0.65 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.94 3m8p h GLU 399 CO 0.05 0.49 0.34 1.15 -0.73 0.00 0.00 179.01 180.30 3m8p h THR 400 N 0.14 0.99 0.23 0.32 2.02 -1.30 -2.98 112.91 112.32 3m8p h THR 400 Ca 0.06 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3m8p h THR 400 Cb 0.31 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 3m8p h THR 400 CO 0.00 0.12 -0.11 -0.25 0.37 0.00 0.00 175.52 175.65 3m8p h TRP 401 N 0.65 -0.29 -0.66 3.16 2.91 -1.31 -3.16 115.95 117.26 3m8p h TRP 401 Ca 0.27 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.29 3m8p h TRP 401 Cb 0.14 0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.85 3m8p h TRP 401 CO -0.08 0.08 0.43 0.11 -1.03 0.00 0.00 178.44 177.95 3m8p h TRP 402 N -0.76 0.81 0.03 2.65 5.08 -1.42 -0.06 115.95 122.29 3m8p h TRP 402 Ca -0.03 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 59.96 3m8p h TRP 402 Cb 0.50 -0.27 0.00 0.00 -3.00 0.00 0.00 29.16 26.39 3m8p h TRP 402 CO 0.05 0.50 -0.01 1.79 -1.28 0.00 0.00 178.44 179.48 3m8p h THR 403 N 0.86 1.41 0.00 0.12 1.35 -1.62 -3.23 112.91 111.82 3m8p h THR 403 Ca 0.25 -1.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 3m8p h THR 403 Cb -0.06 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3m8p h THR 403 CO -0.06 0.43 0.00 -0.62 -0.25 0.00 0.00 175.52 175.02 3m8p n GLU 404 N -4.73 0.13 -3.12 4.72 1.02 -1.18 -4.78 120.64 112.69 3m8p n GLU 404 Ca -0.09 0.30 -0.34 0.00 -0.02 0.00 0.00 57.16 57.01 3m8p n GLU 404 Cb 0.35 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 3m8p n GLU 404 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3m8p s TYR 405 N -3.16 3.49 -1.24 -0.32 5.04 -0.04 -5.02 117.35 116.11 3m8p s TYR 405 Ca 0.07 1.29 0.26 0.00 -2.44 0.00 0.00 57.07 56.25 3m8p s TYR 405 Cb 0.11 -2.57 0.76 0.00 0.35 0.00 0.00 41.96 40.61 3m8p s TYR 405 CO 0.41 0.20 1.58 -2.67 -1.34 0.00 0.00 175.55 173.73 3m8p n TRP 406 N 0.12 0.00 -3.25 4.97 4.27 -1.26 -4.85 117.44 117.43 3m8p n TRP 406 Ca 0.01 0.00 -0.32 0.00 -3.89 0.00 0.00 57.50 53.30 3m8p n TRP 406 Cb 0.52 -0.25 -0.06 0.00 -1.36 0.00 0.00 31.31 30.16 3m8p n TRP 406 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 3m8p s GLN 407 N -2.83 3.92 0.16 -2.67 0.74 -1.26 -5.05 119.66 112.67 3m8p s GLN 407 Ca 0.17 0.51 -0.30 0.00 0.05 0.00 0.00 55.36 55.78 3m8p s GLN 407 Cb 0.18 -2.52 -0.07 0.00 1.10 0.00 0.00 33.01 31.70 3m8p s GLN 407 CO 0.61 0.22 0.94 0.00 -0.55 0.00 0.00 175.29 176.51 3m8p s ALA 408 N -1.91 3.29 -0.01 1.58 0.00 -1.26 -5.03 121.76 118.42 3m8p s ALA 408 Ca 0.51 0.57 -0.01 0.00 0.00 0.00 0.00 51.96 53.04 3m8p s ALA 408 Cb -0.11 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.79 3m8p s ALA 408 CO 0.19 0.08 0.02 0.95 0.00 0.00 0.00 175.76 177.00 3m8p s THR 409 N -0.48 -0.02 -0.21 0.00 -4.23 -1.26 -5.14 115.64 104.30 3m8p s THR 409 Ca 0.44 0.06 -0.09 0.00 -1.18 0.00 0.00 61.69 60.92 3m8p s THR 409 Cb -0.24 -0.05 0.08 0.00 1.34 0.00 0.00 72.50 73.63 3m8p s THR 409 CO 0.30 0.02 0.47 0.86 -0.54 0.00 0.00 174.62 175.73 3m8p s TRP 410 N 0.29 -0.82 0.02 3.99 -0.11 -1.26 -5.08 118.94 115.96 3m8p s TRP 410 Ca -0.02 1.60 0.05 0.00 1.22 0.00 0.00 56.10 58.95 3m8p s TRP 410 Cb -0.03 0.38 -0.03 0.00 -1.50 0.00 0.00 33.47 32.28 3m8p s TRP 410 CO -0.01 -0.46 -0.14 0.96 -4.62 0.00 0.00 176.95 172.68 3m8p s ILE 411 N 2.19 3.11 1.06 5.86 -5.25 -1.26 -5.06 121.20 121.85 3m8p s ILE 411 Ca -0.05 -1.00 -0.17 0.00 -0.99 0.00 0.00 60.65 58.43 3m8p s ILE 411 Cb -0.10 -2.32 0.23 0.00 2.95 0.00 0.00 42.46 43.22 3m8p s ILE 411 CO -0.14 0.38 1.20 -2.16 -1.79 0.00 0.00 174.94 172.43 3m8p s PRO 412 N -1.37 -0.12 -0.09 0.37 0.04 -1.26 -4.86 135.00 127.71 3m8p s PRO 412 Ca 0.15 -0.17 -0.08 0.00 0.04 0.00 0.00 61.00 60.94 3m8p s PRO 412 Cb -0.11 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.66 3m8p s PRO 412 CO 0.06 -2.96 0.37 -1.91 0.04 0.00 0.00 177.00 172.59 3m8p n GLU 413 N -4.21 0.00 -4.08 4.56 2.13 -1.26 -4.73 120.64 113.04 3m8p n GLU 413 Ca 0.13 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.84 3m8p n GLU 413 Cb 0.59 -0.27 -0.07 0.00 0.27 0.00 0.00 31.44 31.97 3m8p n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 3m8p s TRP 414 N 0.98 0.78 -0.00 4.31 1.48 -1.26 -2.15 118.94 123.07 3m8p s TRP 414 Ca 0.21 -1.06 -0.08 0.00 -1.06 0.00 0.00 56.10 54.12 3m8p s TRP 414 Cb -0.27 -0.11 0.00 0.00 -1.16 0.00 0.00 33.47 31.93 3m8p s TRP 414 CO 0.12 -0.91 0.15 -1.21 -4.06 0.00 0.00 176.95 171.04 3m8p s GLU 415 N -3.86 0.48 0.02 3.25 2.02 -1.08 -4.99 118.70 114.54 3m8p s GLU 415 Ca 0.30 -0.34 -0.30 0.00 0.02 0.00 0.00 54.97 54.64 3m8p s GLU 415 Cb 0.02 0.20 -0.05 0.00 0.10 0.00 0.00 34.13 34.40 3m8p s GLU 415 CO 0.13 -0.11 1.17 0.12 0.02 0.00 0.00 175.26 176.58 3m8p s PHE 416 N -1.27 3.40 -0.04 1.61 5.36 -1.26 -0.34 117.98 125.45 3m8p s PHE 416 Ca -0.14 1.33 0.07 0.00 -0.96 0.00 0.00 56.93 57.23 3m8p s PHE 416 Cb -0.07 -3.38 -0.01 0.00 -0.34 0.00 0.00 43.02 39.22 3m8p s PHE 416 CO 0.02 -1.11 -0.24 0.54 -1.46 0.00 0.00 175.22 172.96 3m8p s VAL 417 N 1.37 1.93 -1.22 3.12 0.11 0.04 -4.85 120.40 120.90 3m8p s VAL 417 Ca 0.57 -1.02 -0.13 0.00 -2.93 0.00 0.00 61.98 58.47 3m8p s VAL 417 Cb -0.27 -1.62 0.17 0.00 -1.53 0.00 0.00 36.38 33.13 3m8p s VAL 417 CO 0.27 0.54 1.47 -3.20 -3.33 0.00 0.00 175.10 170.85 3m8p n ASN 418 N 2.77 5.22 -3.80 3.54 2.85 -1.26 -3.98 115.26 120.59 3m8p n ASN 418 Ca -0.17 -2.99 -0.30 0.00 -0.11 0.00 0.00 54.58 51.02 3m8p n ASN 418 Cb 0.52 -1.56 -0.13 0.00 1.24 0.00 0.00 