#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m8p s GLU 6 N 0.00 3.92 -0.16 9.51 8.01 -1.26 -4.88 118.70 133.84 3m8p s GLU 6 Ca 0.00 0.64 -0.07 0.00 0.01 0.00 0.00 54.97 55.55 3m8p s GLU 6 Cb 0.00 -2.38 -0.04 0.00 -4.31 0.00 0.00 34.13 27.40 3m8p s GLU 6 CO 0.00 0.04 0.07 0.95 0.01 0.00 0.00 175.26 176.32 3m8p s THR 7 N -2.19 4.83 -0.03 3.63 -4.23 -1.26 -4.99 115.64 111.39 3m8p s THR 7 Ca 0.54 -0.03 -0.30 0.00 -1.18 0.00 0.00 61.69 60.72 3m8p s THR 7 Cb -0.10 -3.15 -0.05 0.00 1.34 0.00 0.00 72.50 70.53 3m8p s THR 7 CO 0.24 0.49 1.53 -0.69 -0.54 0.00 0.00 174.62 175.65 3m8p s VAL 8 N 0.07 3.62 0.41 2.29 1.01 -1.26 -4.82 120.40 121.72 3m8p s VAL 8 Ca 0.06 0.88 -0.27 0.00 0.00 0.00 0.00 61.98 62.65 3m8p s VAL 8 Cb -0.12 -3.57 -0.10 0.00 0.00 0.00 0.00 36.38 32.59 3m8p s VAL 8 CO 0.01 -0.05 1.47 -0.81 0.00 0.00 0.00 175.10 175.72 3m8p n PRO 9 N 6.34 2.51 -4.44 2.72 -0.04 -1.26 -4.42 135.00 136.41 3m8p n PRO 9 Ca 0.15 0.89 -0.22 0.00 -0.04 0.00 0.00 63.50 64.28 3m8p n PRO 9 Cb 0.43 -2.66 -0.10 0.00 -0.04 0.00 0.00 33.50 31.13 3m8p n PRO 9 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3m8p s VAL 10 N -1.15 2.15 -0.16 0.52 1.01 -1.26 -5.08 120.40 116.44 3m8p s VAL 10 Ca 0.56 -2.30 -0.16 0.00 0.00 0.00 0.00 61.98 60.08 3m8p s VAL 10 Cb -0.46 -2.27 0.04 0.00 0.00 0.00 0.00 36.38 33.69 3m8p s VAL 10 CO 0.61 -0.43 0.45 -1.59 0.00 0.00 0.00 175.10 174.14 3m8p s LYS 11 N -3.58 0.55 0.15 2.72 0.00 -1.26 -4.88 119.74 113.44 3m8p s LYS 11 Ca 0.28 0.58 -0.04 0.00 0.00 0.00 0.00 55.97 56.79 3m8p s LYS 11 Cb -0.02 0.27 -0.02 0.00 0.00 0.00 0.00 37.83 38.06 3m8p s LYS 11 CO 0.12 -0.08 1.38 -0.07 0.00 0.00 0.00 175.35 176.70 3m8p h LEU 12 N 5.28 0.57 0.00 2.77 3.38 -1.93 -3.44 115.31 121.95 3m8p h LEU 12 Ca -0.27 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.30 3m8p h LEU 12 Cb 1.18 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3m8p h LEU 12 CO 0.23 1.16 0.00 1.17 0.09 0.00 0.00 178.44 181.09 3m8p n LYS 13 N -3.83 0.00 0.00 1.13 3.00 -1.26 -4.88 118.16 112.33 3m8p n LYS 13 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 3m8p n LYS 13 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.78 3m8p n LYS 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3m8p n PRO 14 N 0.00 0.00 -1.67 1.64 -0.05 -1.26 -4.95 135.00 128.71 3m8p n PRO 14 Ca 0.00 0.00 -0.25 0.00 -0.05 0.00 0.00 63.50 63.20 3m8p n PRO 14 Cb 0.00 0.00 0.06 0.00 -0.05 0.00 0.00 33.50 33.51 3m8p n PRO 14 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3m8p n GLY 15 N 5.00 6.07 3.65 0.55 0.00 -1.26 -4.88 105.19 114.32 3m8p n GLY 15 Ca 0.00 -2.39 -0.39 0.00 0.00 0.00 0.00 46.02 43.24 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 -3.62 4.15 0.29 1.61 -1.94 -1.26 -5.10 119.30 113.42 3m8p s MET 16 Ca 0.54 0.31 0.05 0.00 -1.71 0.00 0.00 55.69 54.88 3m8p s MET 16 Cb 0.44 -3.58 -0.02 0.00 2.01 0.00 0.00 34.83 33.68 3m8p s MET 16 CO 0.02 -0.16 0.42 0.34 -0.01 0.00 0.00 175.02 175.63 3m8p s ASP 17 N 1.23 6.20 1.30 3.03 2.15 -1.26 -4.80 116.67 124.52 3m8p s ASP 17 Ca 0.21 0.05 -0.20 0.00 0.43 0.00 0.00 52.55 53.04 3m8p s ASP 17 Cb -0.15 -1.70 0.31 0.00 -0.30 0.00 0.00 42.92 41.08 3m8p s ASP 17 CO 0.09 -0.22 0.97 0.61 -0.17 0.00 0.00 175.17 176.45 3m8p n GLY 18 N -1.54 -3.09 3.72 2.66 0.00 -1.26 -4.95 105.19 100.72 3m8p n GLY 18 Ca -0.06 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 3m8p n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m8p s PRO 19 N -5.23 4.56 -0.55 1.61 0.04 -1.26 -4.97 135.00 129.20 3m8p s PRO 19 Ca 0.66 1.34 0.05 0.00 0.04 0.00 0.00 61.00 63.09 3m8p s PRO 19 Cb -0.08 -3.44 0.35 0.00 0.04 0.00 0.00 34.50 31.37 3m8p s PRO 19 CO 0.52 0.02 0.96 1.63 0.04 0.00 0.00 177.00 180.17 3m8p n LYS 20 N 3.67 3.15 -3.59 4.56 5.02 -1.24 0.12 118.16 129.85 3m8p n LYS 20 Ca 0.04 -4.74 -0.39 0.00 -2.02 0.00 0.00 58.31 51.21 3m8p n LYS 20 Cb 0.51 -2.21 -0.11 0.00 -0.02 0.00 0.00 35.03 33.20 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 -4.52 5.17 0.28 -0.18 1.01 -0.06 -4.90 120.40 117.20 3m8p s VAL 21 Ca 0.48 -0.01 -0.13 0.00 0.00 0.00 0.00 61.98 62.32 3m8p s VAL 21 Cb 0.30 -3.53 -0.10 0.00 0.00 0.00 0.00 36.38 33.05 3m8p s VAL 21 CO -0.14 0.17 0.02 0.29 0.00 0.00 0.00 175.10 175.44 3m8p n LYS 22 N 5.06 0.00 -3.46 2.72 5.02 -1.26 -4.19 118.16 122.04 3m8p n LYS 22 Ca -0.14 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.74 3m8p n LYS 22 Cb 0.51 -0.66 -0.10 0.00 -0.02 0.00 0.00 35.03 34.76 3m8p n LYS 22 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3m8p s GLN 23 N -0.66 3.38 0.52 1.97 2.00 -1.26 -4.55 119.66 121.06 3m8p s GLN 23 Ca 0.39 -0.66 -0.22 0.00 -2.00 0.00 0.00 55.36 52.86 3m8p s GLN 23 Cb -0.40 -3.86 -0.06 0.00 0.80 0.00 0.00 33.01 29.50 3m8p s GLN 23 CO 0.42 -0.57 1.31 -0.46 -0.50 0.00 0.00 175.29 175.49 3m8p s TRP 24 N 1.84 2.45 0.37 1.67 -0.11 -1.26 -4.93 118.94 118.97 3m8p s TRP 24 Ca 0.08 1.41 -0.26 0.00 1.22 0.00 0.00 56.10 58.56 3m8p s TRP 24 Cb -0.17 -3.69 -0.12 0.00 -1.50 0.00 0.00 33.47 27.99 3m8p s TRP 24 CO 0.11 -2.52 1.03 -2.30 -4.62 0.00 0.00 176.95 168.65 3m8p n PRO 25 N -0.86 1.43 -4.31 5.86 -0.02 -1.26 -4.99 135.00 130.84 3m8p n PRO 25 Ca 0.09 0.51 -0.24 0.00 -2.02 0.00 0.00 63.50 61.84 3m8p n PRO 25 Cb 0.46 -2.00 -0.12 0.00 -0.02 0.00 0.00 33.50 31.81 3m8p n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m8p s LEU 26 N -0.23 2.35 0.62 2.45 1.43 -1.26 -5.06 118.68 118.97 3m8p s LEU 26 Ca 0.61 -0.75 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 3m8p s LEU 26 Cb -0.60 -0.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 3m8p s LEU 26 CO 0.58 0.05 1.07 0.42 0.23 0.00 0.00 176.35 178.70 3m8p s THR 27 N -1.42 3.71 0.25 5.49 -4.23 -1.26 -4.81 115.64 113.37 3m8p s THR 27 Ca 0.10 0.78 -0.09 0.00 -1.18 0.00 0.00 61.69 61.30 3m8p s THR 27 Cb -0.09 -3.32 0.33 0.00 1.34 0.00 0.00 72.50 70.76 3m8p s THR 27 CO 0.05 -0.51 1.60 -0.08 -0.54 0.00 0.00 174.62 175.15 3m8p h GLU 28 N 0.24 0.02 0.00 3.99 4.81 -2.00 -0.56 114.58 121.07 3m8p h GLU 28 Ca -0.46 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.71 3m8p h GLU 28 Cb 1.22 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3m8p h GLU 28 CO 0.57 0.01 -0.28 1.05 -0.73 0.00 0.00 179.01 179.63 3m8p h GLU 29 N 0.02 0.00 0.03 1.92 4.11 -2.00 -2.30 114.58 116.36 3m8p h GLU 29 Ca 0.41 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.77 3m8p h GLU 29 Cb 0.66 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.92 3m8p h GLU 29 CO -0.81 0.28 -0.27 0.87 0.07 0.00 0.00 179.01 179.15 3m8p h LYS 30 N 0.00 0.14 -0.76 1.06 1.57 -1.48 -2.26 116.57 114.83 3m8p h LYS 30 Ca -0.00 -0.18 0.18 0.00 -1.87 0.00 0.00 60.65 58.77 3m8p h LYS 30 Cb 0.56 0.06 -0.13 0.00 0.08 0.00 0.00 32.23 32.81 3m8p h LYS 30 CO 0.04 1.00 0.07 0.82 -0.57 0.00 0.00 179.45 180.81 3m8p h ILE 31 N -0.64 0.37 0.26 1.86 2.04 -1.18 0.24 117.51 120.46 3m8p h ILE 31 Ca -0.04 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 3m8p h ILE 31 Cb 1.12 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3m8p h ILE 31 CO 0.05 0.03 -0.13 0.11 0.00 0.00 0.00 178.15 178.21 3m8p h LYS 32 N 0.15 -0.34 -0.78 2.37 1.57 -1.38 -1.21 116.57 116.95 3m8p h LYS 32 Ca 0.43 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 59.39 3m8p h LYS 32 Cb 0.77 0.08 -0.10 0.00 0.08 0.00 0.00 32.23 33.06 3m8p h LYS 32 CO -0.63 -0.16 0.30 0.00 -0.57 0.00 0.00 179.45 178.39 3m8p h ALA 33 N 0.27 1.10 -0.49 3.86 0.00 -0.82 -0.31 119.26 122.87 3m8p h ALA 33 Ca -0.04 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3m8p h ALA 33 Cb 0.34 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3m8p h ALA 33 CO 0.06 -0.24 -0.00 -0.07 0.00 0.00 0.00 179.25 178.99 3m8p h LEU 34 N 0.42 0.80 -0.36 0.00 3.38 0.17 -0.87 115.31 118.85 3m8p h LEU 34 Ca 0.44 -0.20 -0.19 0.00 0.09 0.00 0.00 57.88 58.02 3m8p h LEU 34 Cb 0.70 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 3m8p h LEU 34 CO -0.44 0.86 -0.64 -0.37 0.09 0.00 0.00 178.44 177.95 3m8p h VAL 35 N 0.77 1.31 -0.17 1.22 -1.51 -0.21 -0.31 116.25 117.36 3m8p h VAL 35 Ca 0.15 -1.89 0.03 0.00 -1.23 0.00 0.00 66.70 63.76 3m8p h VAL 35 Cb 0.47 1.85 -0.03 0.00 -2.13 0.00 0.00 31.29 31.45 3m8p h VAL 35 CO 0.02 0.59 -0.01 -0.08 -1.23 0.00 0.00 177.57 176.86 3m8p h GLU 36 N 0.48 0.04 -0.39 5.19 4.81 -0.80 0.16 114.58 124.07 3m8p h GLU 36 Ca -0.01 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 3m8p h GLU 36 Cb 1.23 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 3m8p h GLU 36 CO 0.13 0.02 -0.07 0.82 -0.73 0.00 0.00 179.01 179.18 3m8p h ILE 37 N 0.04 1.24 0.00 2.32 2.04 -1.07 -3.01 117.51 119.06 3m8p h ILE 37 Ca 0.08 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.90 3m8p h ILE 37 Cb 0.10 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3m8p h ILE 37 CO -0.15 0.35 -0.54 0.00 0.00 0.00 0.00 178.15 177.81 3m8p h THR 39 N 0.00 1.29 -0.54 0.00 2.02 -0.58 -2.69 112.91 112.41 3m8p h THR 39 Ca 0.00 -1.81 -0.10 0.00 0.77 0.00 0.00 66.41 65.26 3m8p h THR 39 Cb 0.57 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 3m8p h THR 39 CO 0.00 0.58 -0.07 -0.33 0.37 0.00 0.00 175.52 176.07 3m8p h GLU 40 N 0.57 0.97 -0.30 6.66 4.39 -1.50 -1.58 114.58 123.79 3m8p h GLU 40 Ca -0.00 -0.33 -0.16 0.00 0.34 0.00 0.00 59.36 59.21 3m8p h GLU 40 Cb 1.20 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 3m8p h GLU 40 CO 0.13 1.00 -0.44 0.52 -1.16 0.00 0.00 179.01 179.06 3m8p h MET 41 N 0.88 0.77 0.49 2.33 2.86 -1.40 0.06 114.93 120.92 3m8p h MET 41 Ca 0.15 -0.43 -0.01 0.00 -2.06 0.00 0.00 59.70 57.35 3m8p h MET 41 Cb 0.60 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 3m8p h MET 41 CO 0.04 1.05 -0.36 1.49 1.06 0.00 0.00 176.91 180.19 3m8p h GLU 42 N 0.62 -0.80 -0.58 1.72 4.81 -1.46 -0.66 114.58 118.23 3m8p h GLU 42 Ca 0.04 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.38 3m8p h GLU 42 Cb 1.00 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 30.49 3m8p h GLU 42 CO 0.10 -0.54 -0.34 1.63 -0.73 0.00 0.00 179.01 179.13 3m8p n LYS 43 N -5.48 -0.26 0.00 1.92 5.02 -0.60 -0.33 118.16 118.43 3m8p n LYS 43 Ca -0.11 1.17 0.04 0.00 -2.02 0.00 0.00 58.31 57.38 3m8p n LYS 43 Cb 0.38 -1.73 0.23 0.00 -0.02 0.00 0.00 35.03 33.89 3m8p n LYS 43 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3m8p n GLU 44 N -4.36 0.71 -0.94 1.97 1.02 -0.01 -4.79 120.64 114.24 3m8p n GLU 44 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3m8p n GLU 44 Cb 0.15 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 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 0.28 0.67 0.23 0.62 0.00 0.55 -4.91 105.19 102.63 3m8p n GLY 45 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 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 1.82 0.78 -5.30 1.61 1.57 -1.35 -3.44 116.57 112.27 3m8p h LYS 46 Ca 0.00 -0.54 -0.44 0.00 -1.87 0.00 0.00 60.65 57.80 3m8p h LYS 46 Cb 0.00 0.08 -0.14 0.00 0.08 0.00 0.00 32.23 32.25 3m8p h LYS 46 CO 0.00 1.17 -0.66 0.96 -0.57 0.00 0.00 179.45 180.34 3m8p s ILE 47 N -3.99 1.34 -0.01 1.86 -4.36 -1.22 0.61 121.20 115.43 3m8p s ILE 47 Ca -0.11 -2.08 0.02 0.00 -0.26 0.00 0.00 60.65 58.22 3m8p s ILE 47 Cb 0.09 -2.41 -0.00 0.00 1.25 0.00 0.00 42.46 41.39 3m8p s ILE 47 CO 0.88 -0.31 -0.07 -0.44 0.24 0.00 0.00 174.94 175.24 3m8p s SER 48 N -3.38 0.81 0.33 4.36 0.01 -0.67 -4.13 113.70 111.03 3m8p s SER 48 Ca 0.29 -0.12 -0.26 0.00 1.31 0.00 0.00 55.95 57.17 3m8p s SER 48 Cb 0.05 -0.10 -0.14 0.00 0.21 0.00 0.00 66.02 66.04 3m8p s SER 48 CO 0.10 0.08 0.77 0.29 0.41 0.00 0.00 173.24 174.89 3m8p n LYS 49 N 2.95 0.86 -4.37 12.44 4.76 -1.26 -1.32 118.16 132.22 3m8p n LYS 49 Ca -0.13 