39.78 39.84 3m8p n ASN 418 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3m8p s THR 419 N 1.47 1.81 0.58 -0.44 -4.23 -1.26 -5.10 115.64 108.47 3m8p s THR 419 Ca 0.43 -2.77 -0.18 0.00 -1.18 0.00 0.00 61.69 57.99 3m8p s THR 419 Cb -0.02 -2.27 -0.04 0.00 1.34 0.00 0.00 72.50 71.51 3m8p s THR 419 CO 0.00 -0.85 1.11 -2.84 -0.54 0.00 0.00 174.62 171.51 3m8p s PRO 420 N 0.19 3.23 0.31 3.99 0.02 -1.26 -4.60 135.00 136.88 3m8p s PRO 420 Ca 0.17 1.49 -0.28 0.00 0.02 0.00 0.00 61.00 62.40 3m8p s PRO 420 Cb -0.25 -2.00 -0.09 0.00 0.02 0.00 0.00 34.50 32.18 3m8p s PRO 420 CO -0.01 -0.93 1.10 -1.25 -0.33 0.00 0.00 177.00 175.59 3m8p s PRO 421 N -3.58 4.52 0.25 5.54 0.05 -1.26 -4.96 135.00 135.56 3m8p s PRO 421 Ca 0.70 1.78 -0.15 0.00 0.05 0.00 0.00 61.00 63.38 3m8p s PRO 421 Cb -0.22 -3.05 -0.08 0.00 0.05 0.00 0.00 34.50 31.20 3m8p s PRO 421 CO 0.31 0.11 0.67 -0.51 0.05 0.00 0.00 177.00 177.63 3m8p s LEU 422 N -1.71 4.20 -0.04 -3.56 1.02 -1.26 -4.62 118.68 112.70 3m8p s LEU 422 Ca 0.47 1.22 -0.29 0.00 0.02 0.00 0.00 54.13 55.55 3m8p s LEU 422 Cb -0.31 -3.75 -0.03 0.00 0.02 0.00 0.00 46.19 42.12 3m8p s LEU 422 CO 0.39 -0.07 0.95 -0.69 0.02 0.00 0.00 176.35 176.95 3m8p s VAL 423 N -1.76 4.87 -0.04 -1.59 1.01 0.62 -5.02 120.40 118.49 3m8p s VAL 423 Ca 0.47 1.97 -0.14 0.00 0.00 0.00 0.00 61.98 64.29 3m8p s VAL 423 Cb -0.13 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 32.00 3m8p s VAL 423 CO 0.19 0.12 0.31 -1.59 0.00 0.00 0.00 175.10 174.14 3m8p s LYS 424 N 1.31 0.60 0.09 2.72 -2.85 -1.26 -4.34 119.74 115.99 3m8p s LYS 424 Ca 0.49 -0.03 -0.30 0.00 -1.00 0.00 0.00 55.97 55.13 3m8p s LYS 424 Cb -0.20 0.27 -0.05 0.00 -2.06 0.00 0.00 37.83 35.79 3m8p s LYS 424 CO 0.24 -0.15 0.97 -0.51 0.10 0.00 0.00 175.35 176.00 3m8p s LEU 425 N -0.95 4.47 0.05 2.77 1.43 -1.26 -4.80 118.68 120.39 3m8p s LEU 425 Ca -0.10 1.77 0.24 0.00 -1.03 0.00 0.00 54.13 55.01 3m8p s LEU 425 Cb -0.05 -3.58 0.32 0.00 0.03 0.00 0.00 46.19 42.91 3m8p s LEU 425 CO 0.03 -0.12 1.28 0.79 0.23 0.00 0.00 176.35 178.56 3m8p n TRP 426 N 3.05 0.24 -3.62 0.29 7.02 -1.26 -4.91 117.44 118.24 3m8p n TRP 426 Ca 0.03 0.07 -0.12 0.00 -1.02 0.00 0.00 57.50 56.46 3m8p n TRP 426 Cb 0.49 -0.41 -0.05 0.00 -2.42 0.00 0.00 31.31 28.92 3m8p n TRP 426 CO 0.00 0.00 0.00 1.52 -2.02 0.00 0.00 177.69 177.19 3m8p s TYR 427 N -3.10 -0.29 -0.04 -5.99 -0.85 -1.26 -4.77 117.35 101.05 3m8p s TYR 427 Ca 0.08 0.17 0.02 0.00 -0.52 0.00 0.00 57.07 56.81 3m8p s TYR 427 Cb 0.15 0.28 0.01 0.00 0.38 0.00 0.00 41.96 42.78 3m8p s TYR 427 CO 0.74 -0.65 -0.09 1.14 -1.52 0.00 0.00 175.55 175.17 3m8p s GLN 428 N -3.01 1.08 0.40 -3.49 -2.07 -1.26 -4.99 119.66 106.32 3m8p s GLN 428 Ca -0.02 -0.28 -0.24 0.00 -1.82 0.00 0.00 55.36 53.00 3m8p s GLN 428 Cb 0.00 -0.98 -0.09 0.00 -1.09 0.00 0.00 33.01 30.85 3m8p s GLN 428 CO -0.06 0.05 1.05 -0.51 -1.32 0.00 0.00 175.29 174.50 3m8p s LEU 429 N 0.45 4.14 0.81 2.60 1.43 -1.26 -4.69 118.68 122.16 3m8p s LEU 429 Ca -0.07 2.03 -0.10 0.00 -1.03 0.00 0.00 54.13 54.95 3m8p s LEU 429 Cb -0.11 -4.19 0.08 0.00 0.03 0.00 0.00 46.19 42.00 3m8p s LEU 429 CO 0.01 -0.49 1.11 -1.61 0.23 0.00 0.00 176.35 175.60 3m8p s GLU 430 N -2.50 1.89 -0.04 1.70 0.41 0.92 -4.94 118.70 116.13 3m8p s GLU 430 Ca 0.58 1.27 0.19 0.00 -0.41 0.00 0.00 54.97 56.60 3m8p s GLU 430 Cb -0.22 -1.85 -0.29 0.00 -1.78 0.00 0.00 34.13 30.00 3m8p s GLU 430 CO 0.27 -1.94 0.37 1.63 -0.49 0.00 0.00 175.26 175.11 3m8p n LYS 431 N -3.73 0.64 -4.05 1.61 4.76 -1.26 -4.63 118.16 111.50 3m8p n LYS 431 Ca 0.10 -0.15 -0.12 0.00 -2.87 0.00 0.00 58.31 55.26 3m8p n LYS 431 Cb 0.53 -1.45 -0.12 0.00 -1.84 0.00 0.00 35.03 32.15 3m8p n LYS 431 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3m8p s GLU 432 N -3.21 0.47 0.66 1.97 0.41 -1.26 -5.10 118.70 112.63 3m8p s GLU 432 Ca -0.07 -0.69 -0.17 0.00 -0.41 0.00 0.00 54.97 53.63 3m8p s GLU 432 Cb 0.11 -0.21 -0.00 0.00 -1.78 0.00 0.00 34.13 32.25 3m8p s GLU 432 CO 0.78 0.03 1.23 -1.25 -0.49 0.00 0.00 175.26 175.57 3m8p s PRO 433 N -1.46 2.56 -0.21 0.39 0.04 -1.26 -4.86 135.00 130.19 3m8p s PRO 433 Ca -0.10 1.87 -0.13 0.00 0.04 0.00 0.00 61.00 62.67 3m8p s PRO 433 Cb -0.09 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3m8p s PRO 433 CO 0.00 -1.54 0.29 0.42 0.04 0.00 0.00 177.00 176.21 3m8p s ILE 434 N -1.67 5.27 0.25 0.56 1.01 -1.26 -5.08 121.20 120.29 3m8p s ILE 434 Ca 0.78 0.48 -0.19 0.00 0.00 0.00 0.00 60.65 61.72 3m8p s ILE 434 Cb -0.32 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.44 3m8p s ILE 434 CO 0.39 0.30 0.74 -0.69 0.00 0.00 0.00 174.94 175.69 3m8p s VAL 435 N 1.14 4.57 -1.58 2.92 1.01 -1.26 -3.31 120.40 123.89 3m8p s VAL 435 Ca 0.14 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.36 3m8p s VAL 435 Cb -0.14 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3m8p s VAL 435 CO 0.06 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3m8p n GLY 436 N 0.44 1.53 3.64 4.51 0.00 -1.26 -5.00 105.19 109.05 3m8p n GLY 436 Ca -0.01 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 3m8p n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m8p s ALA 437 N -2.54 3.15 0.46 4.61 0.00 -1.21 -5.01 121.76 121.22 3m8p s ALA 437 Ca 0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 51.96 50.77 3m8p s ALA 437 Cb 0.00 -1.26 -0.07 0.00 0.00 0.00 0.00 23.12 21.79 3m8p s ALA 437 CO 0.00 0.62 1.21 -2.00 0.00 0.00 0.00 175.76 175.59 3m8p s GLU 438 N -1.38 3.70 -0.33 0.00 2.12 -1.26 -4.77 118.70 116.78 3m8p s GLU 438 Ca 0.17 1.89 -0.08 0.00 0.36 0.00 0.00 54.97 57.31 3m8p s GLU 438 Cb -0.11 -2.44 0.02 0.00 0.26 0.00 0.00 34.13 31.86 3m8p s GLU 438 CO 0.08 -0.63 0.13 0.99 -0.54 0.00 0.00 175.26 175.28 3m8p s THR 439 N -1.47 4.15 -0.52 -1.70 2.01 -1.26 -1.54 115.64 115.31 3m8p s THR 439 Ca 0.64 -0.80 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 3m8p s THR 439 Cb -0.32 -3.23 0.06 0.00 0.01 0.00 0.00 72.50 69.03 3m8p s THR 439 CO 0.38 -0.06 0.63 -0.36 -0.69 0.00 0.00 174.62 174.53 3m8p s PHE 440 N 1.50 3.05 -0.21 4.92 0.40 -0.37 -2.82 117.98 124.45 3m8p s PHE 440 Ca 0.02 -0.60 -0.29 0.00 -0.60 0.00 0.00 56.93 55.45 3m8p s PHE 440 Cb -0.18 -3.59 -0.01 0.00 0.51 0.00 0.00 43.02 39.75 3m8p s PHE 440 CO 0.04 -1.06 1.27 0.71 0.70 0.00 0.00 175.22 176.88 3m8p s TYR 441 N 2.61 2.80 0.20 0.36 1.51 -0.56 -1.34 117.35 122.94 3m8p s TYR 441 Ca 0.14 0.97 0.08 0.00 -1.01 0.00 0.00 57.07 57.26 3m8p s TYR 441 Cb -0.20 -3.62 -0.04 0.00 -0.11 0.00 0.00 41.96 37.99 3m8p s TYR 441 CO 0.11 -1.70 -0.02 0.14 -1.11 0.00 0.00 175.55 172.97 3m8p s VAL 442 N 3.78 3.52 0.27 0.71 -7.23 -0.55 -1.23 120.40 119.67 3m8p s VAL 442 Ca 0.55 -1.60 -0.20 0.00 -1.81 0.00 0.00 61.98 58.92 3m8p s VAL 442 Cb -0.20 -2.79 0.02 0.00 0.56 0.00 0.00 36.38 33.96 3m8p s VAL 442 CO 0.17 -0.18 0.67 -0.62 -0.31 0.00 0.00 175.10 174.83 3m8p s ASP 443 N -3.10 -0.25 -0.19 4.85 2.15 -0.91 -4.51 116.67 114.70 3m8p s ASP 443 Ca 0.28 -0.62 -0.11 0.00 0.43 0.00 0.00 52.55 52.52 3m8p s ASP 443 Cb -0.08 0.69 0.06 0.00 -0.30 0.00 0.00 42.92 43.29 3m8p s ASP 443 CO 0.18 -1.29 0.47 -0.83 -0.17 0.00 0.00 175.17 173.53 3m8p s GLY 444 N -2.92 -0.39 0.26 2.66 0.00 -1.26 -1.86 107.32 103.80 3m8p s GLY 444 Ca 0.12 1.69 0.11 0.00 0.00 0.00 0.00 44.72 46.64 3m8p s GLY 444 CO 0.06 1.78 -0.15 0.00 0.00 0.00 0.00 173.10 174.78 3m8p s ALA 445 N 1.34 2.83 -0.21 3.20 0.00 -0.85 -4.68 121.76 123.39 3m8p s ALA 445 Ca -0.09 -1.76 -0.07 0.00 0.00 0.00 0.00 51.96 50.05 3m8p s ALA 445 Cb -0.07 -0.43 0.10 0.00 0.00 0.00 0.00 23.12 22.72 3m8p s ALA 445 CO -0.13 0.31 0.43 0.00 0.00 0.00 0.00 175.76 176.38 3m8p s ALA 446 N -2.28 -1.22 0.21 0.00 0.00 -1.26 -1.49 121.76 115.72 3m8p s ALA 446 Ca 0.29 1.52 -0.32 0.00 0.00 0.00 0.00 51.96 53.45 3m8p s ALA 446 Cb -0.06 -1.39 -0.12 0.00 0.00 0.00 0.00 23.12 21.55 3m8p s ALA 446 CO 0.15 -0.81 1.72 -1.71 0.00 0.00 0.00 175.76 175.12 3m8p n ASN 447 N 5.39 3.98 0.08 0.00 2.85 -0.51 -4.78 115.26 122.27 3m8p n ASN 447 Ca -0.08 1.06 0.13 0.00 -0.11 0.00 0.00 54.58 55.58 3m8p n ASN 447 Cb 0.49 -1.57 0.46 0.00 1.24 0.00 0.00 39.78 40.41 3m8p n ASN 447 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 3m8p n ARG 448 N 3.94 0.17 -0.04 1.20 3.00 -1.26 -1.43 116.66 122.25 3m8p n ARG 448 Ca 0.16 0.20 -0.07 0.00 -0.00 0.00 0.00 57.85 58.13 3m8p n ARG 448 Cb 0.35 -1.72 -0.04 0.00 0.00 0.00 0.00 32.46 31.05 3m8p n ARG 448 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3m8p n GLU 449 N -2.03 0.21 0.14 -0.14 4.71 -1.26 -4.48 120.64 117.78 3m8p n GLU 449 Ca 0.05 0.06 0.03 0.00 -0.01 0.00 0.00 57.16 57.29 3m8p n GLU 449 Cb 0.37 -1.05 0.03 0.00 -1.01 0.00 0.00 31.44 29.77 3m8p n GLU 449 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 3m8p h THR 450 N -0.12 0.79 0.00 2.62 1.35 -1.98 -3.47 112.91 112.10 3m8p h THR 450 Ca -0.20 -2.13 0.00 0.00 -0.55 0.00 0.00 66.41 63.52 3m8p h THR 450 Cb 1.26 2.37 0.00 0.00 -1.73 0.00 0.00 68.15 70.06 3m8p h THR 450 CO -0.07 0.45 0.00 0.29 -0.25 0.00 0.00 175.52 175.94 3m8p n LYS 451 N -3.20 -1.39 -1.83 4.72 4.01 -0.51 -4.80 118.16 115.17 3m8p n LYS 451 Ca 0.01 0.35 -0.34 0.00 -0.51 0.00 0.00 58.31 57.83 3m8p n LYS 451 Cb 0.73 -4.72 0.04 0.00 -0.51 0.00 0.00 35.03 30.57 3m8p n LYS 451 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3m8p s LEU 452 N 0.00 3.45 0.36 -0.35 1.43 -1.26 -1.77 118.68 120.55 3m8p s LEU 452 Ca 0.00 2.06 0.04 0.00 -1.03 0.00 0.00 54.13 55.20 3m8p s LEU 452 Cb 0.00 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.63 3m8p s LEU 452 CO 0.00 -1.60 0.15 -0.83 0.23 0.00 0.00 176.35 174.29 3m8p s GLY 453 N -2.39 2.37 -0.03 -3.19 0.00 -1.02 -1.43 107.32 101.64 3m8p s GLY 453 Ca 0.69 -1.55 -0.01 0.00 0.00 0.00 0.00 44.72 43.86 3m8p s GLY 453 CO 0.39 -1.72 0.04 0.54 0.00 0.00 0.00 173.10 172.35 3m8p s LYS 454 N -3.73 -0.02 -0.10 2.90 -0.14 -0.55 -1.92 119.74 116.19 3m8p s LYS 454 Ca 0.30 0.23 0.04 0.00 -1.36 0.00 0.00 55.97 55.18 3m8p s LYS 454 Cb 0.04 -0.34 -0.00 0.00 -1.68 0.00 0.00 37.83 35.84 3m8p s LYS 454 CO 0.17 -0.21 -0.23 0.00 -0.76 0.00 0.00 175.35 174.32 3m8p s ALA 455 N 1.37 2.23 0.32 5.17 0.00 -1.00 -2.02 121.76 127.84 3m8p s ALA 455 Ca -0.05 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 50.88 3m8p s ALA 455 Cb -0.13 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.17 3m8p s ALA 455 CO -0.03 0.31 0.52 0.41 0.00 0.00 0.00 175.76 176.97 3m8p n GLY 456 N 3.42 1.83 3.58 0.00 0.00 -0.78 -0.47 105.19 112.78 3m8p n GLY 456 Ca -0.19 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 3m8p n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3m8p s TYR 457 N -3.12 -0.34 0.07 1.61 -0.85 -0.65 -2.15 117.35 111.92 3m8p s TYR 457 Ca 0.22 0.02 0.03 0.00 -0.52 0.00 0.00 57.07 56.81 3m8p s TYR 457 Cb -0.02 0.57 -0.03 0.00 0.38 0.00 0.00 41.96 42.86 3m8p s TYR 457 CO 0.16 -0.99 -0.09 0.08 -1.52 0.00 0.00 175.55 173.19 3m8p s VAL 458 N -3.83 0.73 0.30 -3.49 1.01 -0.37 -2.88 120.40 111.87 3m8p s VAL 458 Ca 0.06 -1.45 0.03 0.00 0.00 0.00 0.00 61.98 