0.31 -0.19 0.00 -2.87 0.00 0.00 58.31 55.42 3m8p n LYS 49 Cb 0.57 -1.61 -0.10 0.00 -1.84 0.00 0.00 35.03 32.06 3m8p n LYS 49 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3m8p s ILE 50 N -1.21 1.74 0.15 -0.18 -4.36 -0.71 -4.77 121.20 111.86 3m8p s ILE 50 Ca 0.61 -2.20 0.02 0.00 -0.26 0.00 0.00 60.65 58.82 3m8p s ILE 50 Cb -0.69 -2.15 0.03 0.00 1.25 0.00 0.00 42.46 40.89 3m8p s ILE 50 CO 0.58 -0.52 0.21 0.61 0.24 0.00 0.00 174.94 176.07 3m8p n GLY 51 N -0.44 1.54 0.03 6.27 0.00 -1.26 -4.71 105.19 106.63 3m8p n GLY 51 Ca -0.07 -2.09 0.13 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.35 0.07 0.00 1.61 -0.04 -1.26 -2.61 135.00 131.42 3m8p n PRO 52 Ca 0.04 0.11 0.03 0.00 -0.04 0.00 0.00 63.50 63.63 3m8p n PRO 52 Cb 0.14 -1.59 0.15 0.00 -0.04 0.00 0.00 33.50 32.16 3m8p n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3m8p n GLU 53 N -1.71 0.73 -3.81 0.54 0.00 -1.26 -4.44 120.64 110.69 3m8p n GLU 53 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.85 3m8p n GLU 53 Cb 0.33 -1.11 -0.13 0.00 0.00 0.00 0.00 31.44 30.54 3m8p n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3m8p s ASN 54 N -1.42 5.16 0.00 -1.84 3.84 -1.07 -4.97 114.94 114.64 3m8p s ASN 54 Ca 0.08 -1.34 0.27 0.00 0.21 0.00 0.00 52.86 52.07 3m8p s ASN 54 Cb 0.03 -1.81 0.88 0.00 -0.55 0.00 0.00 41.25 39.81 3m8p s ASN 54 CO 0.06 -0.34 1.65 -0.81 -2.79 0.00 0.00 177.10 174.86 3m8p n PRO 55 N 4.71 0.76 -2.27 0.43 -0.04 -1.26 -4.92 135.00 132.41 3m8p n PRO 55 Ca -0.11 -0.40 -0.31 0.00 -0.04 0.00 0.00 63.50 62.64 3m8p n PRO 55 Cb 0.44 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.39 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 -2.52 3.55 -0.28 0.54 2.02 -1.26 -4.80 117.35 114.59 3m8p s TYR 56 Ca 0.25 1.25 -0.23 0.00 -0.37 0.00 0.00 57.07 57.96 3m8p s TYR 56 Cb 0.19 -2.65 0.12 0.00 -0.40 0.00 0.00 41.96 39.23 3m8p s TYR 56 CO 0.51 -0.46 0.99 1.21 -1.57 0.00 0.00 175.55 176.24 3m8p s ASN 57 N -3.69 -0.49 -0.01 2.29 2.47 0.12 -4.71 114.94 110.91 3m8p s ASN 57 Ca 0.55 0.92 0.03 0.00 0.42 0.00 0.00 52.86 54.78 3m8p s ASN 57 Cb -0.10 0.98 -0.01 0.00 -1.45 0.00 0.00 41.25 40.67 3m8p s ASN 57 CO 0.43 -0.16 -0.11 -0.89 -3.72 0.00 0.00 177.10 172.65 3m8p s THR 58 N 0.46 0.87 0.38 -5.21 2.01 0.12 -0.88 115.64 113.39 3m8p s THR 58 Ca 0.01 -0.47 -0.23 0.00 0.31 0.00 0.00 61.69 61.31 3m8p s THR 58 Cb -0.05 -0.73 -0.10 0.00 0.01 0.00 0.00 72.50 71.63 3m8p s THR 58 CO -0.08 0.25 0.96 -2.84 -0.69 0.00 0.00 174.62 172.22 3m8p s PRO 59 N -0.23 4.36 0.14 4.92 0.02 -1.26 -4.31 135.00 138.64 3m8p s PRO 59 Ca 0.04 1.25 0.09 0.00 0.02 0.00 0.00 61.00 62.39 3m8p s PRO 59 Cb -0.05 -2.47 -0.04 0.00 0.02 0.00 0.00 34.50 31.97 3m8p s PRO 59 CO -0.00 0.08 -0.21 0.14 -0.33 0.00 0.00 177.00 176.67 3m8p s VAL 60 N -1.90 1.90 0.22 3.83 -7.23 -1.26 -1.05 120.40 114.91 3m8p s VAL 60 Ca 0.57 -1.77 -0.00 0.00 -1.81 0.00 0.00 61.98 58.97 3m8p s VAL 60 Cb -0.14 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.97 3m8p s VAL 60 CO 0.19 -0.14 0.15 -0.36 -0.31 0.00 0.00 175.10 174.62 3m8p s PHE 61 N -1.53 1.23 0.13 2.82 0.40 0.44 -4.91 117.98 116.55 3m8p s PHE 61 Ca 0.12 -1.41 0.09 0.00 -0.60 0.00 0.00 56.93 55.13 3m8p s PHE 61 Cb -0.08 -0.58 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 3m8p s PHE 61 CO 0.06 -0.67 -0.18 0.00 0.70 0.00 0.00 175.22 175.14 3m8p s ALA 62 N -4.08 2.70 0.32 5.36 0.00 -1.26 0.12 121.76 124.92 3m8p s ALA 62 Ca 0.39 -1.37 0.06 0.00 0.00 0.00 0.00 51.96 51.04 3m8p s ALA 62 Cb 0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 3m8p s ALA 62 CO 0.14 0.58 0.26 0.96 0.00 0.00 0.00 175.76 177.69 3m8p s ILE 63 N -1.22 0.01 0.21 0.00 -4.36 0.37 -4.90 121.20 111.32 3m8p s ILE 63 Ca 0.19 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.58 3m8p s ILE 63 Cb -0.10 -2.50 -0.00 0.00 1.25 0.00 0.00 42.46 41.11 3m8p s ILE 63 CO 0.11 0.00 0.02 0.29 0.24 0.00 0.00 174.94 175.60 3m8p n LYS 64 N -0.58 1.24 0.00 0.37 4.76 -1.26 -0.22 118.16 122.46 3m8p n LYS 64 Ca 0.07 -1.61 0.00 0.00 -2.87 0.00 0.00 58.31 53.90 3m8p n LYS 64 Cb 0.63 0.57 0.00 0.00 -1.84 0.00 0.00 35.03 34.39 3m8p n LYS 64 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3m8p n SER 68 N -1.36 0.00 -0.06 4.39 3.41 -1.26 -4.77 113.62 113.97 3m8p n SER 68 Ca -0.07 0.40 -0.18 0.00 -0.26 0.00 0.00 58.87 58.76 3m8p n SER 68 Cb 0.28 -0.24 -0.13 0.00 -0.26 0.00 0.00 64.21 63.86 3m8p n SER 68 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3m8p n THR 69 N -1.21 1.62 -3.50 6.66 -2.24 -1.26 -4.93 114.28 109.43 3m8p n THR 69 Ca 0.00 -0.65 -0.34 0.00 -2.27 0.00 0.00 64.05 60.79 3m8p n THR 69 Cb 0.00 -1.46 -0.05 0.00 -2.10 0.00 0.00 70.33 66.72 3m8p n THR 69 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3m8p s LYS 70 N -2.54 3.82 0.24 -0.78 1.02 -1.26 -5.10 119.74 115.14 3m8p s LYS 70 Ca -0.25 0.26 -0.30 0.00 0.02 0.00 0.00 55.97 55.70 3m8p s LYS 70 Cb 0.08 -2.92 -0.09 0.00 -0.52 0.00 0.00 37.83 34.37 3m8p s LYS 70 CO 0.71 0.50 1.02 -1.58 -0.92 0.00 0.00 175.35 175.08 3m8p s TRP 71 N -1.49 3.77 0.12 3.18 0.52 -1.26 -4.54 118.94 119.24 3m8p s TRP 71 Ca 0.37 1.79 0.11 0.00 0.02 0.00 0.00 56.10 58.38 3m8p s TRP 71 Cb -0.14 -3.14 -0.04 0.00 -1.15 0.00 0.00 33.47 29.01 3m8p s TRP 71 CO 0.19 -0.07 -0.27 0.50 0.02 0.00 0.00 176.95 177.33 3m8p s ARG 72 N -1.09 1.44 -0.09 4.98 3.52 0.69 -4.94 118.95 123.47 3m8p s ARG 72 Ca 0.44 -1.31 -0.19 0.00 -0.13 0.00 0.00 55.73 54.54 3m8p s ARG 72 Cb -0.28 -1.89 -0.04 0.00 -1.56 0.00 0.00 34.95 31.17 3m8p s ARG 72 CO 0.36 0.45 0.51 0.21 -0.81 0.00 0.00 175.30 176.02 3m8p s LYS 73 N -1.94 4.31 -0.05 5.12 2.20 -1.26 -0.48 119.74 127.64 3m8p s LYS 73 Ca 0.13 0.52 0.04 0.00 -0.36 0.00 0.00 55.97 56.31 3m8p s LYS 73 Cb -0.10 -3.40 -0.00 0.00 -1.51 0.00 0.00 37.83 32.81 3m8p s LYS 73 CO 0.05 0.23 -0.17 -1.17 -0.36 0.00 0.00 175.35 173.94 3m8p s LEU 74 N 0.36 1.91 -0.08 5.43 2.96 0.12 -4.95 118.68 124.43 3m8p s LEU 74 Ca 0.27 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 3m8p s LEU 74 Cb -0.16 -0.97 -0.01 0.00 0.50 0.00 0.00 46.19 45.55 3m8p s LEU 74 CO 0.12 0.15 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.41 3m8p s VAL 75 N 0.08 2.53 -0.89 1.68 1.01 -1.26 -0.42 120.40 123.13 3m8p s VAL 75 Ca -0.05 -0.89 -0.19 0.00 0.00 0.00 0.00 61.98 60.86 3m8p s VAL 75 Cb -0.12 -1.98 0.13 0.00 0.00 0.00 0.00 36.38 34.41 3m8p s VAL 75 CO 0.02 0.56 1.07 -0.62 0.00 0.00 0.00 175.10 176.14 3m8p s ASP 76 N -0.14 6.59 -0.19 3.32 2.15 -0.21 -4.79 116.67 123.40 3m8p s ASP 76 Ca -0.03 -1.99 0.04 0.00 0.43 0.00 0.00 52.55 51.01 3m8p s ASP 76 Cb -0.14 -2.38 0.38 0.00 -0.30 0.00 0.00 42.92 40.48 3m8p s ASP 76 CO 0.04 -1.06 1.34 0.49 -0.17 0.00 0.00 175.17 175.80 3m8p n PHE 77 N 6.45 1.37 -0.36 -5.34 3.72 -1.26 -4.15 117.46 117.89 3m8p n PHE 77 Ca 0.20 -0.85 -0.02 0.00 -0.05 0.00 0.00 57.45 56.73 3m8p n PHE 77 Cb 0.48 -0.49 0.11 0.00 -0.94 0.00 0.00 39.48 38.65 3m8p n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m8p h ARG 78 N 1.17 1.26 0.07 -1.08 3.08 -1.89 0.59 114.38 117.59 3m8p h ARG 78 Ca 0.19 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 3m8p h ARG 78 Cb 1.67 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 31.44 3m8p h ARG 78 CO 0.44 0.83 -0.03 0.93 -1.07 0.00 0.00 179.97 181.07 3m8p h GLU 79 N 1.30 -0.09 -0.69 0.04 4.39 -1.99 -2.12 114.58 115.41 3m8p h GLU 79 Ca 0.36 0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.22 3m8p h GLU 79 Cb -0.12 0.02 -0.12 0.00 -0.10 0.00 0.00 28.75 28.43 3m8p h GLU 79 CO -0.09 0.47 0.01 1.25 -1.16 0.00 0.00 179.01 179.49 3m8p h LEU 80 N -0.85 -0.30 -1.13 1.33 5.85 -1.85 0.72 115.31 119.09 3m8p h LEU 80 Ca -0.01 0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.96 3m8p h LEU 80 Cb 0.61 0.31 -0.06 0.00 0.37 0.00 0.00 40.66 41.88 3m8p h LEU 80 CO 0.02 -0.14 0.60 0.78 -0.34 0.00 0.00 178.44 179.35 3m8p h ASN 81 N 0.12 0.91 0.32 1.25 2.35 0.25 -1.70 115.58 119.06 3m8p h ASN 81 Ca 0.37 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 56.07 3m8p h ASN 81 Cb 0.63 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 3m8p h ASN 81 CO -0.60 0.56 -0.29 0.11 -1.65 0.00 0.00 177.43 175.56 3m8p h LYS 82 N 1.02 0.00 -0.05 0.81 1.57 0.11 -3.00 116.57 117.02 3m8p h LYS 82 Ca 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 3m8p h LYS 82 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3m8p h LYS 82 CO -0.17 0.29 0.00 0.54 -0.57 0.00 0.00 179.45 179.54 3m8p n ARG 83 N -4.13 2.34 -0.13 3.15 1.74 -0.05 -3.74 116.66 115.84 3m8p n ARG 83 Ca -0.02 -1.94 0.04 0.00 -0.77 0.00 0.00 57.85 55.16 3m8p n ARG 83 Cb 0.34 -1.46 0.10 0.00 -1.02 0.00 0.00 32.46 30.42 3m8p n ARG 83 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3m8p n THR 84 N 1.35 1.12 -0.19 0.55 -1.04 -0.85 -4.63 114.28 110.58 3m8p n THR 84 Ca 0.14 -1.10 -0.00 0.00 -2.04 0.00 0.00 64.05 61.05 3m8p n THR 84 Cb 0.60 0.42 0.10 0.00 -1.82 0.00 0.00 70.33 69.63 3m8p n THR 84 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 3m8p h GLN 85 N 1.21 0.34 -0.07 -2.82 4.15 -1.63 0.11 115.11 116.40 3m8p h GLN 85 Ca 0.00 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.42 3m8p h GLN 85 Cb 0.70 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 3m8p h GLN 85 CO 0.01 0.23 0.07 0.22 -1.93 0.00 0.00 178.83 177.43 3m8p h ASP 86 N 0.35 0.00 0.00 -0.69 1.82 -1.90 -0.38 116.42 115.62 3m8p h ASP 86 Ca 0.30 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.93 3m8p h ASP 86 Cb 0.39 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 3m8p h ASP 86 CO -0.32 0.00 -0.23 0.15 -1.61 0.00 0.00 179.24 177.23 3m8p h PHE 87 N 0.00 0.00 0.00 0.28 3.57 -1.26 -1.83 116.94 117.70 3m8p h PHE 87 Ca 0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3m8p h PHE 87 Cb 0.17 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.91 3m8p h PHE 87 CO 0.00 0.11 0.00 0.11 -2.23 0.00 0.00 178.31 176.30 3m8p h TRP 88 N -1.00 0.00 0.00 0.41 5.08 -1.47 -0.55 115.95 118.41 3m8p h TRP 88 Ca -0.01 0.00 -0.41 0.00 1.08 0.00 0.00 58.89 59.55 3m8p h TRP 88 Cb 0.28 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.38 3m8p h TRP 88 CO -0.06 0.00 -2.36 -1.91 -1.28 0.00 0.00 178.44 172.83 3m8p n GLU 89 N -2.70 0.53 -0.08 0.12 2.13 -0.16 -3.73 120.64 116.76 3m8p n GLU 89 Ca 0.00 0.23 -0.05 0.00 0.66 0.00 0.00 57.16 58.00 3m8p n GLU 89 Cb 0.21 -1.39 -0.15 0.00 0.27 0.00 0.00 31.44 30.38 3m8p n GLU 89 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 3m8p n VAL 90 N -4.13 1.02 0.01 6.31 0.24 -1.09 -3.20 118.33 117.49 3m8p n VAL 90 Ca -0.48 -0.72 0.06 0.00 -2.04 0.00 0.00 64.34 61.16 3m8p n VAL 90 Cb 0.84 -0.41 -0.11 0.00 -1.47 0.00 0.00 33.84 32.69 3m8p n VAL 90 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3m8p n GLN 91 N -2.59 0.64 -2.73 7.34 0.00 -0.71 -4.58 117.38 114.75 3m8p n GLN 91 Ca -0.25 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.00 56.71 3m8p n GLN 91 Cb 0.99 -1.65 0.08 0.00 0.00 0.00 0.00 30.24 29.66 3m8p n GLN 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3m8p n LEU 92 N -2.56 0.13 -4.61 1.69 4.32 -0.23 -5.02 117.00 110.71 3m8p n LEU 92 Ca -0.08 -3.28 -0.38 0.00 -0.02 0.00 0.00 56.01 52.25 3m8p n LEU 92 Cb 0.71 0.29 0.04 0.00 -1.62 0.00 0.00 43.42 42.84 3m8p n LEU 92 CO 0.44 1.46 0.53 0.61 -1.22 0.00 0.00 177.39 179.21 3m8p n GLY 93 N -0.78 -0.35 3.38 -0.72 0.00 -1.20 -4.71 105.19 100.81 3m8p n GLY 93 Ca -0.01 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.48 3.93 0.53 -0.61 1.01 -1.26 -5.06 121.20 118.25 3m8p s ILE 94 Ca 0.73 -0.41 -0.21 0.00 0.00 0.00 0.00 60.65 60.77 3m8p s ILE 94 Cb -0.44 -2.87 -0.06 0.00 0.01 0.00 0.00 42.46 39.10 3m8p s ILE 94 CO 