60.62 3m8p s VAL 458 Cb -0.03 -1.10 -0.06 0.00 0.00 0.00 0.00 36.38 35.20 3m8p s VAL 458 CO -0.04 -0.53 0.08 0.42 0.00 0.00 0.00 175.10 175.02 3m8p s THR 459 N -2.18 0.93 -1.74 3.92 -4.23 -0.06 -1.49 115.64 110.79 3m8p s THR 459 Ca -0.00 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.79 3m8p s THR 459 Cb -0.05 -2.72 0.42 0.00 1.34 0.00 0.00 72.50 71.49 3m8p s THR 459 CO -0.01 0.00 1.77 -0.46 -0.54 0.00 0.00 174.62 175.39 3m8p n ASN 460 N -0.62 0.69 -1.21 3.99 6.94 -1.13 -2.28 115.26 121.65 3m8p n ASN 460 Ca -0.01 -0.74 0.10 0.00 -0.02 0.00 0.00 54.58 53.91 3m8p n ASN 460 Cb 0.66 -0.00 0.29 0.00 -2.36 0.00 0.00 39.78 38.37 3m8p n ASN 460 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3m8p n ARG 461 N -0.79 2.93 0.00 -3.83 1.74 -1.26 -5.01 116.66 110.44 3m8p n ARG 461 Ca 0.14 -2.56 0.00 0.00 -0.77 0.00 0.00 57.85 54.66 3m8p n ARG 461 Cb 0.30 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 3m8p n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m8p n GLY 462 N 1.25 2.99 3.56 -0.13 0.00 -0.96 -5.06 105.19 106.84 3m8p n GLY 462 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 3m8p n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m8p n ARG 463 N -0.13 0.92 -3.67 1.61 1.74 -1.26 -4.64 116.66 111.22 3m8p n ARG 463 Ca 0.00 0.34 -0.10 0.00 -0.77 0.00 0.00 57.85 57.32 3m8p n ARG 463 Cb 0.00 -1.92 -0.11 0.00 -1.02 0.00 0.00 32.46 29.41 3m8p n ARG 463 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3m8p s GLN 464 N -2.18 0.29 0.08 5.56 -2.07 -1.26 -0.88 119.66 119.20 3m8p s GLN 464 Ca 0.68 0.88 0.06 0.00 -1.82 0.00 0.00 55.36 55.16 3m8p s GLN 464 Cb -0.50 0.14 -0.03 0.00 -1.09 0.00 0.00 33.01 31.53 3m8p s GLN 464 CO 0.54 -0.23 -0.16 0.21 -1.32 0.00 0.00 175.29 174.33 3m8p s LYS 465 N 2.18 0.89 -0.35 9.60 2.20 -1.14 -5.02 119.74 128.10 3m8p s LYS 465 Ca -0.04 -0.99 0.04 0.00 -0.36 0.00 0.00 55.97 54.63 3m8p s LYS 465 Cb -0.11 -0.94 0.16 0.00 -1.51 0.00 0.00 37.83 35.43 3m8p s LYS 465 CO -0.12 0.21 0.45 0.08 -0.36 0.00 0.00 175.35 175.62 3m8p s VAL 466 N -1.23 -0.61 0.78 4.02 1.01 -1.26 -1.64 120.40 121.47 3m8p s VAL 466 Ca -0.00 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3m8p s VAL 466 Cb -0.10 -0.64 0.12 0.00 0.00 0.00 0.00 36.38 35.76 3m8p s VAL 466 CO 0.03 -0.33 1.09 0.68 0.00 0.00 0.00 175.10 176.56 3m8p s VAL 467 N 1.95 2.17 -0.05 2.92 -7.23 0.38 -4.90 120.40 115.63 3m8p s VAL 467 Ca 0.14 -0.29 0.02 0.00 -1.81 0.00 0.00 61.98 60.04 3m8p s VAL 467 Cb -0.12 -2.88 0.01 0.00 0.56 0.00 0.00 36.38 33.96 3m8p s VAL 467 CO -0.14 0.00 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.65 3m8p s THR 468 N -3.39 1.01 0.36 5.32 2.01 -1.26 -2.38 115.64 117.31 3m8p s THR 468 Ca 0.66 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.27 3m8p s THR 468 Cb -0.07 -0.92 -0.07 0.00 0.01 0.00 0.00 72.50 71.45 3m8p s THR 468 CO 0.47 0.32 0.04 -0.76 -0.69 0.00 0.00 174.62 174.00 3m8p s LEU 469 N 0.53 2.44 0.04 4.42 1.02 -0.81 -4.97 118.68 121.35 3m8p s LEU 469 Ca -0.11 -1.39 -0.01 0.00 0.02 0.00 0.00 54.13 52.64 3m8p s LEU 469 Cb -0.14 -0.57 -0.03 0.00 0.02 0.00 0.00 46.19 45.47 3m8p s LEU 469 CO 0.02 -0.56 -0.01 0.42 0.02 0.00 0.00 176.35 176.24 3m8p s THR 470 N -3.07 0.17 0.00 5.49 -4.23 -1.26 -2.44 115.64 110.29 3m8p s THR 470 Ca 0.35 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.49 3m8p s THR 470 Cb 0.09 -0.98 0.00 0.00 1.34 0.00 0.00 72.50 72.95 3m8p s THR 470 CO 0.16 -0.76 0.00 -0.67 -0.54 0.00 0.00 174.62 172.81 3m8p n ASP 471 N 0.73 0.00 -4.00 3.99 2.03 -1.07 -4.87 116.55 113.35 3m8p n ASP 471 Ca -0.18 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.03 3m8p n ASP 471 Cb 0.59 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.92 3m8p n ASP 471 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3m8p s THR 472 N 0.00 0.02 0.50 5.18 -4.23 -0.73 -5.04 115.64 111.35 3m8p s THR 472 Ca 0.00 -1.45 0.08 0.00 -1.18 0.00 0.00 61.69 59.14 3m8p s THR 472 Cb 0.00 -2.10 0.04 0.00 1.34 0.00 0.00 72.50 71.78 3m8p s THR 472 CO 0.00 -0.09 0.59 0.42 -0.54 0.00 0.00 174.62 174.99 3m8p s THR 473 N -4.01 2.34 0.32 3.99 -4.23 -1.26 -4.69 115.64 108.09 3m8p s THR 473 Ca 0.22 -1.16 0.01 0.00 -1.18 0.00 0.00 61.69 59.58 3m8p s THR 473 Cb 0.02 -2.51 0.27 0.00 1.34 0.00 0.00 72.50 71.63 3m8p s THR 473 CO 0.06 0.00 1.95 0.78 -0.54 0.00 0.00 174.62 176.87 3m8p h ASN 474 N 0.56 0.86 0.34 3.99 -0.26 -1.90 -2.15 115.58 117.02 3m8p h ASN 474 Ca -0.36 -0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.36 3m8p h ASN 474 Cb 1.28 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 38.35 3m8p h ASN 474 CO 0.48 0.58 -0.16 1.56 -1.06 0.00 0.00 177.43 178.83 3m8p h GLN 475 N 0.99 -0.44 -0.53 0.81 4.20 -1.96 -2.62 115.11 115.57 3m8p h GLN 475 Ca 0.33 0.03 0.07 0.00 0.06 0.00 0.00 58.65 59.15 3m8p h GLN 475 Cb 0.07 0.10 -0.06 0.00 0.30 0.00 0.00 27.48 27.89 3m8p h GLN 475 CO -0.10 -0.18 0.19 0.87 -0.67 0.00 0.00 178.83 178.93 3m8p h LYS 476 N -0.65 0.36 -0.42 1.46 1.57 -1.92 -2.77 116.57 114.21 3m8p h LYS 476 Ca -0.05 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 3m8p h LYS 476 Cb 0.46 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 3m8p h LYS 476 CO 0.08 0.24 0.17 1.79 -0.57 0.00 0.00 179.45 181.16 3m8p h THR 477 N 0.37 0.91 0.00 -0.16 1.35 -1.28 0.22 112.91 114.32 3m8p h THR 477 Ca 0.26 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 3m8p h THR 477 Cb 0.29 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 67.23 3m8p h THR 477 CO -0.26 0.06 0.00 -0.62 -0.25 0.00 0.00 175.52 174.45 3m8p n GLU 478 N -4.98 0.11 -0.06 4.72 -0.58 -1.00 0.15 120.64 119.00 3m8p n GLU 478 Ca 0.03 0.41 -0.17 0.00 -0.42 0.00 0.00 57.16 57.01 3m8p n GLU 478 Cb 0.14 -1.73 -0.13 0.00 -0.57 0.00 0.00 31.44 29.14 3m8p n GLU 478 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3m8p n LEU 479 N -1.94 2.26 -0.23 -4.62 7.94 -0.54 -3.19 117.00 116.69 3m8p n LEU 479 Ca 0.02 0.07 -0.07 0.00 -1.11 0.00 0.00 56.01 54.92 3m8p n LEU 479 Cb 0.16 -0.70 0.04 0.00 0.53 0.00 0.00 43.42 43.45 3m8p n LEU 479 CO 0.14 0.79 1.05 -0.61 -1.11 0.00 0.00 177.39 177.66 3m8p h GLN 480 N 0.03 0.90 -0.32 1.96 5.75 0.93 -1.74 115.11 122.62 3m8p h GLN 480 Ca -0.49 -0.12 0.08 0.00 -0.15 0.00 0.00 58.65 57.98 3m8p h GLN 480 Cb 2.01 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 30.37 3m8p h GLN 480 CO 0.01 0.71 0.23 0.00 -2.65 0.00 0.00 178.83 177.12 3m8p h ALA 481 N 1.15 2.23 0.13 3.38 0.00 -0.40 -1.30 119.26 124.44 3m8p h ALA 481 Ca 0.22 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.94 3m8p h ALA 481 Cb 0.09 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.90 3m8p h ALA 481 CO -0.03 -0.31 -0.78 0.82 0.00 0.00 0.00 179.25 178.95 3m8p h ILE 482 N 0.06 1.51 -1.04 0.00 2.04 -1.43 -2.95 117.51 115.70 3m8p h ILE 482 Ca 0.15 -2.49 0.27 0.00 1.00 0.00 0.00 64.86 63.79 3m8p h ILE 482 Cb 0.53 3.15 -0.09 0.00 -0.74 0.00 0.00 36.82 39.67 3m8p h ILE 482 CO -0.01 0.71 0.68 0.22 0.00 0.00 0.00 178.15 179.74 3m8p h TYR 483 N -0.35 0.61 -0.03 1.37 3.20 -0.68 -0.98 116.97 120.11 3m8p h TYR 483 Ca -0.13 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.72 3m8p h TYR 483 Cb 1.60 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.70 3m8p h TYR 483 CO 0.19 0.06 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.57 3m8p h LEU 484 N 0.37 0.16 -1.14 2.82 3.38 -1.26 -1.08 115.31 118.56 3m8p h LEU 484 Ca 0.59 -0.66 0.09 0.00 0.09 0.00 0.00 57.88 57.99 3m8p h LEU 484 Cb 1.53 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 42.17 3m8p h LEU 484 CO -0.27 0.79 0.60 0.00 0.09 0.00 0.00 178.44 179.64 3m8p h ALA 485 N 0.38 1.58 0.00 1.53 0.00 -1.05 -1.61 119.26 120.09 3m8p h ALA 485 Ca -0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3m8p h ALA 485 Cb 0.79 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3m8p h ALA 485 CO 0.03 0.24 -0.67 -0.07 0.00 0.00 0.00 179.25 178.77 3m8p h LEU 486 N 0.95 0.00 0.24 0.00 3.38 -1.09 -2.52 115.31 116.27 3m8p h LEU 486 Ca 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.38 3m8p h LEU 486 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3m8p h LEU 486 CO -0.19 0.67 -0.12 1.56 0.09 0.00 0.00 178.44 180.46 3m8p h GLN 487 N 0.00 -0.31 0.00 1.13 4.20 -0.30 -3.31 115.11 116.51 3m8p h GLN 487 Ca -0.01 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3m8p h GLN 487 Cb 1.27 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.12 3m8p h GLN 487 CO 0.09 0.06 0.00 -0.25 -0.67 0.00 0.00 178.83 178.05 3m8p n ASP 488 N -5.03 0.00 -4.86 1.46 8.00 -0.70 -4.84 116.55 110.58 3m8p n ASP 488 Ca -0.08 0.31 -0.21 0.00 0.71 0.00 0.00 54.79 55.51 3m8p n ASP 488 Cb 0.26 -0.42 0.07 0.00 -0.02 0.00 0.00 41.12 41.02 3m8p n ASP 488 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3m8p s SER 489 N -2.83 4.86 0.16 -2.24 0.15 -0.95 -5.09 113.70 107.74 3m8p s SER 489 Ca 0.13 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.38 3m8p s SER 489 Cb 0.13 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 3m8p s SER 489 CO 0.33 -1.48 0.00 0.61 1.20 0.00 0.00 173.24 173.90 3m8p n GLY 490 N -2.49 1.09 0.26 9.45 0.00 -1.26 -5.00 105.19 107.24 3m8p n GLY 490 Ca 0.13 -1.96 0.16 0.00 0.00 0.00 0.00 46.02 44.34 3m8p n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3m8p h LEU 491 N 0.00 0.00 -8.15 0.99 3.38 -1.95 -3.41 115.31 106.17 3m8p h LEU 491 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 3m8p h LEU 491 Cb 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.43 3m8p h LEU 491 CO 0.00 0.02 -0.84 -1.61 0.09 0.00 0.00 178.44 176.11 3m8p s GLU 492 N -3.58 1.96 -0.04 1.13 2.02 -1.26 -1.33 118.70 117.61 3m8p s GLU 492 Ca 0.02 -0.58 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 3m8p s GLU 492 Cb 0.08 -1.61 0.01 0.00 0.10 0.00 0.00 34.13 32.71 3m8p s GLU 492 CO 0.58 0.15 0.17 0.54 0.02 0.00 0.00 175.26 176.71 3m8p s VAL 493 N 0.33 0.03 -0.08 2.63 0.11 -0.94 -4.25 120.40 118.24 3m8p s VAL 493 Ca -0.11 -0.29 -0.02 0.00 -2.93 0.00 0.00 61.98 58.64 3m8p s VAL 493 Cb -0.14 -0.34 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 3m8p s VAL 493 CO 0.04 -0.16 -0.00 0.20 -3.33 0.00 0.00 175.10 171.85 3m8p s ASN 494 N -0.53 5.20 -0.05 3.54 0.01 -0.59 -1.53 114.94 120.98 3m8p s ASN 494 Ca -0.06 0.13 -0.00 0.00 -0.71 0.00 0.00 52.86 52.22 3m8p s ASN 494 Cb -0.04 -1.45 0.03 0.00 0.41 0.00 0.00 41.25 40.20 3m8p s ASN 494 CO 0.01 0.38 -0.00 -0.63 -1.51 0.00 0.00 177.10 175.34 3m8p s ILE 495 N -0.88 0.32 -0.09 0.60 1.01 -0.02 -1.24 121.20 120.89 3m8p s ILE 495 Ca 0.13 0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.87 3m8p s ILE 495 Cb -0.11 -0.43 -0.03 0.00 0.01 0.00 0.00 42.46 41.90 3m8p s ILE 495 CO 0.02 0.21 -0.09 -0.69 0.00 0.00 0.00 174.94 174.40 3m8p s VAL 496 N 1.48 3.49 0.05 2.92 1.01 -0.45 -1.97 120.40 126.93 3m8p s VAL 496 Ca -0.03 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 3m8p s VAL 496 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 3m8p s VAL 496 CO -0.03 0.57 0.00 0.28 0.00 