0.49 0.30 1.19 -2.16 0.00 0.00 0.00 174.94 174.76 3m8p s PRO 95 N 1.54 3.35 -0.20 2.79 0.04 -1.26 -5.01 135.00 136.25 3m8p s PRO 95 Ca 0.05 1.79 -0.09 0.00 0.04 0.00 0.00 61.00 62.79 3m8p s PRO 95 Cb -0.15 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 3m8p s PRO 95 CO 0.01 -0.89 0.11 -1.58 0.04 0.00 0.00 177.00 174.69 3m8p s HIS 96 N -1.60 3.32 -0.26 0.56 2.46 -1.26 -4.92 115.29 113.58 3m8p s HIS 96 Ca 0.71 0.18 -0.26 0.00 0.47 0.00 0.00 55.06 56.16 3m8p s HIS 96 Cb -0.29 -2.15 0.00 0.00 -0.13 0.00 0.00 32.58 30.01 3m8p s HIS 96 CO 0.33 0.17 0.92 -1.25 -2.47 0.00 0.00 174.74 172.43 3m8p s PRO 97 N 0.55 4.16 0.51 2.88 0.04 -1.26 -4.90 135.00 136.98 3m8p s PRO 97 Ca 0.06 1.03 0.32 0.00 0.04 0.00 0.00 61.00 62.45 3m8p s PRO 97 Cb -0.12 -3.67 1.45 0.00 0.04 0.00 0.00 34.50 32.20 3m8p s PRO 97 CO 0.00 -0.62 1.80 0.00 0.04 0.00 0.00 177.00 178.22 3m8p h ALA 98 N 7.73 2.91 -0.14 8.56 0.00 -1.93 -2.19 119.26 134.20 3m8p h ALA 98 Ca -0.22 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.70 3m8p h ALA 98 Cb 1.08 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3m8p h ALA 98 CO 0.93 -1.27 0.10 0.78 0.00 0.00 0.00 179.25 179.78 3m8p h GLY 99 N 0.09 0.13 0.27 0.00 0.00 -1.96 -3.31 103.07 98.28 3m8p h GLY 99 Ca 0.57 -0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.97 3m8p h GLY 99 CO -0.08 0.04 0.22 -2.00 0.00 0.00 0.00 176.54 174.72 3m8p h LEU 100 N 0.12 0.18 -1.91 3.11 5.85 -1.71 -1.18 115.31 119.77 3m8p h LEU 100 Ca 0.06 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3m8p h LEU 100 Cb 0.09 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3m8p h LEU 100 CO -0.01 0.09 0.00 0.07 -0.34 0.00 0.00 178.44 178.25 3m8p h LYS 101 N 0.38 0.00 0.00 1.25 2.10 -1.75 -2.99 116.57 115.57 3m8p h LYS 101 Ca 0.34 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.98 3m8p h LYS 101 Cb 0.47 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.80 3m8p h LYS 101 CO -0.36 0.00 -0.05 0.87 -2.00 0.00 0.00 179.45 177.91 3m8p h LYS 102 N 0.00 0.00 -7.24 0.07 1.57 -1.44 -2.97 116.57 106.56 3m8p h LYS 102 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3m8p h LYS 102 Cb 0.23 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.68 3m8p h LYS 102 CO 0.00 0.04 0.34 0.15 -0.57 0.00 0.00 179.45 179.41 3m8p s LYS 103 N -3.19 2.25 0.00 3.15 -0.14 -1.13 -4.36 119.74 116.32 3m8p s LYS 103 Ca 0.07 1.40 -0.18 0.00 -1.36 0.00 0.00 55.97 55.89 3m8p s LYS 103 Cb 0.05 -1.88 -0.31 0.00 -1.68 0.00 0.00 37.83 34.01 3m8p s LYS 103 CO 0.68 -1.68 1.00 -0.22 -0.76 0.00 0.00 175.35 174.36 3m8p h LYS 104 N -0.69 0.46 -3.77 1.68 3.64 -1.80 -2.54 116.57 113.54 3m8p h LYS 104 Ca -0.45 -0.69 -0.40 0.00 -1.27 0.00 0.00 60.65 57.84 3m8p h LYS 104 Cb 1.25 0.24 -0.36 0.00 -0.41 0.00 0.00 32.23 32.96 3m8p h LYS 104 CO 0.51 1.31 -0.76 -1.12 -2.27 0.00 0.00 179.45 177.12 3m8p s SER 105 N -7.21 1.05 -0.07 4.20 0.01 -0.86 -4.16 113.70 106.66 3m8p s SER 105 Ca -0.11 -0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.13 3m8p s SER 105 Cb 0.03 -0.36 -0.01 0.00 0.21 0.00 0.00 66.02 65.89 3m8p s SER 105 CO 0.89 -0.13 -0.24 -0.69 0.41 0.00 0.00 173.24 173.48 3m8p s VAL 106 N 1.42 1.97 -0.07 3.43 1.01 0.14 -1.89 120.40 126.41 3m8p s VAL 106 Ca -0.04 -1.01 0.05 0.00 0.00 0.00 0.00 61.98 60.98 3m8p s VAL 106 Cb -0.13 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3m8p s VAL 106 CO -0.03 0.55 -0.23 -0.89 0.00 0.00 0.00 175.10 174.50 3m8p s THR 107 N -0.02 2.24 -0.24 3.92 2.01 -0.21 0.15 115.64 123.49 3m8p s THR 107 Ca -0.07 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 60.85 3m8p s THR 107 Cb -0.14 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 3m8p s THR 107 CO 0.05 0.56 0.13 -0.69 -0.69 0.00 0.00 174.62 173.98 3m8p s VAL 108 N -0.04 4.99 -0.02 3.82 1.01 -1.26 -1.00 120.40 127.89 3m8p s VAL 108 Ca -0.07 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.04 3m8p s VAL 108 Cb -0.15 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 3m8p s VAL 108 CO 0.05 0.34 -0.24 -0.76 0.00 0.00 0.00 175.10 174.48 3m8p s LEU 109 N 1.28 2.05 -0.17 3.92 1.43 0.63 -4.94 118.68 122.88 3m8p s LEU 109 Ca 0.06 -0.44 -0.23 0.00 -1.03 0.00 0.00 54.13 52.50 3m8p s LEU 109 Cb -0.14 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 3m8p s LEU 109 CO 0.06 0.29 0.72 -0.62 0.23 0.00 0.00 176.35 177.02 3m8p s ASP 110 N -0.54 6.82 0.00 2.29 2.15 -1.26 0.13 116.67 126.25 3m8p s ASP 110 Ca 0.09 1.00 0.00 0.00 0.43 0.00 0.00 52.55 54.07 3m8p s ASP 110 Cb -0.09 -2.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 3m8p s ASP 110 CO -0.01 -0.31 0.90 1.33 -0.17 0.00 0.00 175.17 176.92 3m8p n VAL 111 N 4.63 0.82 0.22 1.11 0.24 0.10 -4.83 118.33 120.62 3m8p n VAL 111 Ca 0.01 -0.87 0.15 0.00 -2.04 0.00 0.00 64.34 61.59 3m8p n VAL 111 Cb 0.49 0.60 0.81 0.00 -1.47 0.00 0.00 33.84 34.27 3m8p n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3m8p h GLY 112 N 0.00 0.00 2.00 7.63 0.00 -1.79 -1.44 103.07 109.47 3m8p h GLY 112 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3m8p h GLY 112 CO 0.00 0.00 -0.01 -0.55 0.00 0.00 0.00 176.54 175.98 3m8p h ASP 113 N 0.00 0.00 -0.42 0.19 3.32 -1.90 -1.08 116.42 116.53 3m8p h ASP 113 Ca 0.06 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.18 3m8p h ASP 113 Cb 0.32 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.81 3m8p h ASP 113 CO -0.00 0.01 0.05 0.00 -1.72 0.00 0.00 179.24 177.58 3m8p h ALA 114 N 1.99 0.43 0.00 3.45 0.00 -1.45 -2.87 119.26 120.81 3m8p h ALA 114 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3m8p h ALA 114 Cb 0.14 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3m8p h ALA 114 CO 0.00 -0.35 0.00 1.88 0.00 0.00 0.00 179.25 180.78 3m8p h TYR 115 N 0.16 0.00 0.00 0.00 0.99 -1.39 -1.84 116.97 114.90 3m8p h TYR 115 Ca 0.21 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.94 3m8p h TYR 115 Cb 0.27 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.00 3m8p h TYR 115 CO -0.24 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.11 3m8p n PHE 116 N -2.96 0.00 -0.06 4.88 3.72 -1.08 -3.02 117.46 118.93 3m8p n PHE 116 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.24 3m8p n PHE 116 Cb 0.08 -0.34 -0.14 0.00 -0.94 0.00 0.00 39.48 38.14 3m8p n PHE 116 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3m8p n SER 117 N -1.34 1.03 -4.73 4.37 7.64 -0.69 -4.88 113.62 115.01 3m8p n SER 117 Ca 0.05 0.15 -0.40 0.00 1.01 0.00 0.00 58.87 59.68 3m8p n SER 117 Cb 0.11 0.06 -0.05 0.00 -1.01 0.00 0.00 64.21 63.33 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 -2.54 4.67 0.69 0.44 1.01 -1.17 -4.87 120.40 118.63 3m8p s VAL 118 Ca -0.15 1.82 -0.10 0.00 0.00 0.00 0.00 61.98 63.55 3m8p s VAL 118 Cb 0.07 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.27 3m8p s VAL 118 CO 0.78 0.33 1.05 -2.16 0.00 0.00 0.00 175.10 175.09 3m8p s PRO 119 N 0.08 2.68 -0.14 2.72 0.04 -1.26 -1.84 135.00 137.28 3m8p s PRO 119 Ca 0.43 0.22 -0.03 0.00 0.04 0.00 0.00 61.00 61.65 3m8p s PRO 119 Cb -0.21 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.20 3m8p s PRO 119 CO 0.26 -1.05 -0.02 -1.17 0.04 0.00 0.00 177.00 175.05 3m8p s LEU 120 N -5.29 3.37 -0.67 -3.56 2.96 -0.75 -4.59 118.68 110.16 3m8p s LEU 120 Ca 0.58 -0.04 -0.33 0.00 -0.22 0.00 0.00 54.13 54.11 3m8p s LEU 120 Cb -0.11 -1.80 -0.18 0.00 0.50 0.00 0.00 46.19 44.59 3m8p s LEU 120 CO 0.49 0.22 2.16 -0.67 -1.32 0.00 0.00 176.35 177.23 3m8p n ASP 121 N 3.18 0.45 -0.17 3.68 2.03 -1.26 -4.75 116.55 119.71 3m8p n ASP 121 Ca -0.18 0.37 0.08 0.00 0.52 0.00 0.00 54.79 55.59 3m8p n ASP 121 Cb 0.53 -0.81 0.16 0.00 -0.72 0.00 0.00 41.12 40.28 3m8p n ASP 121 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 3m8p n GLU 122 N 7.11 -0.04 0.00 -0.67 4.07 -1.26 0.11 120.64 129.96 3m8p n GLU 122 Ca 0.54 0.72 0.15 0.00 -0.06 0.00 0.00 57.16 58.51 3m8p n GLU 122 Cb -0.00 -1.17 0.79 0.00 -0.06 0.00 0.00 31.44 31.00 3m8p n GLU 122 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3m8p n ASP 123 N -4.50 0.23 -0.04 4.31 8.00 -1.26 -3.18 116.55 120.11 3m8p n ASP 123 Ca 0.12 -0.72 -0.05 0.00 0.71 0.00 0.00 54.79 54.85 3m8p n ASP 123 Cb 0.41 -0.09 -0.14 0.00 -0.02 0.00 0.00 41.12 41.28 3m8p n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3m8p n PHE 124 N -0.96 0.47 -0.48 1.24 7.35 0.29 -4.58 117.46 120.78 3m8p n PHE 124 Ca 0.19 0.16 0.41 0.00 -0.76 0.00 0.00 57.45 57.45 3m8p n PHE 124 Cb 0.20 -1.01 0.74 0.00 0.35 0.00 0.00 39.48 39.76 3m8p n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3m8p h ARG 125 N 0.00 0.05 0.00 -4.13 3.08 -1.41 -0.04 114.38 111.93 3m8p h ARG 125 Ca -0.34 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 3m8p h ARG 125 Cb 1.91 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.95 3m8p h ARG 125 CO 0.04 0.03 -0.07 1.57 -1.07 0.00 0.00 179.97 180.48 3m8p h LYS 126 N 0.05 0.00 -0.00 0.04 2.10 -1.81 -1.06 116.57 115.89 3m8p h LYS 126 Ca 0.74 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.39 3m8p h LYS 126 Cb 2.78 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 34.11 3m8p h LYS 126 CO -0.11 0.07 -0.06 0.66 -2.00 0.00 0.00 179.45 178.02 3m8p n TYR 127 N -3.77 0.00 -0.60 0.07 4.01 -0.03 -3.42 117.16 113.42 3m8p n TYR 127 Ca -0.02 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.80 3m8p n TYR 127 Cb 0.17 -0.27 0.36 0.00 -0.31 0.00 0.00 39.34 39.29 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 -1.21 1.98 -1.73 -0.72 -2.24 -0.40 -4.78 114.28 105.18 3m8p n THR 128 Ca 0.13 -1.19 -0.42 0.00 -2.27 0.00 0.00 64.05 60.30 3m8p n THR 128 Cb 0.26 0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.49 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 1.00 2.55 -2.25 6.98 0.00 -1.22 -4.22 120.51 123.35 3m8p n ALA 129 Ca 0.26 0.38 -0.14 0.00 0.00 0.00 0.00 53.44 53.94 3m8p n ALA 129 Cb 0.94 -2.47 -0.10 0.00 0.00 0.00 0.00 19.45 17.82 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 0.36 1.31 -0.06 0.00 -0.71 -1.01 -0.70 117.98 117.16 3m8p s PHE 130 Ca 0.68 -1.29 0.02 0.00 -1.04 0.00 0.00 56.93 55.30 3m8p s PHE 130 Cb -0.51 -0.70 0.02 0.00 -1.21 0.00 0.00 43.02 40.62 3m8p s PHE 130 CO 0.43 -0.51 -0.09 0.99 -1.34 0.00 0.00 175.22 174.71 3m8p s THR 131 N -3.98 0.94 -0.15 -4.49 2.01 -1.26 -2.05 115.64 106.65 3m8p s THR 131 Ca 0.38 -0.35 -0.16 0.00 0.31 0.00 0.00 61.69 61.87 3m8p s THR 131 Cb 0.07 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 3m8p s THR 131 CO 0.12 0.32 0.40 -0.63 -0.69 0.00 0.00 174.62 174.14 3m8p s ILE 132 N 0.84 5.23 0.36 1.82 1.01 -0.02 -4.70 121.20 125.75 3m8p s ILE 132 Ca -0.12 0.77 0.05 0.00 0.00 0.00 0.00 60.65 61.35 3m8p s ILE 132 Cb -0.15 -3.74 0.05 0.00 0.01 0.00 0.00 42.46 38.63 3m8p s ILE 132 CO 0.02 0.34 0.39 -0.81 0.00 0.00 0.00 174.94 174.87 3m8p n PRO 133 N 3.76 0.86 -4.18 2.79 -0.04 -1.26 -1.02 135.00 135.90 3m8p n PRO 133 Ca -0.09 -2.12 -0.17 0.00 -0.04 0.00 0.00 63.50 61.08 3m8p n PRO 133 Cb 0.52 0.04 -0.12 0.00 -0.04 0.00 0.00 33.50 33.90 3m8p n PRO 133 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3m8p s SER 134 N -3.20 1.65 0.27 3.54 1.04 -1.26 -4.89 113.70 110.85 3m8p s SER 134 Ca 0.30 -0.69 -0.29 0.00 0.48 0.00 0.00 55.95 55.74 3m8p s SER 134 Cb -0.02 -0.04 -0.10 0.00 0.10 0.00 0.00 66.02 65.96 3m8p s SER 134 CO 0.19 -0.13 1.28 -0.63 0.98 0.00 0.00 173.24 174.93 3m8p s ILE 135 N -1.68 3.02 -1.41 -1.02 1.01 -1.26 -2.04 121.20 117.81 3m8p s ILE 135 Ca 0.01 0.94 0.00 0.00 0.00 0.00 0.00 60.65 61.60 3m8p s ILE 135 Cb -0.08 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.80 3m8p s ILE 135 CO 0.02 0.19 0.00 -3.20 0.00 0.00 0.00 174.94 171.95 3m8p n ASN 136 N 1.62 -4.79 -2.32 3.58 