0.00 0.00 175.10 175.92 3m8p s THR 497 N -0.40 0.20 -1.49 3.92 -1.32 -0.52 -1.48 115.64 114.56 3m8p s THR 497 Ca 0.05 -1.67 0.20 0.00 -1.21 0.00 0.00 61.69 59.06 3m8p s THR 497 Cb -0.12 -1.44 -0.09 0.00 -1.51 0.00 0.00 72.50 69.34 3m8p s THR 497 CO 0.02 -0.92 0.94 -0.90 -2.21 0.00 0.00 174.62 171.55 3m8p n ASP 498 N 0.15 1.51 -4.61 8.08 3.85 -1.25 -0.97 116.55 123.32 3m8p n ASP 498 Ca -0.15 -1.26 -0.43 0.00 -0.71 0.00 0.00 54.79 52.25 3m8p n ASP 498 Cb 0.61 0.69 -0.03 0.00 -1.35 0.00 0.00 41.12 41.04 3m8p n ASP 498 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 3m8p s SER 499 N -2.53 6.70 0.49 -1.12 0.15 -1.26 -4.49 113.70 111.63 3m8p s SER 499 Ca 0.13 0.60 0.14 0.00 0.70 0.00 0.00 55.95 57.52 3m8p s SER 499 Cb 0.16 -2.48 1.14 0.00 -1.71 0.00 0.00 66.02 63.12 3m8p s SER 499 CO 0.64 -0.92 2.10 -0.61 1.20 0.00 0.00 173.24 175.65 3m8p h GLN 500 N 8.55 0.11 -0.17 5.44 4.15 -1.94 -2.95 115.11 128.31 3m8p h GLN 500 Ca -0.23 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.17 3m8p h GLN 500 Cb 1.07 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 3m8p h GLN 500 CO 1.01 0.11 0.04 -0.92 -1.93 0.00 0.00 178.83 177.14 3m8p h TYR 501 N 0.12 0.28 -0.19 3.99 3.20 -1.99 0.68 116.97 123.05 3m8p h TYR 501 Ca 0.03 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3m8p h TYR 501 Cb 0.04 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 3m8p h TYR 501 CO 0.00 0.39 0.07 0.00 -1.64 0.00 0.00 178.16 176.98 3m8p h ALA 502 N 0.85 0.24 -0.48 1.82 0.00 -1.94 -1.98 119.26 117.77 3m8p h ALA 502 Ca 0.05 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.94 3m8p h ALA 502 Cb 0.25 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 3m8p h ALA 502 CO -0.00 -0.16 0.02 1.25 0.00 0.00 0.00 179.25 180.36 3m8p h LEU 503 N 0.14 -0.16 -0.14 0.00 5.85 -1.41 -2.14 115.31 117.46 3m8p h LEU 503 Ca 0.06 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3m8p h LEU 503 Cb 0.18 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 3m8p h LEU 503 CO -0.00 -0.05 -0.39 1.23 -0.34 0.00 0.00 178.44 178.89 3m8p h GLY 504 N 0.14 -1.25 0.02 3.75 0.00 -0.59 0.87 103.07 106.02 3m8p h GLY 504 Ca 0.24 0.70 0.08 0.00 0.00 0.00 0.00 47.33 48.35 3m8p h GLY 504 CO -0.38 -0.31 -0.20 -2.22 0.00 0.00 0.00 176.54 173.43 3m8p h ILE 505 N -0.39 0.42 0.02 2.60 2.04 -0.93 -2.12 117.51 119.15 3m8p h ILE 505 Ca 0.03 0.00 -0.26 0.00 1.00 0.00 0.00 64.86 65.63 3m8p h ILE 505 Cb 0.47 0.42 0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3m8p h ILE 505 CO -0.34 0.00 -1.02 0.40 0.00 0.00 0.00 178.15 177.19 3m8p h ILE 506 N -0.13 1.29 -0.75 -0.67 2.04 -1.09 -2.87 117.51 115.35 3m8p h ILE 506 Ca 0.19 -2.25 0.13 0.00 1.00 0.00 0.00 64.86 63.93 3m8p h ILE 506 Cb 0.43 2.45 -0.05 0.00 -0.74 0.00 0.00 36.82 38.90 3m8p h ILE 506 CO -0.47 0.69 0.50 1.56 0.00 0.00 0.00 178.15 180.42 3m8p h GLN 507 N 0.32 0.48 0.00 2.37 1.08 0.12 -1.67 115.11 117.82 3m8p h GLN 507 Ca -0.13 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 3m8p h GLN 507 Cb 1.69 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 29.01 3m8p h GLN 507 CO 0.20 0.32 0.00 0.00 -0.95 0.00 0.00 178.83 178.40 3m8p n ALA 508 N -2.50 1.82 -3.86 3.87 0.00 -0.83 -4.90 120.51 114.12 3m8p n ALA 508 Ca 0.14 -0.02 -0.26 0.00 0.00 0.00 0.00 53.44 53.30 3m8p n ALA 508 Cb 0.46 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.86 3m8p n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3m8p n GLN 509 N -0.70 -4.58 -1.59 0.00 6.02 -0.63 -4.84 117.38 111.06 3m8p n GLN 509 Ca 0.03 0.55 -0.36 0.00 -0.01 0.00 0.00 57.00 57.20 3m8p n GLN 509 Cb 0.01 -5.11 0.08 0.00 1.02 0.00 0.00 30.24 26.25 3m8p n GLN 509 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3m8p n PRO 510 N -4.42 0.90 0.00 -1.09 -0.01 -1.26 -4.63 135.00 124.48 3m8p n PRO 510 Ca -0.18 0.37 0.00 0.00 -0.01 0.00 0.00 63.50 63.67 3m8p n PRO 510 Cb 0.63 -2.48 0.00 0.00 -0.01 0.00 0.00 33.50 31.63 3m8p n PRO 510 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 3m8p n ASP 511 N -2.10 1.08 -3.77 2.55 5.68 -0.72 -4.91 116.55 114.36 3m8p n ASP 511 Ca 0.15 -1.42 -0.13 0.00 -0.50 0.00 0.00 54.79 52.90 3m8p n ASP 511 Cb 0.48 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.34 3m8p n ASP 511 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 3m8p s GLN 512 N -0.42 0.25 0.11 0.11 -0.21 -0.17 -4.97 119.66 114.35 3m8p s GLN 512 Ca 0.00 0.39 -0.09 0.00 0.02 0.00 0.00 55.36 55.68 3m8p s GLN 512 Cb 0.00 0.04 -0.00 0.00 1.00 0.00 0.00 33.01 34.05 3m8p s GLN 512 CO 0.00 -0.08 0.21 0.45 -2.12 0.00 0.00 175.29 173.75 3m8p s SER 513 N 0.51 0.10 0.00 5.90 0.15 -1.26 -1.99 113.70 117.11 3m8p s SER 513 Ca -0.03 -0.70 0.28 0.00 0.70 0.00 0.00 55.95 56.20 3m8p s SER 513 Cb -0.05 0.36 1.09 0.00 -1.71 0.00 0.00 66.02 65.71 3m8p s SER 513 CO -0.03 -0.77 1.76 -0.62 1.20 0.00 0.00 173.24 174.79 3m8p n GLU 514 N -0.10 1.33 -4.54 5.44 1.02 -0.94 -4.82 120.64 118.03 3m8p n GLU 514 Ca -0.13 -0.70 -0.34 0.00 -0.02 0.00 0.00 57.16 55.97 3m8p n GLU 514 Cb 0.63 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.45 3m8p n GLU 514 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3m8p s SER 515 N -2.16 4.81 -0.03 1.62 0.15 -1.26 -5.04 113.70 111.80 3m8p s SER 515 Ca 0.35 0.01 -0.22 0.00 0.70 0.00 0.00 55.95 56.80 3m8p s SER 515 Cb 0.21 -1.25 -0.27 0.00 -1.71 0.00 0.00 66.02 63.00 3m8p s SER 515 CO 0.39 0.36 0.98 -0.08 1.20 0.00 0.00 173.24 176.09 3m8p h GLU 516 N 5.14 0.31 -0.70 5.44 4.57 -1.99 -2.92 114.58 124.43 3m8p h GLU 516 Ca -0.49 -0.43 0.11 0.00 -1.18 0.00 0.00 59.36 57.37 3m8p h GLU 516 Cb 1.18 0.14 -0.12 0.00 -0.16 0.00 0.00 28.75 29.79 3m8p h GLU 516 CO 0.53 1.15 -0.39 1.25 -1.18 0.00 0.00 179.01 180.37 3m8p h LEU 517 N -0.32 -1.36 -1.04 1.64 6.46 -1.98 0.10 115.31 118.81 3m8p h LEU 517 Ca -0.10 0.26 -0.09 0.00 -0.12 0.00 0.00 57.88 57.83 3m8p h LEU 517 Cb 1.43 0.66 -0.01 0.00 -0.73 0.00 0.00 40.66 42.01 3m8p h LEU 517 CO 0.12 -0.31 -0.28 0.58 -0.62 0.00 0.00 178.44 177.93 3m8p h VAL 518 N -0.13 1.26 -0.20 1.05 2.07 -1.97 0.32 116.25 118.64 3m8p h VAL 518 Ca 0.24 -1.26 -0.10 0.00 0.82 0.00 0.00 66.70 66.41 3m8p h VAL 518 Cb 0.56 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 3m8p h VAL 518 CO -0.77 0.39 -0.30 0.78 0.02 0.00 0.00 177.57 177.69 3m8p h ASN 519 N 0.30 0.41 -0.31 0.57 2.35 -1.22 0.58 115.58 118.27 3m8p h ASN 519 Ca 0.04 -0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 3m8p h ASN 519 Cb 0.66 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 3m8p h ASN 519 CO 0.05 0.70 0.08 1.56 -1.65 0.00 0.00 177.43 178.16 3m8p h GLN 520 N 0.35 0.49 -0.50 0.81 4.20 0.20 -2.36 115.11 118.31 3m8p h GLN 520 Ca 0.05 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3m8p h GLN 520 Cb 0.71 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 3m8p h GLN 520 CO 0.05 0.56 0.25 0.82 -0.67 0.00 0.00 178.83 179.84 3m8p h ILE 521 N 0.33 1.16 -0.09 2.54 2.04 -0.27 -2.19 117.51 121.03 3m8p h ILE 521 Ca 0.10 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 3m8p h ILE 521 Cb 0.29 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3m8p h ILE 521 CO 0.00 0.19 0.03 0.40 0.00 0.00 0.00 178.15 178.77 3m8p h ILE 522 N 0.69 1.17 -0.59 -0.67 2.04 -0.67 -2.01 117.51 117.48 3m8p h ILE 522 Ca 0.18 -0.51 0.10 0.00 1.00 0.00 0.00 64.86 65.62 3m8p h ILE 522 Cb 0.06 1.33 -0.11 0.00 -0.74 0.00 0.00 36.82 37.36 3m8p h ILE 522 CO -0.03 0.15 -0.37 -0.33 0.00 0.00 0.00 178.15 177.57 3m8p h GLU 523 N -0.03 -0.18 -0.64 2.37 5.08 -0.89 -0.10 114.58 120.19 3m8p h GLU 523 Ca 0.03 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.47 3m8p h GLU 523 Cb 0.21 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 3m8p h GLU 523 CO -0.00 -0.12 0.33 1.96 -1.00 0.00 0.00 179.01 180.18 3m8p h GLN 524 N -0.19 0.59 0.00 2.33 1.08 -1.16 -2.52 115.11 115.24 3m8p h GLN 524 Ca 0.21 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.32 3m8p h GLN 524 Cb 0.56 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 3m8p h GLN 524 CO -0.69 0.39 -0.27 -0.07 -0.95 0.00 0.00 178.83 177.24 3m8p h LEU 525 N 0.61 0.00 -0.32 1.46 3.38 -0.28 -2.44 115.31 117.71 3m8p h LEU 525 Ca 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 3m8p h LEU 525 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3m8p h LEU 525 CO -0.20 0.27 0.08 0.40 0.09 0.00 0.00 178.44 179.08 3m8p h ILE 526 N 0.00 1.22 -0.57 1.22 2.04 -0.98 -3.08 117.51 117.36 3m8p h ILE 526 Ca -0.00 -0.73 0.05 0.00 1.00 0.00 0.00 64.86 65.17 3m8p h ILE 526 Cb 0.54 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3m8p h ILE 526 CO 0.04 0.24 0.38 0.11 0.00 0.00 0.00 178.15 178.92 3m8p h LYS 527 N 0.36 0.59 -7.29 2.37 1.57 -1.07 -3.46 116.57 109.64 3m8p h LYS 527 Ca 0.10 -0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 58.33 3m8p h LYS 527 Cb 0.29 -0.13 0.13 0.00 0.08 0.00 0.00 32.23 32.59 3m8p h LYS 527 CO 0.00 0.39 0.33 0.15 -0.57 0.00 0.00 179.45 179.75 3m8p s LYS 528 N -5.54 2.37 -0.13 3.15 -0.14 -1.07 -4.93 119.74 113.45 3m8p s LYS 528 Ca -0.09 1.22 -0.03 0.00 -1.36 0.00 0.00 55.97 55.71 3m8p s LYS 528 Cb 0.19 -1.91 -0.25 0.00 -1.68 0.00 0.00 37.83 34.18 3m8p s LYS 528 CO 0.75 -1.56 0.33 -1.91 -0.76 0.00 0.00 175.35 172.20 3m8p n GLU 529 N -3.29 0.74 -3.81 1.68 2.13 -0.44 -4.96 120.64 112.68 3m8p n GLU 529 Ca 0.09 0.25 -0.12 0.00 0.66 0.00 0.00 57.16 58.04 3m8p n GLU 529 Cb 0.53 -1.70 -0.13 0.00 0.27 0.00 0.00 31.44 30.42 3m8p n GLU 529 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3m8p s LYS 530 N -2.56 0.18 -0.00 5.31 1.02 -0.81 -5.01 119.74 117.87 3m8p s LYS 530 Ca -0.22 0.23 -0.00 0.00 0.02 0.00 0.00 55.97 56.00 3m8p s LYS 530 Cb 0.07 0.08 -0.00 0.00 -0.52 0.00 0.00 37.83 37.46 3m8p s LYS 530 CO 0.76 -0.03 0.00 0.08 -0.92 0.00 0.00 175.35 175.25 3m8p s VAL 531 N 0.12 0.01 -0.02 3.17 1.01 -1.26 -2.22 120.40 121.20 3m8p s VAL 531 Ca -0.00 -0.06 0.05 0.00 0.00 0.00 0.00 61.98 61.97 3m8p s VAL 531 Cb -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 36.38 36.32 3m8p s VAL 531 CO 0.00 -0.03 -0.16 -0.47 0.00 0.00 0.00 175.10 174.44 3m8p s TYR 532 N -0.09 1.44 -0.03 5.22 5.04 -0.59 -0.05 117.35 128.28 3m8p s TYR 532 Ca -0.01 -0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.33 3m8p s TYR 532 Cb -0.01 -0.93 0.03 0.00 0.35 0.00 0.00 41.96 41.40 3m8p s TYR 532 CO -0.00 -0.04 0.00 -1.17 -1.34 0.00 0.00 175.55 173.00 3m8p s LEU 533 N -0.30 1.05 0.15 6.97 2.96 -1.26 -0.84 118.68 127.41 3m8p s LEU 533 Ca 0.05 -0.