5.15 -1.26 -2.77 115.26 114.47 3m8p n ASN 136 Ca 0.02 0.12 -0.09 0.00 -0.60 0.00 0.00 54.58 54.03 3m8p n ASN 136 Cb 0.43 -4.05 -0.01 0.00 -0.53 0.00 0.00 39.78 35.62 3m8p n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3m8p n ASN 137 N -1.83 -3.07 -0.11 1.20 3.02 -0.87 -4.84 115.26 108.76 3m8p n ASN 137 Ca -0.19 0.27 -0.13 0.00 -0.03 0.00 0.00 54.58 54.50 3m8p n ASN 137 Cb 0.64 -2.69 -0.03 0.00 -0.61 0.00 0.00 39.78 37.09 3m8p n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3m8p h GLU 138 N 0.00 0.79 -6.19 3.52 5.08 -1.74 -3.44 114.58 112.61 3m8p h GLU 138 Ca -0.21 -0.40 -0.54 0.00 -1.00 0.00 0.00 59.36 57.21 3m8p h GLU 138 Cb 1.10 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.28 3m8p h GLU 138 CO 0.26 1.03 -0.59 0.95 -1.00 0.00 0.00 179.01 179.66 3m8p s THR 139 N -4.45 3.72 -1.27 1.13 -4.23 -1.26 -5.06 115.64 104.22 3m8p s THR 139 Ca -0.12 -1.70 0.26 0.00 -1.18 0.00 0.00 61.69 58.95 3m8p s THR 139 Cb 0.10 -3.06 0.37 0.00 1.34 0.00 0.00 72.50 71.25 3m8p s THR 139 CO 0.84 -0.34 1.87 -2.65 -0.54 0.00 0.00 174.62 173.81 3m8p n PRO 140 N -1.04 0.24 -0.11 3.99 -0.02 -1.26 -4.69 135.00 132.12 3m8p n PRO 140 Ca -0.06 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3m8p n PRO 140 Cb 0.59 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 3m8p n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m8p n GLY 141 N 1.04 -0.35 3.65 -1.23 0.00 -1.26 -4.93 105.19 102.11 3m8p n GLY 141 Ca 0.10 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 3m8p n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m8p s ILE 142 N -0.15 4.85 -0.19 -0.61 1.01 -0.19 -4.80 121.20 121.12 3m8p s ILE 142 Ca 0.00 1.57 -0.07 0.00 0.00 0.00 0.00 60.65 62.15 3m8p s ILE 142 Cb 0.00 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 3m8p s ILE 142 CO 0.00 -0.05 0.06 -0.13 0.00 0.00 0.00 174.94 174.82 3m8p s ARG 143 N 2.69 3.93 0.36 2.79 1.81 -1.26 -0.84 118.95 128.43 3m8p s ARG 143 Ca 0.35 -0.36 0.03 0.00 -1.72 0.00 0.00 55.73 54.03 3m8p s ARG 143 Cb -0.15 -3.22 -0.05 0.00 -0.45 0.00 0.00 34.95 31.08 3m8p s ARG 143 CO 0.08 0.22 0.09 0.71 -0.68 0.00 0.00 175.30 175.72 3m8p s TYR 144 N 0.52 1.86 0.12 -0.53 2.02 -0.87 -1.74 117.35 118.72 3m8p s TYR 144 Ca 0.03 -1.10 -0.09 0.00 -0.37 0.00 0.00 57.07 55.54 3m8p s TYR 144 Cb -0.13 -1.21 -0.00 0.00 -0.40 0.00 0.00 41.96 40.22 3m8p s TYR 144 CO 0.01 -0.13 0.23 1.14 -1.57 0.00 0.00 175.55 175.23 3m8p s GLN 145 N -3.84 0.98 0.21 -0.62 -2.07 -0.43 -2.41 119.66 111.47 3m8p s GLN 145 Ca 0.31 -1.04 -0.27 0.00 -1.82 0.00 0.00 55.36 52.54 3m8p s GLN 145 Cb 0.06 0.36 -0.09 0.00 -1.09 0.00 0.00 33.01 32.25 3m8p s GLN 145 CO 0.15 -0.33 0.85 0.71 -1.32 0.00 0.00 175.29 175.34 3m8p s TYR 146 N -3.90 3.89 -0.26 9.60 1.51 -1.26 -1.66 117.35 125.27 3m8p s TYR 146 Ca 0.10 1.73 0.22 0.00 -1.01 0.00 0.00 57.07 58.11 3m8p s TYR 146 Cb 0.04 -2.85 -0.31 0.00 -0.11 0.00 0.00 41.96 38.73 3m8p s TYR 146 CO -0.07 0.45 0.58 0.09 -1.11 0.00 0.00 175.55 175.49 3m8p n ASN 147 N 1.37 0.25 -4.42 2.29 3.02 0.20 -4.69 115.26 113.28 3m8p n ASN 147 Ca -0.03 -0.24 -0.21 0.00 -0.03 0.00 0.00 54.58 54.07 3m8p n ASN 147 Cb 0.48 1.76 -0.10 0.00 -0.61 0.00 0.00 39.78 41.31 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 -3.39 1.65 0.10 2.41 -7.23 -1.13 -1.81 120.40 111.00 3m8p s VAL 148 Ca -0.04 -2.13 -0.34 0.00 -1.81 0.00 0.00 61.98 57.65 3m8p s VAL 148 Cb 0.14 -2.43 -0.14 0.00 0.56 0.00 0.00 36.38 34.52 3m8p s VAL 148 CO 0.90 -0.32 1.60 0.18 -0.31 0.00 0.00 175.10 177.15 3m8p n LEU 149 N -0.57 2.94 -4.90 1.32 4.77 -0.77 -4.64 117.00 115.15 3m8p n LEU 149 Ca -0.06 1.07 -0.31 0.00 -0.03 0.00 0.00 56.01 56.69 3m8p n LEU 149 Cb 0.63 -1.38 -0.05 0.00 -2.33 0.00 0.00 43.42 40.30 3m8p n LEU 149 CO 0.39 -0.36 0.07 -2.16 -1.33 0.00 0.00 177.39 174.00 3m8p s PRO 150 N 1.39 3.64 0.22 3.23 0.04 -1.26 -4.05 135.00 138.21 3m8p s PRO 150 Ca 0.82 -0.05 -0.27 0.00 0.04 0.00 0.00 61.00 61.54 3m8p s PRO 150 Cb -0.73 -2.80 -0.09 0.00 0.04 0.00 0.00 34.50 30.92 3m8p s PRO 150 CO 0.42 0.42 0.87 -0.65 0.04 0.00 0.00 177.00 178.10 3m8p s GLN 151 N -2.79 4.70 0.00 4.56 -0.21 -1.26 -3.59 119.66 121.07 3m8p s GLN 151 Ca 0.42 1.33 0.00 0.00 0.02 0.00 0.00 55.36 57.13 3m8p s GLN 151 Cb -0.12 -3.20 0.00 0.00 1.00 0.00 0.00 33.01 30.69 3m8p s GLN 151 CO 0.25 0.50 0.00 0.41 -2.12 0.00 0.00 175.29 174.33 3m8p n GLY 152 N 1.38 2.38 3.68 3.09 0.00 -1.26 -4.68 105.19 109.78 3m8p n GLY 152 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.42 3.40 0.36 1.61 -0.00 -1.24 -4.55 118.94 116.10 3m8p s TRP 153 Ca 0.00 0.66 0.38 0.00 -0.00 0.00 0.00 56.10 57.14 3m8p s TRP 153 Cb 0.00 -2.52 1.91 0.00 -0.00 0.00 0.00 33.47 32.86 3m8p s TRP 153 CO 0.00 0.02 2.16 0.87 -0.00 0.00 0.00 176.95 180.01 3m8p h LYS 154 N 7.24 0.00 -0.50 5.86 1.57 -1.92 -1.26 116.57 127.56 3m8p h LYS 154 Ca -0.37 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.56 3m8p h LYS 154 Cb 1.16 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 3m8p h LYS 154 CO 0.73 0.00 0.37 0.78 -0.57 0.00 0.00 179.45 180.76 3m8p h GLY 155 N 0.84 0.00 0.76 3.86 0.00 -1.94 -3.17 103.07 103.43 3m8p h GLY 155 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3m8p h GLY 155 CO 0.00 0.00 -0.23 1.76 0.00 0.00 0.00 176.54 178.07 3m8p h SER 156 N 0.00 -0.55 0.37 0.19 0.02 -1.50 -0.94 113.55 111.14 3m8p h SER 156 Ca 0.24 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 3m8p h SER 156 Cb 0.97 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 3m8p h SER 156 CO -0.00 -0.23 -0.24 1.55 -1.14 0.00 0.00 176.83 176.77 3m8p h PRO 157 N -0.89 0.00 -0.61 3.45 0.13 -1.74 -1.55 132.00 130.78 3m8p h PRO 157 Ca -0.07 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.19 3m8p h PRO 157 Cb 0.59 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.61 3m8p h PRO 157 CO 0.11 0.24 -0.01 0.00 -0.23 0.00 0.00 178.00 178.11 3m8p h ALA 158 N 1.76 0.59 0.26 -0.56 0.00 -1.35 -2.43 119.26 117.53 3m8p h ALA 158 Ca -0.00 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3m8p h ALA 158 Cb 0.50 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3m8p h ALA 158 CO 0.03 -0.40 -0.13 0.82 0.00 0.00 0.00 179.25 179.58 3m8p h ILE 159 N 0.11 0.62 0.00 0.00 2.04 -0.37 -3.17 117.51 116.74 3m8p h ILE 159 Ca 0.32 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3m8p h ILE 159 Cb 0.51 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 3m8p h ILE 159 CO -0.53 0.14 0.00 0.33 0.00 0.00 0.00 178.15 178.09 3m8p n PHE 160 N -5.03 0.00 -0.06 1.37 7.35 -0.66 -3.43 117.46 117.00 3m8p n PHE 160 Ca -0.08 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.52 3m8p n PHE 160 Cb 0.26 -0.24 0.06 0.00 0.35 0.00 0.00 39.48 39.91 3m8p n PHE 160 CO 0.00 0.00 0.00 -0.56 -0.76 0.00 0.00 176.76 175.44 3m8p h GLN 161 N 0.00 0.73 -0.82 -4.13 3.07 -1.41 0.27 115.11 112.83 3m8p h GLN 161 Ca 0.00 -0.36 0.16 0.00 0.09 0.00 0.00 58.65 58.54 3m8p h GLN 161 Cb 0.03 -0.00 -0.15 0.00 0.08 0.00 0.00 27.48 27.44 3m8p h GLN 161 CO 0.00 0.98 -0.23 0.66 0.09 0.00 0.00 178.83 180.33 3m8p h SER 162 N 0.61 -0.84 -0.42 0.06 4.64 -1.82 0.14 113.55 115.92 3m8p h SER 162 Ca 0.06 0.25 -0.13 0.00 -0.47 0.00 0.00 61.79 61.50 3m8p h SER 162 Cb 0.89 0.53 -0.01 0.00 -0.31 0.00 0.00 62.40 63.50 3m8p h SER 162 CO 0.08 -0.28 -0.25 0.28 -0.87 0.00 0.00 176.83 175.79 3m8p h SER 163 N -0.01 0.95 -0.57 4.97 0.02 -1.10 -3.13 113.55 114.67 3m8p h SER 163 Ca 0.38 -0.42 0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3m8p h SER 163 Cb 0.60 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 3m8p h SER 163 CO -0.84 1.17 0.38 -0.03 -1.14 0.00 0.00 176.83 176.36 3m8p h MET 164 N 0.74 0.69 -0.27 3.45 -1.53 0.59 -2.66 114.93 115.94 3m8p h MET 164 Ca 0.09 -0.04 -0.10 0.00 -3.44 0.00 0.00 59.70 56.21 3m8p h MET 164 Cb 0.83 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 31.72 3m8p h MET 164 CO 0.07 0.46 -0.22 1.15 0.14 0.00 0.00 176.91 178.51 3m8p h THR 165 N 0.71 1.31 -0.51 -0.77 2.02 -0.73 -2.95 112.91 111.99 3m8p h THR 165 Ca 0.22 -1.36 0.05 0.00 0.77 0.00 0.00 66.41 66.09 3m8p h THR 165 Cb 0.02 1.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.97 3m8p h THR 165 CO -0.06 0.43 0.23 0.11 0.37 0.00 0.00 175.52 176.61 3m8p h LYS 166 N 0.34 0.44 -0.60 6.66 1.57 -1.49 -2.23 116.57 121.26 3m8p h LYS 166 Ca 0.05 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3m8p h LYS 166 Cb 0.76 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 3m8p h LYS 166 CO 0.06 0.29 0.25 0.82 -0.57 0.00 0.00 179.45 180.30 3m8p h ILE 167 N 0.45 1.21 -0.00 1.86 2.04 -1.42 -2.93 117.51 118.73 3m8p h ILE 167 Ca 0.23 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.45 3m8p h ILE 167 Cb 0.18 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3m8p h ILE 167 CO -0.19 0.26 -0.49 0.18 0.00 0.00 0.00 178.15 177.91 3m8p n LEU 168 N -4.33 0.56 -0.23 1.44 4.77 -1.12 -4.36 117.00 113.73 3m8p n LEU 168 Ca 0.05 -0.03 0.01 0.00 -0.03 0.00 0.00 56.01 56.01 3m8p n LEU 168 Cb 0.16 -0.23 0.13 0.00 -2.33 0.00 0.00 43.42 41.14 3m8p n LEU 168 CO 0.39 0.13 1.03 -0.08 -1.33 0.00 0.00 177.39 177.53 3m8p h GLU 169 N 0.11 0.50 -0.07 3.23 4.81 -1.21 0.12 114.58 122.07 3m8p h GLU 169 Ca 0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 3m8p h GLU 169 Cb 0.50 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 3m8p h GLU 169 CO 0.00 0.33 -0.12 -1.35 -0.73 0.00 0.00 179.01 177.14 3m8p h PRO 170 N 0.51 0.21 -0.96 0.92 0.11 -1.79 0.59 132.00 131.59 3m8p h PRO 170 Ca 0.33 -0.13 0.16 0.00 0.11 0.00 0.00 66.00 66.48 3m8p h PRO 170 Cb 0.39 0.01 -0.09 0.00 0.11 0.00 0.00 31.00 31.42 3m8p h PRO 170 CO -0.29 0.69 0.61 0.35 -0.21 0.00 0.00 178.00 179.15 3m8p h PHE 171 N -0.26 0.95 -0.02 0.65 3.57 -1.56 0.26 116.94 120.53 3m8p h PHE 171 Ca 0.01 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.43 3m8p h PHE 171 Cb 0.68 -0.29 0.01 0.00 2.79 0.00 0.00 35.95 39.13 3m8p h PHE 171 CO 0.11 0.30 -0.38 0.00 -2.23 0.00 0.00 178.31 176.10 3m8p h ARG 172 N 0.76 0.29 -0.79 1.11 3.08 -0.61 -0.57 114.38 117.65 3m8p h ARG 172 Ca 0.51 -0.29 0.18 0.00 0.07 0.00 0.00 59.98 60.45 3m8p h ARG 172 Cb 0.79 0.08 -0.11 0.00 0.08 0.00 0.00 29.97 30.80 3m8p h ARG 172 CO -0.27 0.98 0.25 -0.22 -1.07 0.00 0.00 179.97 179.63 3m8p h LYS 173 N -0.28 0.31 0.00 0.04 3.64 0.15 -2.64 116.57 117.79 3m8p h LYS 173 Ca -0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3m8p h LYS 173 Cb 1.09 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3m8p h LYS 173 CO 0.08 0.21 -0.54 1.04 -2.27 0.00 0.00 179.45 177.97 3m8p n GLN 174 N -5.11 0.26 -3.70 1.90 6.02 0.80 -4.42 117.38 113.12 3m8p n GLN 174 Ca 0.16 0.09 -0.29 0.00 -0.01 0.00 0.00 57.00 56.95 3m8p n GLN 174 Cb 0.51 -1.68 -0.12 0.00 1.02 0.00 0.00 30.24 29.97 3m8p n GLN 174 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3m8p s ASN 175 N -4.12 3.53 0.20 1.08 0.01 -0.23 -5.00 114.94 110.41 3m8p s ASN 175 Ca 0.07 -2.87 0.24 0.00 -0.71 0.00 0.00 52.86 49.59 3m8p s ASN 175 Cb 0.14 -1.05 0.32 0.00 0.41 0.00 0.00 41.25 41.07 3m8p s ASN 175 CO 0.70 -0.23 1.36 -0.65 -1.51 0.00 0.00 177.10 176.77 3m8p h PRO 176 N 6.38 0.00 -0.58 -0.60 0.11 -1.76 -3.00 132.00 132.55 3m8p h PRO 176 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3m8p h PRO 176 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3m8p h PRO 176 CO 0.51 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.05 3m8p n ASP 177 N -2.42 2.97 -4.54 -2.05 8.00 -1.26 -4.86 116.55 112.40 3m8p n ASP 177 Ca 0.03 -2.25 -0.34 0.00 0.71 0.00 0.00 54.79 52.94 3m8p n ASP 177 Cb 0.48 -0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 3m8p n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3m8p