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.96 3m8p s LEU 533 Cb -0.07 -0.24 -0.04 0.00 0.50 0.00 0.00 46.19 46.33 3m8p s LEU 533 CO -0.00 -0.12 -0.06 0.00 -1.32 0.00 0.00 176.35 174.85 3m8p s ALA 534 N 1.18 1.35 0.00 5.97 0.00 -0.83 -4.99 121.76 124.44 3m8p s ALA 534 Ca -0.08 -1.51 0.04 0.00 0.00 0.00 0.00 51.96 50.41 3m8p s ALA 534 Cb -0.13 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 3m8p s ALA 534 CO -0.02 -0.20 -0.12 -0.46 0.00 0.00 0.00 175.76 174.95 3m8p s TRP 535 N -3.49 1.08 0.03 0.00 -0.00 -1.26 -1.43 118.94 113.87 3m8p s TRP 535 Ca 0.19 -0.24 -0.02 0.00 -0.00 0.00 0.00 56.10 56.03 3m8p s TRP 535 Cb 0.04 -0.68 -0.02 0.00 -0.00 0.00 0.00 33.47 32.81 3m8p s TRP 535 CO 0.01 -0.01 0.00 0.14 -0.00 0.00 0.00 176.95 177.09 3m8p s VAL 536 N -0.43 0.14 0.11 5.86 -7.23 -0.14 -4.93 120.40 113.79 3m8p s VAL 536 Ca 0.04 -1.15 -0.31 0.00 -1.81 0.00 0.00 61.98 58.74 3m8p s VAL 536 Cb -0.05 -0.69 -0.09 0.00 0.56 0.00 0.00 36.38 36.10 3m8p s VAL 536 CO -0.00 -0.63 1.69 -2.16 -0.31 0.00 0.00 175.10 173.68 3m8p s PRO 537 N -2.27 4.18 0.36 4.82 0.04 -1.26 -3.91 135.00 136.95 3m8p s PRO 537 Ca -0.08 2.43 -0.23 0.00 0.04 0.00 0.00 61.00 63.16 3m8p s PRO 537 Cb -0.04 -3.47 -0.16 0.00 0.04 0.00 0.00 34.50 30.88 3m8p s PRO 537 CO -0.04 -0.74 0.20 0.00 0.04 0.00 0.00 177.00 176.46 3m8p n ALA 538 N 5.16 -2.93 -4.12 8.56 0.00 -1.26 -3.75 120.51 122.18 3m8p n ALA 538 Ca 0.16 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.45 3m8p n ALA 538 Cb 0.39 -1.51 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 3m8p n ALA 538 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3m8p n HIS 539 N -0.79 -1.87 -0.89 0.00 8.25 -1.26 -4.79 115.22 113.88 3m8p n HIS 539 Ca 0.13 0.82 0.08 0.00 -0.26 0.00 0.00 57.72 58.49 3m8p n HIS 539 Cb 0.37 -3.29 0.18 0.00 1.12 0.00 0.00 29.99 28.37 3m8p n HIS 539 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3m8p n LYS 540 N -4.46 2.21 -3.51 -0.41 4.01 -1.25 -4.99 118.16 109.77 3m8p n LYS 540 Ca 0.02 -2.56 -0.23 0.00 -0.51 0.00 0.00 58.31 55.03 3m8p n LYS 540 Cb 0.52 -1.59 0.01 0.00 -0.51 0.00 0.00 35.03 33.47 3m8p n LYS 540 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3m8p n GLY 541 N -0.84 -0.92 3.86 0.72 0.00 -1.26 -4.99 105.19 101.76 3m8p n GLY 541 Ca 0.17 0.79 -0.34 0.00 0.00 0.00 0.00 46.02 46.64 3m8p n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m8p s ILE 542 N -2.56 5.22 -0.45 -0.61 1.09 -1.26 -4.94 121.20 117.68 3m8p s ILE 542 Ca 0.12 -0.19 -0.42 0.00 -1.10 0.00 0.00 60.65 59.06 3m8p s ILE 542 Cb -0.02 -3.40 -0.17 0.00 -1.06 0.00 0.00 42.46 37.81 3m8p s ILE 542 CO 0.86 0.37 2.10 0.61 -0.10 0.00 0.00 174.94 178.77 3m8p n GLY 543 N 1.15 0.09 1.29 6.18 0.00 -1.26 -0.83 105.19 111.81 3m8p n GLY 543 Ca -0.13 1.06 0.00 0.00 0.00 0.00 0.00 46.02 46.95 3m8p n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m8p n GLY 544 N 6.87 2.59 0.12 -0.02 0.00 -1.26 -4.66 105.19 108.82 3m8p n GLY 544 Ca 0.48 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 3m8p n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3m8p h ASN 545 N 0.00 -0.17 -0.49 1.61 -0.00 -1.75 -2.53 115.58 112.26 3m8p h ASN 545 Ca 0.00 -0.16 0.09 0.00 -0.00 0.00 0.00 56.30 56.23 3m8p h ASN 545 Cb 0.00 0.04 -0.08 0.00 -0.00 0.00 0.00 38.32 38.29 3m8p h ASN 545 CO 0.00 0.06 0.04 -0.08 -0.00 0.00 0.00 177.43 177.45 3m8p h GLU 546 N -0.41 0.16 -0.83 6.67 4.81 -1.25 -1.54 114.58 122.18 3m8p h GLU 546 Ca -0.02 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3m8p h GLU 546 Cb 0.32 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 3m8p h GLU 546 CO 0.03 0.10 0.47 0.37 -0.73 0.00 0.00 179.01 179.26 3m8p h GLN 547 N 0.16 1.16 -0.43 1.92 -0.00 -1.76 -2.51 115.11 113.65 3m8p h GLN 547 Ca 0.25 -0.13 -0.11 0.00 -0.00 0.00 0.00 58.65 58.66 3m8p h GLN 547 Cb 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 27.48 27.59 3m8p h GLN 547 CO -0.37 0.84 -0.17 0.28 0.00 0.00 0.00 178.83 179.41 3m8p h VAL 548 N 1.16 1.27 -0.51 2.39 2.07 -0.96 -2.94 116.25 118.72 3m8p h VAL 548 Ca 0.30 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.58 3m8p h VAL 548 Cb 0.01 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 3m8p h VAL 548 CO -0.05 0.43 0.28 -0.78 0.02 0.00 0.00 177.57 177.47 3m8p h ASP 549 N 0.73 0.42 0.16 0.57 1.82 -1.03 -1.07 116.42 118.02 3m8p h ASP 549 Ca 0.11 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.76 3m8p h ASP 549 Cb 0.68 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.62 3m8p h ASP 549 CO 0.05 0.30 -0.14 0.11 -1.61 0.00 0.00 179.24 177.95 3m8p h LYS 550 N 0.55 -0.28 -1.34 0.28 1.79 -1.43 -2.07 116.57 114.07 3m8p h LYS 550 Ca 0.22 0.02 0.39 0.00 -2.18 0.00 0.00 60.65 59.09 3m8p h LYS 550 Cb 0.08 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 3m8p h LYS 550 CO -0.13 -0.19 1.12 -0.07 -1.08 0.00 0.00 179.45 179.10 3m8p h LEU 551 N -0.29 0.00 -1.66 2.94 3.38 -1.31 0.10 115.31 118.47 3m8p h LEU 551 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3m8p h LEU 551 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3m8p h LEU 551 CO -0.01 0.00 0.00 0.55 0.09 0.00 0.00 178.44 179.07 3m8p n VAL 552 N -3.77 0.01 1.33 1.22 3.14 -0.43 -4.71 118.33 115.13 3m8p n VAL 552 Ca 0.30 -0.50 0.13 0.00 -2.96 0.00 0.00 64.34 61.31 3m8p n VAL 552 Cb 1.54 1.34 0.43 0.00 -1.06 0.00 0.00 33.84 36.09 3m8p n VAL 552 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 3m8p n SER 553 N 0.95 1.18 -4.75 6.55 7.64 0.35 -4.43 113.62 121.12 3m8p n SER 553 Ca 0.10 -1.10 -0.41 0.00 1.01 0.00 0.00 58.87 58.48 3m8p n SER 553 Cb 0.42 0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.67 3m8p n SER 553 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m8p s ALA 554 N -2.33 3.41 0.00 -0.43 0.00 -1.26 -5.11 121.76 116.04 3m8p s ALA 554 Ca 0.29 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.15 3m8p s ALA 554 Cb 0.20 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.96 3m8p s ALA 554 CO 0.45 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.38