s ILE 178 N -1.70 4.17 -0.14 0.53 1.01 -1.13 -4.58 121.20 119.35 3m8p s ILE 178 Ca 0.30 -0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.67 3m8p s ILE 178 Cb 0.19 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 3m8p s ILE 178 CO 0.15 0.48 -0.07 0.54 0.00 0.00 0.00 174.94 176.04 3m8p s VAL 179 N 0.41 3.63 -0.07 2.92 0.11 0.12 -4.94 120.40 122.58 3m8p s VAL 179 Ca -0.02 -0.46 0.02 0.00 -2.93 0.00 0.00 61.98 58.59 3m8p s VAL 179 Cb -0.14 -2.56 0.02 0.00 -1.53 0.00 0.00 36.38 32.17 3m8p s VAL 179 CO 0.02 0.51 -0.10 -0.63 -3.33 0.00 0.00 175.10 171.58 3m8p s ILE 180 N 0.23 0.98 0.01 7.04 1.01 -1.25 0.03 121.20 129.25 3m8p s ILE 180 Ca -0.04 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.25 3m8p s ILE 180 Cb -0.14 -0.93 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 3m8p s ILE 180 CO 0.04 0.33 -0.05 -0.47 0.00 0.00 0.00 174.94 174.78 3m8p s TYR 181 N 0.84 0.47 -0.22 3.97 5.04 0.86 -4.97 117.35 123.35 3m8p s TYR 181 Ca -0.12 -0.22 -0.02 0.00 -2.44 0.00 0.00 57.07 54.27 3m8p s TYR 181 Cb -0.15 -0.30 0.01 0.00 0.35 0.00 0.00 41.96 41.87 3m8p s TYR 181 CO 0.02 -0.04 -0.08 -1.14 -1.34 0.00 0.00 175.55 172.97 3m8p s GLN 182 N -0.61 3.15 -0.18 4.97 0.74 -1.26 0.20 119.66 126.66 3m8p s GLN 182 Ca -0.03 -0.77 -0.00 0.00 0.05 0.00 0.00 55.36 54.62 3m8p s GLN 182 Cb -0.05 -2.92 0.04 0.00 1.10 0.00 0.00 33.01 31.19 3m8p s GLN 182 CO -0.00 -0.26 -0.07 -0.47 -0.55 0.00 0.00 175.29 173.95 3m8p s TYR 183 N 1.40 1.92 0.00 1.67 5.04 0.07 -5.00 117.35 122.45 3m8p s TYR 183 Ca 0.04 -1.25 0.00 0.00 -2.44 0.00 0.00 57.07 53.42 3m8p s TYR 183 Cb -0.15 -1.41 0.00 0.00 0.35 0.00 0.00 41.96 40.75 3m8p s TYR 183 CO -0.06 -0.66 0.00 -1.33 -1.34 0.00 0.00 175.55 172.17 3m8p n MET 184 N 4.82 0.00 0.00 4.97 2.81 -1.26 -1.67 117.12 126.79 3m8p n MET 184 Ca -0.13 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.90 3m8p n MET 184 Cb 0.47 0.00 0.41 0.00 -0.71 0.00 0.00 33.22 33.40 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 8.46 1.37 -4.50 7.83 8.00 -1.26 -4.57 116.55 131.88 3m8p n ASP 185 Ca 0.00 -1.24 -0.27 0.00 0.71 0.00 0.00 54.79 53.99 3m8p n ASP 185 Cb 0.00 0.08 -0.11 0.00 -0.02 0.00 0.00 41.12 41.08 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 -2.25 3.86 -0.14 -2.24 1.01 -0.67 0.02 116.67 116.26 3m8p s ASP 186 Ca 0.30 -0.71 -0.02 0.00 0.71 0.00 0.00 52.55 52.83 3m8p s ASP 186 Cb 0.20 -0.50 -0.02 0.00 1.01 0.00 0.00 42.92 43.61 3m8p s ASP 186 CO 0.43 0.11 -0.08 -0.76 0.21 0.00 0.00 175.17 175.09 3m8p s LEU 187 N -2.73 3.02 -0.24 1.23 1.43 0.12 -0.75 118.68 120.77 3m8p s LEU 187 Ca 0.23 -0.20 -0.10 0.00 -1.03 0.00 0.00 54.13 53.03 3m8p s LEU 187 Cb -0.08 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.39 3m8p s LEU 187 CO 0.12 0.18 0.14 -0.31 0.23 0.00 0.00 176.35 176.72 3m8p s TYR 188 N 0.26 3.24 -0.24 0.29 2.02 0.52 -0.27 117.35 123.18 3m8p s TYR 188 Ca -0.06 0.07 0.00 0.00 -0.37 0.00 0.00 57.07 56.72 3m8p s TYR 188 Cb -0.15 -2.26 0.07 0.00 -0.40 0.00 0.00 41.96 39.22 3m8p s TYR 188 CO 0.04 -0.05 -0.02 0.08 -1.57 0.00 0.00 175.55 174.03 3m8p s VAL 189 N 1.22 1.34 -0.10 0.71 1.01 -0.18 -0.10 120.40 124.31 3m8p s VAL 189 Ca 0.07 -1.19 -0.00 0.00 0.00 0.00 0.00 61.98 60.86 3m8p s VAL 189 Cb -0.14 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 3m8p s VAL 189 CO 0.05 -0.20 -0.08 -0.83 0.00 0.00 0.00 175.10 174.04 3m8p s GLY 190 N 1.47 1.65 0.03 4.51 0.00 0.10 -1.04 107.32 114.03 3m8p s GLY 190 Ca -0.03 -0.88 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 3m8p s GLY 190 CO -0.08 -0.42 0.03 -1.35 0.00 0.00 0.00 173.10 171.28 3m8p s SER 191 N -0.23 0.23 -0.08 1.64 1.04 -0.79 -0.70 113.70 114.81 3m8p s SER 191 Ca 0.03 -0.54 0.12 0.00 0.48 0.00 0.00 55.95 56.03 3m8p s SER 191 Cb -0.13 0.16 0.48 0.00 0.10 0.00 0.00 66.02 66.63 3m8p s SER 191 CO 0.03 -0.41 1.32 0.47 0.98 0.00 0.00 173.24 175.63 3m8p n ASP 192 N 1.13 3.33 -4.60 7.02 8.00 -1.26 -2.04 116.55 128.13 3m8p n ASP 192 Ca -0.21 -2.31 -0.31 0.00 0.71 0.00 0.00 54.79 52.67 3m8p n ASP 192 Cb 0.57 -0.48 0.18 0.00 -0.02 0.00 0.00 41.12 41.37 3m8p n ASP 192 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3m8p n LEU 193 N 0.63 2.04 -4.79 0.64 4.32 -1.26 -4.89 117.00 113.69 3m8p n LEU 193 Ca 0.17 0.30 -0.33 0.00 -0.02 0.00 0.00 56.01 56.13 3m8p n LEU 193 Cb 0.64 -1.40 0.03 0.00 -1.62 0.00 0.00 43.42 41.06 3m8p n LEU 193 CO 0.16 -2.53 0.73 -1.61 -1.22 0.00 0.00 177.39 172.92 3m8p s GLU 194 N -4.47 3.12 0.07 3.23 2.02 -1.26 -4.68 118.70 116.73 3m8p s GLU 194 Ca 0.66 1.26 -0.32 0.00 0.02 0.00 0.00 54.97 56.59 3m8p s GLU 194 Cb -0.23 -2.00 -0.19 0.00 0.10 0.00 0.00 34.13 31.81 3m8p s GLU 194 CO 0.60 -0.98 1.63 0.97 0.02 0.00 0.00 175.26 177.50 3m8p h ILE 195 N 0.25 0.37 -1.01 -1.63 6.09 -1.97 0.99 117.51 120.61 3m8p h ILE 195 Ca -0.47 -0.01 0.27 0.00 -1.37 0.00 0.00 64.86 63.29 3m8p h ILE 195 Cb 1.23 0.37 -0.13 0.00 0.47 0.00 0.00 36.82 38.76 3m8p h ILE 195 CO 0.56 0.00 0.59 1.23 -3.07 0.00 0.00 178.15 177.47 3m8p h GLY 196 N -0.87 1.93 1.33 8.18 0.00 -1.97 2.09 103.07 113.75 3m8p h GLY 196 Ca -0.09 -0.28 -0.22 0.00 0.00 0.00 0.00 47.33 46.74 3m8p h GLY 196 CO 0.15 -0.32 -0.84 1.46 0.00 0.00 0.00 176.54 176.99 3m8p h GLN 197 N 0.49 0.64 -0.26 4.80 4.20 -1.17 0.22 115.11 124.02 3m8p h GLN 197 Ca 0.67 -0.57 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 3m8p h GLN 197 Cb 1.40 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 29.30 3m8p h GLN 197 CO -0.51 1.18 0.05 1.25 -0.67 0.00 0.00 178.83 180.13 3m8p h HIS 198 N 0.41 0.44 -0.38 2.96 2.76 0.31 -0.21 115.15 121.44 3m8p h HIS 198 Ca -0.06 -0.06 -0.03 0.00 -2.20 0.00 0.00 60.37 58.02 3m8p h HIS 198 Cb 1.46 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 30.27 3m8p h HIS 198 CO 0.08 0.52 0.11 0.00 -1.30 0.00 0.00 177.93 177.33 3m8p h ARG 199 N 0.24 0.56 -0.10 5.26 3.08 0.34 -1.56 114.38 122.20 3m8p h ARG 199 Ca 0.08 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 3m8p h ARG 199 Cb 0.31 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3m8p h ARG 199 CO 0.00 0.50 -0.60 1.15 -1.07 0.00 0.00 179.97 179.95 3m8p h THR 200 N 0.55 1.37 0.00 2.04 2.02 -0.62 -2.56 112.91 115.71 3m8p h THR 200 Ca 0.13 -1.95 -0.00 0.00 0.77 0.00 0.00 66.41 65.36 3m8p h THR 200 Cb 0.19 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 68.55 3m8p h THR 200 CO -0.01 0.58 -0.02 0.11 0.37 0.00 0.00 175.52 176.55 3m8p h LYS 201 N 0.26 0.00 -0.14 6.66 1.79 -0.10 -2.40 116.57 122.65 3m8p h LYS 201 Ca -0.01 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 3m8p h LYS 201 Cb 1.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 3m8p h LYS 201 CO 0.10 0.02 -0.45 0.82 -1.08 0.00 0.00 179.45 178.87 3m8p h ILE 202 N 0.00 1.35 -0.34 1.86 1.08 -0.94 -0.75 117.51 119.77 3m8p h ILE 202 Ca -0.00 -1.73 0.04 0.00 -0.39 0.00 0.00 64.86 62.78 3m8p h ILE 202 Cb 0.73 2.06 -0.04 0.00 -3.07 0.00 0.00 36.82 36.49 3m8p h ILE 202 CO 0.00 0.53 0.11 -0.08 -0.69 0.00 0.00 178.15 178.02 3m8p h GLU 203 N 0.18 0.24 -0.55 2.37 4.57 -1.42 0.95 114.58 120.93 3m8p h GLU 203 Ca -0.02 -0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.25 3m8p h GLU 203 Cb 1.07 -0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 29.52 3m8p h GLU 203 CO 0.10 0.16 0.06 1.49 -1.18 0.00 0.00 179.01 179.64 3m8p h GLU 204 N 0.25 0.18 -0.64 1.92 4.81 -1.30 -0.41 114.58 119.39 3m8p h GLU 204 Ca 0.15 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 3m8p h GLU 204 Cb 0.13 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3m8p h GLU 204 CO -0.17 0.12 0.21 1.25 -0.73 0.00 0.00 179.01 179.69 3m8p h LEU 205 N 0.18 0.90 -0.68 1.64 5.85 0.08 -2.69 115.31 120.60 3m8p h LEU 205 Ca 0.28 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3m8p h LEU 205 Cb 0.42 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 3m8p h LEU 205 CO -0.41 0.83 0.41 0.03 -0.34 0.00 0.00 178.44 178.97 3m8p h ARG 206 N 0.94 0.91 -0.83 1.25 3.08 0.79 -2.48 114.38 118.05 3m8p h ARG 206 Ca 0.21 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 3m8p h ARG 206 Cb 0.25 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 3m8p h ARG 206 CO -0.01 0.64 0.36 1.96 -1.07 0.00 0.00 179.97 181.85 3m8p h GLN 207 N 0.92 1.21 -0.89 0.04 1.08 -1.09 0.55 115.11 116.93 3m8p h GLN 207 Ca 0.24 -0.20 0.16 0.00 -1.45 0.00 0.00 58.65 57.40 3m8p h GLN 207 Cb -0.04 -0.21 -0.10 0.00 -0.05 0.00 0.00 27.48 27.08 3m8p h GLN 207 CO -0.05 0.95 0.48 0.45 -0.95 0.00 0.00 178.83 179.72 3m8p h HIS 208 N 1.19 0.84 -0.05 2.96 3.86 -1.13 -2.44 115.15 120.38 3m8p h HIS 208 Ca 0.28 0.03 -0.20 0.00 -1.16 0.00 0.00 60.37 59.32 3m8p h HIS 208 Cb 0.17 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.41 3m8p h HIS 208 CO 0.02 0.19 -0.76 -0.07 0.86 0.00 0.00 177.93 178.17 3m8p h LEU 209 N 0.66 0.76 -1.47 2.43 3.38 -0.76 -3.23 115.31 117.07 3m8p h LEU 209 Ca 0.49 -0.70 0.11 0.00 0.09 0.00 0.00 57.88 57.87 3m8p h LEU 209 Cb 0.72 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 3m8p h LEU 209 CO -0.37 1.35 0.48 0.25 0.09 0.00 0.00 178.44 180.24 3m8p h LEU 210 N 0.23 0.53 -9.84 1.67 5.85 0.47 -0.90 115.31 113.31 3m8p h LEU 210 Ca -0.08 0.02 -0.50 0.00 0.84 0.00 0.00 57.88 58.16 3m8p h LEU 210 Cb 1.42 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 42.37 3m8p h LEU 210 CO 0.15 0.31 0.45 -0.13 -0.34 0.00 0.00 178.44 178.87 3m8p s ARG 211 N -5.54 4.54 0.00 1.25 3.00 -0.97 -3.34 118.95 117.89 3m8p s ARG 211 Ca -0.09 1.70 0.00 0.00 0.00 0.00 0.00 55.73 57.34 3m8p s ARG 211 Cb 0.20 -3.03 0.00 0.00 0.00 0.00 0.00 34.95 32.12 3m8p s ARG 211 CO 0.77 0.15 0.00 0.91 0.00 0.00 0.00 175.30 177.13 3m8p n TRP 212 N 0.90 0.00 0.00 -0.53 7.02 -1.25 -4.77 117.44 118.81 3m8p n TRP 212 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3m8p n TRP 212 Cb 0.46 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.35 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 0.00 0.80 2.26 6.99 0.00 -0.35 -5.04 105.19 109.85 3m8p n GLY 213 Ca 0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.37 3m8p n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3m8p n LEU 214 N 0.00 0.00 0.00 0.99 4.77 -1.17 -4.33 117.00 117.26 3m8p n LEU 214 Ca 0.00 -1.35 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 3m8p n LEU 214 Cb 0.00 2.12 0.00 0.00 -2.33 0.00 0.00 43.42 43.21 3m8p n LEU 214 CO 0.00 -0.45 0.00 -2.67 -1.33 0.00 0.00 177.39 172.94 3m8p n TRP 229 N -0.35 0.00 1.10 -1.77 4.27 -1.26 -4.79 117.44 114.63 3m8p n TRP 229 Ca -0.04 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.66 3m8p n TRP 229 Cb 0.35 0.00 0.54 0.00 -1.36 0.00 0.00 31.31 30.84 3m8p n TRP 229 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3m8p n MET 230 N 0.00 0.49 0.00 -2.67 0.00 -1.26 -4.94 117.12 108.75 3m8p n MET 230 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 57.70 57.74 3m8p n MET 230 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.72 3m8p n MET 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3m8p n GLY 231 N 0.23 0.90 0.00 3.17 0.00 -1.26 -4.44 105.19 103.78 3m8p n GLY 231 Ca 0.13 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3m8p n GLY 231 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3m8p n TYR 232 N 0.00 0.00 -2.23 1.61 4.02 -1.26 -5.12 117.16 114.18 3m8p n TYR 232 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.62 3m8p n TYR 232 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 39.34 39.47 3m8p n TYR 232 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3m8p s GLU 233 N 0.63 1.08 0.32 -0.72 8.01 -1.26 -4.71 118.70 122.05 3m8p s GLU 233 Ca 0.00 -0.75 0.10 0.00 0.01 0.00 0.00 54.97 54.33 3m8p s GLU 233 Cb 0.00 -2.06 -0.05 0.00 -4.31 0.00 0.00 34.13 27.70 3m8p s GLU 233 CO 0.00 -2.00 -0.06 -0.51 0.01 0.00 0.00 175.26 172.70 3m8p s LEU 234 N -5.56 2.87 -0.50 1.80 1.43 0.41 -4.93 118.68 114.20 3m8p s LEU 234 Ca 0.71 -1.00 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 3m8p s LEU 234 Cb -0.04 -1.27 0.16 0.00 0.03 0.00 0.00 46.19 45.07 3m8p s LEU 234 CO 0.49 -0.14 0.36 -1.00 0.23 0.00 0.00 176.35 176.30 3m8p s HIS 235 N -2.51 2.01 0.17 0.29 3.76 -1.26 0.26 115.29 118.01 3m8p s HIS 235 Ca 0.33 -2.62 -0.06 0.00 -0.15 0.00 0.00 55.06 52.55 3m8p s HIS 235 Cb -0.01 -1.65 0.06 0.00 1.11 0.00 0.00 32.58 32.08 3m8p s HIS 235 CO 0.18 -0.73 1.49 -1.35 -0.85 0.00 0.00 174.74 173.48 3m8p h PRO 236 N 5.84 0.71 0.00 8.40 0.11 -1.72 -1.87 132.00 143.47 3m8p h PRO 236 Ca 0.17 -0.41 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3m8p h PRO 236 Cb 0.87 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3m8p h PRO 236 CO 0.49 1.04 0.09 -0.40 -0.21 0.00 0.00 178.00 179.01 3m8p n ASP 237 N -4.00 0.24 -2.20 -2.05 5.75 -0.96 -1.62 116.55 111.70 3m8p n ASP 237 Ca -0.03 0.55 -0.24 0.00 -0.01 0.00 0.00 54.79 55.07 3m8p n ASP 237 Cb 0.58 -0.57 0.18 0.00 -1.03 0.00 0.00 41.12 40.28 3m8p n ASP 237 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3m8p n LYS 238 N -1.80 2.24 -3.55 0.11 4.76 -0.70 -4.85 118.16 114.37 3m8p n LYS 238 Ca -0.01 -3.02 -0.34 0.00 -2.87 0.00 0.00 58.31 52.07 3m8p n LYS 238 Cb 0.11 -2.17 -0.06 0.00 -1.84 0.00 0.00 35.03 31.06 3m8p n LYS 238 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 3m8p n TRP 239 N -1.15 3.78 -3.40 2.13 8.01 -0.64 -5.04 117.44 121.14 3m8p n TRP 239 Ca 0.59 -3.97 -0.38 0.00 -1.31 0.00 0.00 57.50 52.43 3m8p n TRP 239 Cb 1.66 -0.99 -0.06 0.00 -2.01 0.00 0.00 31.31 29.91 3m8p n TRP 239 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3m8p s THR 240 N -1.78 4.90 0.71 -0.99 -4.23 -1.26 -5.07 115.64 107.91 3m8p s THR 240 Ca 0.30 1.01 -0.16 0.00 -1.18 0.00 0.00 61.69 61.66 3m8p s THR 240 Cb -0.01 -3.80 0.02 0.00 1.34 0.00 0.00 72.50 70.05 3m8p s THR 240 CO -0.08 0.56 1.25 1.33 -0.54 0.00 0.00 174.62 177.14 3m8p n VAL 241 N 1.81 3.86 -2.60 2.29 0.24 -1.26 -4.96 118.33 117.71 3m8p n VAL 241 Ca -0.12 -0.39 -0.42 0.00 -2.04 0.00 0.00 64.34 61.36 3m8p n VAL 241 Cb 0.52 -1.38 -0.03 0.00 -1.47 0.00 0.00 33.84 31.48 3m8p n VAL 241 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3m8p s GLN 242 N -3.63 3.49 0.36 7.34 2.00 -1.01 -5.00 119.66 123.21 3m8p s GLN 242 Ca 0.79 0.19 -0.27 0.00 -2.00 0.00 0.00 55.36 54.07 3m8p s GLN 242 Cb -0.35 -4.02 -0.12 0.00 0.80 0.00 0.00 33.01 29.32 3m8p s GLN 242 CO 0.44 -1.69 1.22 -2.30 -0.50 0.00 0.00 175.29 172.47 3m8p n PRO 243 N 8.40 1.91 -1.70 1.67 -0.02 -1.26 -4.76 135.00 139.25 3m8p n PRO 243 Ca 0.08 0.67 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 3m8p n PRO 243 Cb 0.49 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 3m8p n PRO 243 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3m8p s ILE 244 N -1.13 2.88 -0.11 4.25 1.01 -1.26 -4.92 121.20 121.91 3m8p s ILE 244 Ca 0.58 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 61.29 3m8p s ILE 244 Cb -0.57 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 3m8p s ILE 244 CO 0.61 -0.00 -0.09 0.68 0.00 0.00 0.00 174.94 176.13 3m8p s VAL 245 N 3.84 3.46 -0.24 2.92 -7.23 -1.26 -4.81 120.40 117.07 3m8p s VAL 245 Ca 0.85 -0.53 -0.08 0.00 -1.81 0.00 0.00 61.98 60.41 3m8p s VAL 245 Cb -0.43 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.02 3m8p s VAL 245 CO 0.39 0.54 0.08 -0.76 -0.31 0.00 0.00 175.10 175.05 3m8p s LEU 246 N -0.06 3.55 0.16 1.32 1.43 -1.26 -4.82 118.68 119.00 3m8p s LEU 246 Ca -0.01 -0.15 -0.33 0.00 -1.03 0.00 0.00 54.13 52.61 3m8p s LEU 246 Cb -0.14 -1.95 -0.16 0.00 0.03 0.00 0.00 46.19 43.98 3m8p s LEU 246 CO 0.03 -0.01 1.21 -0.81 0.23 0.00 0.00 176.35 177.00 3m8p n PRO 247 N 4.76 1.20 -2.68 1.29 -0.04 -1.26 -4.96 135.00 133.31 3m8p n PRO 247 Ca -0.16 0.43 -0.38 0.00 -0.04 0.00 0.00 63.50 63.35 3m8p n PRO 247 Cb 0.52 -1.96 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 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 -0.20 4.63 -0.22 0.54 8.01 -1.26 -5.08 118.70 125.12 3m8p s GLU 248 Ca 0.75 1.49 -0.06 0.00 0.01 0.00 0.00 54.97 57.17 3m8p s GLU 248 Cb -0.86 -2.99 0.11 0.00 -4.31 0.00 0.00 34.13 26.08 3m8p s GLU 248 CO 0.51 0.29 0.42 0.15 0.01 0.00 0.00 175.26 176.64 3m8p s LYS 249 N -1.72 0.35 0.14 1.61 1.02 -1.26 -5.01 119.74 114.87 3m8p s LYS 249 Ca 0.47 0.91 -0.24 0.00 0.02 0.00 0.00 55.97 57.13 3m8p s LYS 249 Cb -0.24 0.13 -0.03 0.00 -0.52 0.00 0.00 37.83 37.18 3m8p s LYS 249 CO 0.30 -0.38 1.26 -0.40 -0.92 0.00 0.00 175.35 175.21 3m8p n ASP 250 N 5.39 -0.83 -4.17 2.83 3.85 -1.26 -4.80 116.55 117.56 3m8p n ASP 250 Ca -0.07 1.45 -0.25 0.00 -0.71 0.00 0.00 54.79 55.22 3m8p n ASP 250 Cb 0.50 -0.20 -0.15 0.00 -1.35 0.00 0.00 41.12 39.91 3m8p n ASP 250 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 3m8p s SER 251 N -5.39 2.08 -0.04 -1.12 0.15 -1.26 -4.99 113.70 103.12 3m8p s SER 251 Ca -0.10 -0.34 0.04 0.00 0.70 0.00 0.00 55.95 56.25 3m8p s SER 251 Cb 0.10 -0.22 -0.00 0.00 -1.71 0.00 0.00 66.02 64.18 3m8p s SER 251 CO 0.52 0.21 -0.16 0.26 1.20 0.00 0.00 173.24 175.27 3m8p s TRP 252 N -0.45 1.60 0.47 3.44 0.52 -1.26 -5.10 118.94 118.16 3m8p s TRP 252 Ca 0.07 -0.47 0.07 0.00 0.02 0.00 0.00 56.10 55.79 3m8p s TRP 252 Cb -0.07 -1.09 0.01 0.00 -1.15 0.00 0.00 33.47 31.17 3m8p s TRP 252 CO -0.00 -0.17 0.46 0.95 0.02 0.00 0.00 176.95 178.20 3m8p s THR 253 N 0.14 2.34 0.00 2.01 -4.23 -1.26 -2.51 115.64 112.13 3m8p s THR 253 Ca -0.05 -1.30 -0.25 0.00 -1.18 0.00 0.00 61.69 58.91 3m8p s THR 253 Cb -0.12 -2.65 -0.18 0.00 1.34 0.00 0.00 72.50 70.90 3m8p s THR 253 CO 0.02 0.00 1.29 0.58 -0.54 0.00 0.00 174.62 175.97 3m8p h VAL 254 N 0.80 0.98 -0.77 2.29 2.07 -0.80 -2.35 116.25 118.47 3m8p h VAL 254 Ca -0.38 -0.75 0.08 0.00 0.82 0.00 0.00 66.70 66.46 3m8p h VAL 254 Cb 1.28 1.43 -0.10 0.00 -1.52 0.00 0.00 31.29 32.39 3m8p h VAL 254 CO 0.54 0.17 -0.43 -3.20 0.02 0.00 0.00 177.57 174.67 3m8p n ASN 255 N -5.02 -0.77 0.07 0.57 4.05 -1.00 -0.70 115.26 112.46 3m8p n ASN 255 Ca -0.09 1.36 0.14 0.00 0.45 0.00 0.00 54.58 56.45 3m8p n ASN 255 Cb 0.23 -0.19 0.63 0.00 1.23 0.00 0.00 39.78 41.68 3m8p n ASN 255 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 177.26 174.65 3m8p h ASP 256 N 0.00 0.08 0.06 1.20 3.32 -1.73 0.56 116.42 119.92 3m8p h ASP 256 Ca 0.14 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 3m8p h ASP 256 Cb 0.33 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.88 3m8p h ASP 256 CO -0.73 0.05 -0.61 0.40 -1.72 0.00 0.00 179.24 176.64 3m8p h ILE 257 N 0.09 1.51 -0.18 0.35 5.03 -0.47 -1.64 117.51 122.20 3m8p h ILE 257 Ca 0.17 -2.29 0.05 0.00 -0.12 0.00 0.00 64.86 62.68 3m8p h ILE 257 Cb 0.56 2.95 -0.06 0.00 -3.03 0.00 0.00 36.82 37.24 3m8p h ILE 257 CO -0.02 0.65 -0.24 1.56 -0.68 0.00 0.00 178.15 179.42 3m8p h GLN 258 N -0.34 -0.27 -0.69 2.37 4.20 -0.36 1.51 115.11 121.52 3m8p h GLN 258 Ca -0.09 0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.77 3m8p h GLN 258 Cb 1.40 0.06 -0.10 0.00 0.30 0.00 0.00 27.48 29.14 3m8p h GLN 258 CO 0.12 -0.18 0.18 0.87 -0.67 0.00 0.00 178.83 179.15 3m8p h LYS 259 N -0.28 0.29 -0.24 1.46 1.57 -0.97 0.58 116.57 118.99 3m8p h LYS 259 Ca 0.12 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3m8p h LYS 259 Cb 0.45 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3m8p h LYS 259 CO -0.34 0.19 -0.02 1.25 -0.57 0.00 0.00 179.45 179.96 3m8p h LEU 260 N 0.30 0.43 -1.05 2.94 5.85 -0.08 -1.18 115.31 122.53 3m8p h LEU 260 Ca 0.38 -0.33 0.05 0.00 0.84 0.00 0.00 57.88 58.82 3m8p h LEU 260 Cb 0.60 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 3m8p h LEU 260 CO -0.45 0.66 0.64 0.58 -0.34 0.00 0.00 178.44 179.52 3m8p h VAL 261 N 0.19 1.13 -0.09 1.05 2.07 0.27 -1.15 116.25 119.71 3m8p h VAL 261 Ca 0.06 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 3m8p h VAL 261 Cb 0.45 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.05 3m8p h VAL 261 CO 0.02 0.22 -0.04 1.23 0.02 0.00 0.00 177.57 179.02 3m8p h GLY 262 N 1.19 0.20 2.00 2.17 0.00 -0.69 0.17 103.07 108.11 3m8p h GLY 262 Ca 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 3m8p h GLY 262 CO -0.14 0.16 -0.04 1.70 0.00 0.00 0.00 176.54 178.22 3m8p h LYS 263 N -0.17 0.00 0.07 4.80 3.11 -1.08 0.97 116.57 124.27 3m8p h LYS 263 Ca 0.02 0.00 -0.33 0.00 -2.81 0.00 0.00 60.65 57.53 3m8p h LYS 263 Cb 0.47 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.67 3m8p h LYS 263 CO 0.01 0.04 -1.87 1.28 -2.81 0.00 0.00 179.45 176.10 3m8p n LEU 264 N -4.07 1.80 0.04 5.20 4.77 -0.45 -3.34 117.00 120.95 3m8p n LEU 264 Ca -0.03 0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 56.24 3m8p n LEU 264 Cb 0.12 -0.50 0.24 0.00 -2.33 0.00 0.00 43.42 40.95 3m8p n LEU 264 CO 0.31 0.63 0.76 -1.13 -1.33 0.00 0.00 177.39 176.63 3m8p h ASN 265 N 0.04 0.41 0.34 -1.43 -1.24 -0.50 -0.21 115.58 112.98 3m8p h ASN 265 Ca -0.36 -0.13 -0.02 0.00 0.71 0.00 0.00 56.30 56.51 3m8p h ASN 265 Cb 2.03 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.97 3m8p h ASN 265 CO 0.08 0.65 -0.16 -0.25 -1.29 0.00 0.00 177.43 176.46 3m8p h TRP 266 N 0.37 -0.43 -0.80 0.67 7.01 -0.97 -3.15 115.95 118.65 3m8p h TRP 266 Ca 0.06 -0.01 0.23 0.00 2.11 0.00 0.00 58.89 61.28 3m8p h TRP 266 Cb 0.61 0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 27.78 3m8p h TRP 266 CO 0.02 -0.09 0.79 0.00 -2.79 0.00 0.00 178.44 176.36 3m8p h ALA 267 N -0.37 2.62 -0.65 2.65 0.00 -1.43 -0.36 119.26 121.72 3m8p h ALA 267 Ca -0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3m8p h ALA 267 Cb 0.53 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3m8p h ALA 267 CO 0.08 -1.20 0.25 0.66 0.00 0.00 0.00 179.25 179.04 3m8p h SER 268 N 0.00 0.91 0.00 0.00 4.64 -1.00 0.98 113.55 119.08 3m8p h SER 268 Ca 0.38 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3m8p h SER 268 Cb 1.95 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 3m8p h SER 268 CO -0.00 0.85 0.00 0.00 -0.87 0.00 0.00 176.83 176.80 3m8p n GLN 269 N -4.40 0.63 -0.00 4.77 6.02 -0.15 -3.19 117.38 121.07 3m8p n GLN 269 Ca 0.04 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3m8p n GLN 269 Cb 0.18 -1.26 -0.00 0.00 1.02 0.00 0.00 30.24 30.18 3m8p n GLN 269 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3m8p n ILE 270 N -0.76 0.01 -3.13 5.09 5.41 -0.86 -4.85 119.36 120.27 3m8p n ILE 270 Ca 0.08 -0.00 -0.41 0.00 1.00 0.00 0.00 62.75 63.42 3m8p n ILE 270 Cb 0.04 -1.26 -0.07 0.00 -0.71 0.00 0.00 39.64 37.64 3m8p n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3m8p s TYR 271 N -2.00 3.27 -0.21 1.39 1.51 0.28 -4.81 117.35 116.79 3m8p s TYR 271 Ca -0.00 0.78 -0.29 0.00 -1.01 0.00 0.00 57.07 56.54 3m8p s TYR 271 Cb 0.00 -2.83 0.01 0.00 -0.11 0.00 0.00 41.96 39.02 3m8p s TYR 271 CO 0.00 -0.33 1.03 -1.25 -1.11 0.00 0.00 175.55 173.90 3m8p s PRO 272 N 2.49 4.29 0.00 -1.71 0.05 -1.26 -3.77 135.00 135.09 3m8p s PRO 272 Ca 0.25 1.37 0.00 0.00 0.05 0.00 0.00 61.00 62.67 3m8p s PRO 272 Cb -0.15 -3.62 0.00 0.00 0.05 0.00 0.00 34.50 30.77 3m8p s PRO 272 CO 0.09 -0.57 0.00 0.41 0.05 0.00 0.00 177.00 176.98 3m8p n GLY 273 N 3.28 1.03 3.77 0.56 0.00 -1.26 -4.95 105.19 107.61 3m8p n GLY 273 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 3m8p n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m8p s ILE 274 N -1.25 3.31 0.01 -0.61 -1.09 -1.25 -4.97 121.20 115.35 3m8p s ILE 274 Ca 0.00 1.00 0.01 0.00 -2.23 0.00 0.00 60.65 59.43 3m8p s ILE 274 Cb 0.00 -3.52 -0.01 0.00 -1.58 0.00 0.00 42.46 37.36 3m8p s ILE 274 CO 0.00 0.00 -0.03 -0.75 -1.23 0.00 0.00 174.94 172.93 3m8p s LYS 275 N -2.59 0.25 0.00 2.79 2.47 -1.26 -4.99 119.74 116.41 3m8p s LYS 275 Ca 0.61 -0.22 0.00 0.00 -1.56 0.00 0.00 55.97 54.80 3m8p s LYS 275 Cb -0.27 -0.17 0.00 0.00 -1.46 0.00 0.00 37.83 35.93 3m8p s LYS 275 CO 0.33 0.04 0.00 0.28 0.16 0.00 0.00 175.35 176.16 3m8p n VAL 276 N 2.69 0.00 0.00 4.02 0.31 -1.26 -4.91 118.33 119.18 3m8p n VAL 276 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3m8p n VAL 276 Cb 0.58 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 3m8p n VAL 276 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3m8p n ARG 277 N -1.82 0.00 -0.20 5.55 0.63 -1.26 -0.06 116.66 119.51 3m8p n ARG 277 Ca 0.00 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 3m8p n ARG 277 Cb 0.35 0.00 0.06 0.00 0.45 0.00 0.00 32.46 33.32 3m8p n ARG 277 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3m8p h GLN 278 N 0.00 0.63 -0.22 -0.14 1.08 -1.96 -0.21 115.11 114.30 3m8p h GLN 278 Ca 0.00 -0.04 -0.17 0.00 -1.45 0.00 0.00 58.65 56.99 3m8p h GLN 278 Cb 0.00 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 3m8p h GLN 278 CO 0.00 0.42 -0.55 -0.07 -0.95 0.00 0.00 178.83 177.68 3m8p h LEU 279 N 0.65 0.73 -1.63 1.46 4.07 -0.82 -2.06 115.31 117.71 3m8p h LEU 279 Ca 0.24 -0.39 0.03 0.00 0.08 0.00 0.00 57.88 57.84 3m8p h LEU 279 Cb 0.07 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.58 3m8p h LEU 279 CO -0.12 1.13 0.30 0.00 -1.08 0.00 0.00 178.44 178.66 3m8p h LYS 281 N 0.48 -0.44 -1.15 0.00 1.57 -0.39 -2.60 116.57 114.04 3m8p h LYS 281 Ca 0.18 0.03 0.33 0.00 -1.87 0.00 0.00 60.65 59.32 3m8p h LYS 281 Cb 0.12 0.10 -0.09 0.00 0.08 0.00 0.00 32.23 32.44 3m8p h LYS 281 CO -0.04 -0.29 0.76 -0.07 -0.57 0.00 0.00 179.45 179.23 3m8p h LEU 282 N -0.46 0.31 -7.74 2.94 4.07 0.49 -3.11 115.31 111.81 3m8p h LEU 282 Ca 0.05 0.08 -0.74 0.00 0.08 0.00 0.00 57.88 57.35 3m8p h LEU 282 Cb 0.53 0.04 -0.19 0.00 1.08 0.00 0.00 40.66 42.11 3m8p h LEU 282 CO -0.23 0.01 1.10 -0.76 -1.08 0.00 0.00 178.44 177.47 3m8p s LEU 283 N -9.34 5.30 -0.11 1.67 1.43 -0.94 -4.87 118.68 111.82 3m8p s LEU 283 Ca -0.08 -2.93 -0.05 0.00 -1.03 0.00 0.00 54.13 50.04 3m8p s LEU 283 Cb 0.26 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 3m8p s LEU 283 CO 0.81 -0.72 0.05 0.08 0.23 0.00 0.00 176.35 176.79 3m8p h ARG 284 N 7.35 0.00 0.00 1.70 0.11 -1.74 -3.48 114.38 118.32 3m8p h ARG 284 Ca 0.26 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.34 3m8p h ARG 284 Cb 0.90 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.98 3m8p h ARG 284 CO 1.17 0.12 0.00 0.41 0.10 0.00 0.00 179.97 181.78 3m8p n GLY 285 N 1.72 2.84 3.14 0.08 0.00 -1.26 -5.05 105.19 106.66 3m8p n GLY 285 Ca -0.03 -1.78 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 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 3.79 3.97 0.38 2.61 2.01 -1.26 -5.09 115.64 122.05 3m8p s THR 286 Ca 0.00 -2.72 0.08 0.00 0.31 0.00 0.00 61.69 59.36 3m8p s THR 286 Cb 0.00 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 68.88 3m8p s THR 286 CO 0.00 -0.87 0.07 -1.59 -0.69 0.00 0.00 174.62 171.54 3m8p s LYS 287 N 0.19 2.11 0.40 4.92 -2.85 -1.26 -5.12 119.74 118.13 3m8p s LYS 287 Ca 0.15 -1.85 -0.25 0.00 -1.00 0.00 0.00 55.97 53.02 3m8p s LYS 287 Cb -0.20 -1.89 -0.09 0.00 -2.06 0.00 0.00 37.83 33.60 3m8p s LYS 287 CO -0.04 0.01 1.09 0.00 0.10 0.00 0.00 175.35 176.51 3m8p s ALA 288 N -2.59 3.12 0.11 0.59 0.00 -1.26 -4.97 121.76 116.76 3m8p s ALA 288 Ca 0.37 0.80 -0.07 0.00 0.00 0.00 0.00 51.96 53.06 3m8p s ALA 288 Cb 0.03 -3.31 -0.14 0.00 0.00 0.00 0.00 23.12 19.70 3m8p s ALA 288 CO 0.20 -0.33 1.26 -0.07 0.00 0.00 0.00 175.76 176.83 3m8p h LEU 289 N 2.60 0.63 -1.60 0.00 3.38 -2.00 -2.65 115.31 115.66 3m8p h LEU 289 Ca -0.48 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 56.94 3m8p h LEU 289 Cb 1.22 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 3m8p h LEU 289 CO 0.62 1.32 -0.12 0.00 0.09 0.00 0.00 178.44 180.35 3m8p h THR 290 N 0.26 1.13 -2.12 0.22 1.03 -1.97 -2.31 112.91 109.15 3m8p h THR 290 Ca -0.10 -0.57 -0.60 0.00 -0.01 0.00 0.00 66.41 65.13 3m8p h THR 290 Cb 1.63 1.21 0.03 0.00 -1.07 0.00 0.00 68.15 69.95 3m8p h THR 290 CO 0.18 0.17 1.03 1.21 -0.01 0.00 0.00 175.52 178.10 3m8p n GLU 291 N -4.34 2.21 -2.31 0.00 2.13 -1.00 -4.71 120.64 112.63 3m8p n GLU 291 Ca -0.02 0.81 -0.32 0.00 0.66 0.00 0.00 57.16 58.29 3m8p n GLU 291 Cb 0.22 -2.64 -0.02 0.00 0.27 0.00 0.00 31.44 29.27 3m8p n GLU 291 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3m8p s VAL 292 N 3.22 4.29 -0.16 6.31 0.11 -1.26 -1.75 120.40 131.15 3m8p s VAL 292 Ca 0.89 1.11 -0.09 0.00 -2.93 0.00 0.00 61.98 60.96 3m8p s VAL 292 Cb -0.67 -3.61 0.06 0.00 -1.53 0.00 0.00 36.38 30.63 3m8p s VAL 292 CO 0.47 -0.61 0.39 -0.51 -3.33 0.00 0.00 175.10 171.51 3m8p s ILE 293 N -2.54 -0.03 -0.05 7.04 1.10 -1.04 -4.90 121.20 120.78 3m8p s ILE 293 Ca 0.61 0.10 -0.21 0.00 -0.51 0.00 0.00 60.65 60.63 3m8p s ILE 293 Cb -0.12 -0.57 -0.04 0.00 0.15 0.00 0.00 42.46 41.87 3m8p s ILE 293 CO 0.32 0.04 0.62 -2.16 -2.11 0.00 0.00 174.94 171.65 3m8p s PRO 294 N 1.35 4.37 -0.39 3.50 0.04 -1.26 -4.53 135.00 138.09 3m8p s PRO 294 Ca -0.09 0.75 -0.45 0.00 0.04 0.00 0.00 61.00 61.24 3m8p s PRO 294 Cb -0.09 -3.40 -0.19 0.00 0.04 0.00 0.00 34.50 30.86 3m8p s PRO 294 CO -0.12 0.21 1.53 1.47 0.04 0.00 0.00 177.00 180.13 3m8p n LEU 295 N 3.31 1.15 -4.83 -3.56 -0.00 -1.26 -4.99 117.00 106.83 3m8p n LEU 295 Ca -0.05 1.17 -0.30 0.00 -0.00 0.00 0.00 56.01 56.83 3m8p n LEU 295 Cb 0.51 -0.92 0.07 0.00 -0.00 0.00 0.00 43.42 43.08 3m8p n LEU 295 CO 0.45 -0.97 0.72 -0.89 -0.00 0.00 0.00 177.39 176.70 3m8p s THR 296 N 2.55 3.51 0.09 1.47 2.01 -1.26 -4.87 115.64 119.14 3m8p s THR 296 Ca 1.02 0.49 -0.31 0.00 0.31 0.00 0.00 61.69 63.20 3m8p s THR 296 Cb -1.41 -3.30 -0.14 0.00 0.01 0.00 0.00 72.50 67.67 3m8p s THR 296 CO 0.76 -0.64 1.49 -0.33 -0.69 0.00 0.00 174.62 175.21 3m8p h GLU 297 N -0.86 -0.70 -0.01 4.92 5.08 -1.99 0.19 114.58 121.20 3m8p h GLU 297 Ca -0.46 0.05 -0.25 0.00 -1.00 0.00 0.00 59.36 57.71 3m8p h GLU 297 Cb 1.24 0.16 0.02 0.00 0.50 0.00 0.00 28.75 30.67 3m8p h GLU 297 CO 0.60 -0.47 -0.95 1.49 -1.00 0.00 0.00 179.01 178.67 3m8p h GLU 298 N -0.73 0.67 -0.44 2.33 4.81 -1.98 -2.67 114.58 116.57 3m8p h GLU 298 Ca -0.02 -0.70 0.09 0.00 -0.13 0.00 0.00 59.36 58.59 3m8p h GLU 298 Cb 0.70 0.20 -0.09 0.00 0.63 0.00 0.00 28.75 30.18 3m8p h GLU 298 CO -0.20 1.29 -0.26 0.00 -0.73 0.00 0.00 179.01 179.11 3m8p h ALA 299 N 0.40 -0.01 -0.86 2.92 0.00 -1.86 0.38 119.26 120.23 3m8p h ALA 299 Ca -0.12 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.02 3m8p h ALA 299 Cb 1.61 0.61 -0.07 0.00 0.00 0.00 0.00 17.79 19.94 3m8p h ALA 299 CO 0.19 -0.63 0.52 0.93 0.00 0.00 0.00 179.25 180.25 3m8p h GLU 300 N -0.18 0.86 0.11 0.00 4.39 -1.02 -2.52 114.58 116.23 3m8p h GLU 300 Ca 0.20 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.87 3m8p h GLU 300 Cb 0.50 -0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 3m8p h GLU 300 CO -0.54 0.57 -0.27 1.25 -1.16 0.00 0.00 179.01 178.86 3m8p h LEU 301 N 0.89 -0.76 -0.35 1.33 7.12 -0.03 -2.82 115.31 120.69 3m8p h LEU 301 Ca 0.40 0.09 0.07 0.00 0.13 0.00 0.00 57.88 58.57 3m8p h LEU 301 Cb 0.30 0.29 -0.08 0.00 -0.53 0.00 0.00 40.66 40.63 3m8p h LEU 301 CO -0.22 -0.36 -0.29 -0.08 -0.13 0.00 0.00 178.44 177.37 3m8p h GLU 302 N -0.47 -0.24 -0.60 1.25 4.81 -0.56 -2.05 114.58 116.72 3m8p h GLU 302 Ca 0.03 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.37 3m8p h GLU 302 Cb 0.50 0.05 -0.11 0.00 0.63 0.00 0.00 28.75 29.83 3m8p h GLU 302 CO -0.16 -0.16 -0.41 -0.07 -0.73 0.00 0.00 179.01 177.48 3m8p h LEU 303 N -0.25 -1.43 -1.04 1.64 3.38 -1.26 0.34 115.31 116.70 3m8p h LEU 303 Ca 0.16 0.24 -0.10 0.00 0.09 0.00 0.00 57.88 58.28 3m8p h LEU 303 Cb 0.51 0.66 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3m8p h LEU 303 CO -0.49 -0.33 -0.42 0.00 0.09 0.00 0.00 178.44 177.30 3m8p h ALA 304 N 0.73 1.20 -0.52 1.53 0.00 -1.39 0.76 119.26 121.56 3m8p h ALA 304 Ca 0.20 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 3m8p h ALA 304 Cb 0.56 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3m8p h ALA 304 CO -0.70 0.56 -0.12 0.93 0.00 0.00 0.00 179.25 179.93 3m8p h GLU 305 N 0.10 0.98 -0.34 0.00 5.08 -0.26 -1.30 114.58 118.83 3m8p h GLU 305 Ca 0.01 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 57.92 3m8p h GLU 305 Cb 0.79 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3m8p h GLU 305 CO 0.06 1.03 -0.13 -0.91 -1.00 0.00 0.00 179.01 178.06 3m8p h ASN 306 N 0.87 0.71 -0.33 1.42 2.35 -0.20 -2.84 115.58 117.56 3m8p h ASN 306 Ca 0.14 -0.39 0.07 0.00 -0.55 0.00 0.00 56.30 55.56 3m8p h ASN 306 Cb 0.67 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.78 3m8p h ASN 306 CO 0.05 0.94 -0.08 0.03 -1.65 0.00 0.00 177.43 176.72 3m8p h ARG 307 N 0.48 0.01 -1.00 0.81 3.08 -0.48 0.64 114.38 117.90 3m8p h ARG 307 Ca 0.08 -0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.34 3m8p h ARG 307 Cb 0.66 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.59 3m8p h ARG 307 CO 0.04 0.01 0.61 0.93 -1.07 0.00 0.00 179.97 180.49 3m8p h GLU 308 N 0.01 0.68 -0.12 0.04 5.08 -1.27 -2.68 114.58 116.32 3m8p h GLU 308 Ca 0.16 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 3m8p h GLU 308 Cb 0.24 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3m8p h GLU 308 CO -0.34 0.45 -0.22 0.82 -1.00 0.00 0.00 179.01 178.72 3m8p h ILE 309 N 0.70 1.38 0.00 3.13 2.04 0.49 -3.19 117.51 122.05 3m8p h ILE 309 Ca 0.60 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 3m8p h ILE 309 Cb 1.02 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 39.14 3m8p h ILE 309 CO -0.41 0.43 -0.01 -0.07 0.00 0.00 0.00 178.15 178.09 3m8p h LEU 310 N -0.06 0.00 0.04 1.44 3.38 -0.92 -2.95 115.31 116.25 3m8p h LEU 310 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3m8p h LEU 310 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3m8p h LEU 310 CO 0.05 0.01 -0.02 0.11 0.09 0.00 0.00 178.44 178.68 3m8p h LYS 311 N 0.00 -0.06 -6.91 1.13 1.57 -1.49 -3.38 116.57 107.42 3m8p h LYS 311 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3m8p h LYS 311 Cb 0.23 0.01 0.08 0.00 0.08 0.00 0.00 32.23 32.63 3m8p h LYS 311 CO 0.00 0.56 0.69 -2.00 -0.57 0.00 0.00 179.45 178.13 3m8p s GLU 312 N -3.42 4.21 1.29 3.15 2.56 -1.12 -4.79 118.70 120.58 3m8p s GLU 312 Ca -0.16 2.36 -0.18 0.00 0.00 0.00 0.00 54.97 56.99 3m8p s GLU 312 Cb -0.00 -2.99 0.32 0.00 2.00 0.00 0.00 34.13 33.46 3m8p s GLU 312 CO 0.62 -0.37 1.00 -1.25 -0.56 0.00 0.00 175.26 174.70 3m8p s PRO 313 N -1.97 -1.86 0.10 4.30 0.04 -1.26 -4.90 135.00 129.44 3m8p s PRO 313 Ca 0.51 0.34 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 3m8p s PRO 313 Cb -0.42 -1.48 -0.07 0.00 0.04 0.00 0.00 34.50 32.56 3m8p s PRO 313 CO 0.57 -4.22 1.34 0.08 0.04 0.00 0.00 177.00 174.81 3m8p s VAL 314 N -2.49 3.49 -0.13 -0.36 1.01 -1.26 -4.99 120.40 115.67 3m8p s VAL 314 Ca 0.69 1.06 -0.26 0.00 0.00 0.00 0.00 61.98 63.47 3m8p s VAL 314 Cb -0.17 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 3m8p s VAL 314 CO 0.60 0.08 0.85 -2.28 0.00 0.00 0.00 175.10 174.35 3m8p s HIS 315 N 1.11 3.48 0.00 5.22 2.46 -1.26 -4.06 115.29 122.25 3m8p s HIS 315 Ca 0.63 1.34 0.00 0.00 0.47 0.00 0.00 55.06 57.50 3m8p s HIS 315 Cb -0.35 -3.01 0.00 0.00 -0.13 0.00 0.00 32.58 29.09 3m8p s HIS 315 CO 0.30 -0.16 0.00 0.41 -2.47 0.00 0.00 174.74 172.82 3m8p n GLY 316 N 3.29 1.64 3.44 1.59 0.00 -1.26 -4.70 105.19 109.19 3m8p n GLY 316 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 3m8p n GLY 316 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3m8p s VAL 317 N -2.01 3.86 0.02 1.61 -7.23 -1.26 -5.07 120.40 110.33 3m8p s VAL 317 Ca 0.00 -0.35 0.01 0.00 -1.81 0.00 0.00 61.98 59.83 3m8p s VAL 317 Cb 0.00 -2.74 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 3m8p s VAL 317 CO 0.00 0.44 -0.04 -0.31 -0.31 0.00 0.00 175.10 174.88 3m8p s TYR 318 N 0.95 0.35 0.04 2.82 1.51 -1.26 -5.02 117.35 116.73 3m8p s TYR 318 Ca 0.01 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.34 3m8p s TYR 318 Cb -0.14 -0.23 -0.07 0.00 -0.11 0.00 0.00 41.96 41.41 3m8p s TYR 318 CO 0.02 -0.13 1.47 -0.47 -1.11 0.00 0.00 175.55 175.33 3m8p s TYR 319 N -1.17 2.79 -0.29 2.71 5.04 -1.26 -5.00 117.35 120.18 3m8p s TYR 319 Ca -0.11 0.70 -0.06 0.00 -2.44 0.00 0.00 57.07 55.15 3m8p s TYR 319 Cb -0.08 -3.75 0.01 0.00 0.35 0.00 0.00 41.96 38.48 3m8p s TYR 319 CO -0.00 -2.84 0.06 0.34 -1.34 0.00 0.00 175.55 171.77 3m8p s ASP 320 N 1.91 5.04 0.02 4.32 -1.08 -1.26 -4.97 116.67 120.64 3m8p s ASP 320 Ca 0.67 -0.67 0.07 0.00 -0.52 0.00 0.00 52.55 52.10 3m8p s ASP 320 Cb -0.35 -1.86 0.33 0.00 -1.46 0.00 0.00 42.92 39.58 3m8p s ASP 320 CO 0.29 -0.17 1.24 -2.65 0.52 0.00 0.00 175.17 174.39 3m8p n PRO 321 N 4.85 0.01 0.01 4.34 -0.02 -1.26 -2.68 135.00 140.25 3m8p n PRO 321 Ca -0.15 0.40 0.11 0.00 -2.02 0.00 0.00 63.50 61.84 3m8p n PRO 321 Cb 0.48 -1.53 -0.07 0.00 -0.02 0.00 0.00 33.50 32.37 3m8p n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3m8p n SER 322 N -1.55 0.58 -4.90 2.55 3.41 -1.26 -4.87 113.62 107.58 3m8p n SER 322 Ca 0.01 -0.40 -0.31 0.00 -0.26 0.00 0.00 58.87 57.90 3m8p n SER 322 Cb 0.08 1.14 -0.05 0.00 -0.26 0.00 0.00 64.21 65.13 3m8p n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3m8p s LYS 323 N -3.21 3.59 0.44 4.33 1.02 -1.09 -5.11 119.74 119.71 3m8p s LYS 323 Ca 0.02 -0.14 -0.25 0.00 0.02 0.00 0.00 55.97 55.62 3m8p s LYS 323 Cb 0.15 -2.89 -0.08 0.00 -0.52 0.00 0.00 37.83 34.49 3m8p s LYS 323 CO 0.85 0.50 1.30 -0.51 -0.92 0.00 0.00 175.35 176.56 3m8p s ASP 324 N -2.42 6.07 -0.05 2.83 1.01 -1.26 -4.89 116.67 117.96 3m8p s ASP 324 Ca 0.40 2.63 -0.17 0.00 0.71 0.00 0.00 52.55 56.12 3m8p s ASP 324 Cb -0.12 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.12 3m8p s ASP 324 CO 0.25 -1.01 0.46 -0.76 0.21 0.00 0.00 175.17 174.32 3m8p s LEU 325 N -2.75 4.38 0.12 1.23 1.43 -1.26 -4.58 118.68 117.26 3m8p s LEU 325 Ca 0.61 0.93 0.10 0.00 -1.03 0.00 0.00 54.13 54.74 3m8p s LEU 325 Cb -0.37 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.13 3m8p s LEU 325 CO 0.47 0.16 -0.26 -0.51 0.23 0.00 0.00 176.35 176.44 3m8p s ILE 326 N -0.24 2.14 -0.09 -0.59 1.10 0.12 -0.64 121.20 123.01 3m8p s ILE 326 Ca 0.25 -1.69 -0.00 0.00 -0.51 0.00 0.00 60.65 58.70 3m8p s ILE 326 Cb -0.16 -1.90 0.02 0.00 0.15 0.00 0.00 42.46 40.57 3m8p s ILE 326 CO 0.13 0.08 -0.05 0.00 -2.11 0.00 0.00 174.94 172.98 3m8p s ALA 327 N -1.06 1.04 0.02 1.50 0.00 0.00 -1.19 121.76 122.07 3m8p s ALA 327 Ca 0.12 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.77 3m8p s ALA 327 Cb -0.10 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 3m8p s ALA 327 CO 0.05 -0.32 0.02 -1.21 0.00 0.00 0.00 175.76 174.30 3m8p s GLU 328 N 1.58 2.78 -0.02 0.00 2.02 -0.20 -0.75 118.70 124.10 3m8p s GLU 328 Ca 0.01 -0.65 0.04 0.00 0.02 0.00 0.00 54.97 54.39 3m8p s GLU 328 Cb -0.13 -2.67 -0.01 0.00 0.10 0.00 0.00 34.13 31.42 3m8p s GLU 328 CO -0.05 0.61 -0.13 0.42 0.02 0.00 0.00 175.26 176.12 3m8p s ILE 329 N -1.17 1.07 -0.07 -1.63 1.01 -1.23 -0.97 121.20 118.22 3m8p s ILE 329 Ca 0.22 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.35 3m8p s ILE 329 Cb -0.12 -0.91 -0.00 0.00 0.01 0.00 0.00 42.46 41.44 3m8p s ILE 329 CO 0.13 0.31 -0.20 -1.10 0.00 0.00 0.00 174.94 174.08 3m8p s GLN 330 N -0.14 2.35 -0.20 2.79 1.11 0.42 -4.51 119.66 121.49 3m8p s GLN 330 Ca 0.02 -0.72 -0.29 0.00 0.01 0.00 0.00 55.36 54.38 3m8p s GLN 330 Cb -0.07 -1.90 -0.01 0.00 -1.01 0.00 0.00 33.01 30.02 3m8p s GLN 330 CO 0.00 0.20 1.31 0.21 0.01 0.00 0.00 175.29 177.02 3m8p s LYS 331 N 0.24 4.13 0.00 2.91 2.20 -1.26 -2.05 119.74 125.91 3m8p s LYS 331 Ca -0.11 1.58 0.25 0.00 -0.36 0.00 0.00 55.97 57.33 3m8p s LYS 331 Cb -0.15 -3.82 0.49 0.00 -1.51 0.00 0.00 37.83 32.84 3m8p s LYS 331 CO 0.05 -0.84 1.43 1.04 -0.36 0.00 0.00 175.35 176.67 3m8p n GLN 332 N 6.86 2.13 0.00 4.03 1.13 0.10 -4.98 117.38 126.65 3m8p n GLN 332 Ca 0.14 -1.66 0.00 0.00 -1.94 0.00 0.00 57.00 53.54 3m8p n GLN 332 Cb 0.45 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.33 3m8p n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3m8p n GLY 333 N 1.31 -1.72 3.73 1.08 0.00 -1.24 -4.88 105.19 103.47 3m8p n GLY 333 Ca 0.16 -1.46 -0.24 0.00 0.00 0.00 0.00 46.02 44.48 3m8p n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m8p n GLN 334 N -0.98 -5.83 -1.05 1.61 6.02 -1.26 -2.77 117.38 113.11 3m8p n GLN 334 Ca 0.00 0.67 -0.02 0.00 -0.01 0.00 0.00 57.00 57.64 3m8p n GLN 334 Cb 0.00 -5.48 -0.01 0.00 1.02 0.00 0.00 30.24 25.77 3m8p n GLN 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m8p n GLY 335 N -1.63 0.54 3.35 1.08 0.00 -1.26 -5.00 105.19 102.27 3m8p n GLY 335 Ca -0.13 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.49 2.05 0.02 1.61 -1.52 -1.12 -4.30 119.66 114.91 3m8p s GLN 336 Ca 0.00 -0.97 -0.02 0.00 -1.95 0.00 0.00 55.36 52.42 3m8p s GLN 336 Cb 0.00 -2.07 -0.02 0.00 -0.22 0.00 0.00 33.01 30.70 3m8p s GLN 336 CO 0.00 0.55 0.02 -1.58 -0.25 0.00 0.00 175.29 174.03 3m8p s TRP 337 N -0.72 0.23 0.13 0.91 0.52 -0.61 -0.72 118.94 118.68 3m8p s TRP 337 Ca 0.11 -0.50 0.08 0.00 0.02 0.00 0.00 56.10 55.81 3m8p s TRP 337 Cb -0.10 -0.17 -0.04 0.00 -1.15 0.00 0.00 33.47 32.01 3m8p s TRP 337 CO 0.01 -0.25 -0.19 0.95 0.02 0.00 0.00 176.95 177.49 3m8p s THR 338 N -1.80 1.68 0.03 2.01 -4.23 -0.87 -0.40 115.64 112.06 3m8p s THR 338 Ca -0.12 -1.71 -0.17 0.00 -1.18 0.00 0.00 61.69 58.51 3m8p s THR 338 Cb -0.07 -1.65 0.03 0.00 1.34 0.00 0.00 72.50 72.16 3m8p s THR 338 CO -0.02 -0.22 0.38 -0.72 -0.54 0.00 0.00 174.62 173.51 3m8p s TYR 339 N -1.66 -0.24 -0.00 3.99 1.13 -0.75 -0.44 117.35 119.39 3m8p s TYR 339 Ca 0.10 0.23 0.01 0.00 -1.41 0.00 0.00 57.07 56.00 3m8p s TYR 339 Cb -0.08 0.18 -0.00 0.00 -1.10 0.00 0.00 41.96 40.96 3m8p s TYR 339 CO 0.05 -0.53 -0.04 -0.65 -2.51 0.00 0.00 175.55 171.87 3m8p s GLN 340 N -2.22 0.34 -0.13 -3.49 1.11 -0.14 -0.69 119.66 114.44 3m8p s GLN 340 Ca -0.07 -0.14 0.00 0.00 0.01 0.00 0.00 55.36 55.16 3m8p s GLN 340 Cb -0.02 -0.34 -0.01 0.00 -1.01 0.00 0.00 33.01 31.64 3m8p s GLN 340 CO -0.01 0.08 -0.14 0.42 0.01 0.00 0.00 175.29 175.66 3m8p s ILE 341 N -0.05 2.97 0.14 1.08 1.01 -0.17 -1.03 121.20 125.15 3m8p s ILE 341 Ca 0.01 -0.69 -0.18 0.00 0.00 0.00 0.00 60.65 59.79 3m8p s ILE 341 Cb -0.02 -2.24 0.05 0.00 0.01 0.00 0.00 42.46 40.25 3m8p s ILE 341 CO -0.00 0.52 0.48 -0.72 0.00 0.00 0.00 174.94 175.22 3m8p s TYR 342 N 0.41 -0.31 -0.20 3.97 -0.85 -0.34 0.13 117.35 120.17 3m8p s TYR 342 Ca -0.11 0.03 -0.12 0.00 -0.52 0.00 0.00 57.07 56.35 3m8p s TYR 342 Cb -0.16 0.37 -0.08 0.00 0.38 0.00 0.00 41.96 42.47 3m8p s TYR 342 CO 0.05 -0.77 -0.29 1.04 -1.52 0.00 0.00 175.55 174.06 3m8p n GLN 343 N -0.29 0.47 -3.75 -3.49 6.02 -1.26 -0.70 117.38 114.38 3m8p n GLN 343 Ca -0.16 0.20 -0.36 0.00 -0.01 0.00 0.00 57.00 56.67 3m8p n GLN 343 Cb 0.64 -1.30 -0.07 0.00 1.02 0.00 0.00 30.24 30.54 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 -2.51 3.80 0.20 -1.09 0.41 -1.26 -4.79 118.70 113.46 3m8p s GLU 344 Ca -0.30 -0.06 -0.32 0.00 -0.41 0.00 0.00 54.97 53.88 3m8p s GLU 344 Cb 0.10 -3.29 -0.15 0.00 -1.78 0.00 0.00 34.13 29.01 3m8p s GLU 344 CO 0.39 0.57 1.29 -2.30 -0.49 0.00 0.00 175.26 174.72 3m8p n PRO 345 N 2.59 1.60 0.00 0.39 -0.02 -1.26 -1.86 135.00 136.43 3m8p n PRO 345 Ca -0.17 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3m8p n PRO 345 Cb 0.53 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 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 1.76 0.00 -0.40 6.00 3.01 -1.26 -4.91 117.46 121.65 3m8p n PHE 346 Ca 0.13 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.31 3m8p n PHE 346 Cb 0.28 -0.03 -0.07 0.00 -0.01 0.00 0.00 39.48 39.66 3m8p n PHE 346 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3m8p n LYS 347 N -0.23 0.27 -1.73 -1.08 4.76 -0.78 -4.84 118.16 114.52 3m8p n LYS 347 Ca 0.00 -0.94 -0.42 0.00 -2.87 0.00 0.00 58.31 54.08 3m8p n LYS 347 Cb 0.00 -2.36 -0.01 0.00 -1.84 0.00 0.00 35.03 30.81 3m8p n LYS 347 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3m8p n ASN 348 N 7.20 3.39 -0.04 4.39 3.02 -1.26 -4.47 115.26 127.49 3m8p n ASN 348 Ca 0.31 1.18 0.02 0.00 -0.03 0.00 0.00 54.58 56.06 3m8p n ASN 348 Cb 0.26 -1.54 -0.15 0.00 -0.61 0.00 0.00 39.78 37.73 3m8p n ASN 348 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3m8p n LEU 349 N 1.46 0.00 -3.63 3.41 4.77 0.12 -4.77 117.00 118.36 3m8p n LEU 349 Ca 0.07 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.90 3m8p n LEU 349 Cb 0.36 0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.57 3m8p n LEU 349 CO 0.63 0.19 0.40 -0.75 -1.33 0.00 0.00 177.39 176.53 3m8p s LYS 350 N -3.03 0.84 0.11 3.23 2.47 -1.18 -5.00 119.74 117.18 3m8p s LYS 350 Ca -0.08 0.91 0.06 0.00 -1.56 0.00 0.00 55.97 55.30 3m8p s LYS 350 Cb 0.10 0.41 -0.04 0.00 -1.46 0.00 0.00 37.83 36.84 3m8p s LYS 350 CO 0.82 -0.12 -0.15 0.95 0.16 0.00 0.00 175.35 177.01 3m8p s THR 351 N 0.23 1.32 0.00 3.43 -4.23 -1.26 -1.00 115.64 114.13 3m8p s THR 351 Ca -0.01 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 3m8p s THR 351 Cb -0.04 -1.46 0.00 0.00 1.34 0.00 0.00 72.50 72.33 3m8p s THR 351 CO 0.02 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.35 3m8p n GLY 352 N 0.69 2.40 3.22 3.99 0.00 0.13 -2.40 105.19 113.22 3m8p n GLY 352 Ca -0.17 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 3m8p n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3m8p s LYS 353 N -0.75 0.71 -0.06 1.61 2.20 -1.26 -1.81 119.74 120.38 3m8p s LYS 353 Ca 0.00 -0.41 -0.05 0.00 -0.36 0.00 0.00 55.97 55.14 3m8p s LYS 353 Cb 0.00 0.31 0.02 0.00 -1.51 0.00 0.00 37.83 36.64 3m8p s LYS 353 CO 0.00 -0.21 0.16 -0.47 -0.36 0.00 0.00 175.35 174.47 3m8p s TYR 354 N -2.04 -0.17 -0.11 4.03 5.04 0.46 -4.95 117.35 119.61 3m8p s TYR 354 Ca -0.09 0.42 -0.02 0.00 -2.44 0.00 0.00 57.07 54.94 3m8p s TYR 354 Cb -0.03 0.06 0.04 0.00 0.35 0.00 0.00 41.96 42.38 3m8p s TYR 354 CO -0.00 -0.08 0.03 0.00 -1.34 0.00 0.00 175.55 174.15 3m8p s ALA 355 N 0.09 0.66 -0.06 3.97 0.00 -1.26 -1.57 121.76 123.59 3m8p s ALA 355 Ca -0.00 -0.24 0.20 0.00 0.00 0.00 0.00 51.96 51.92 3m8p s ALA 355 Cb -0.01 -0.87 -0.30 0.00 0.00 0.00 0.00 23.12 21.93 3m8p s ALA 355 CO 0.00 -0.74 0.37 0.25 0.00 0.00 0.00 175.76 175.64 3m8p n THR 362 N 5.17 0.28 -4.32 0.00 -2.24 -1.26 -4.92 114.28 106.98 3m8p n THR 362 Ca -0.07 -0.54 -0.23 0.00 -2.27 0.00 0.00 64.05 60.93 3m8p n THR 362 Cb 0.49 -0.08 -0.12 0.00 -2.10 0.00 0.00 70.33 68.52 3m8p n THR 362 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3m8p s ASN 363 N -4.58 2.69 0.30 3.42 2.20 -1.26 -5.05 114.94 112.65 3m8p s ASN 363 Ca -0.08 -0.78 0.01 0.00 -0.94 0.00 0.00 52.86 51.07 3m8p s ASN 363 Cb 0.12 -0.16 0.72 0.00 -2.00 0.00 0.00 41.25 39.93 3m8p s ASN 363 CO 0.84 0.02 1.60 0.44 -2.94 0.00 0.00 177.10 177.06 3m8p h ASP 364 N 3.63 -0.33 -0.15 3.54 3.32 -2.04 -1.04 116.42 123.34 3m8p h ASP 364 Ca -0.45 0.25 -0.14 0.00 0.02 0.00 0.00 57.03 56.71 3m8p h ASP 364 Cb 1.19 0.41 0.00 0.00 0.22 0.00 0.00 39.33 41.16 3m8p h ASP 364 CO 0.45 -0.29 -0.46 0.58 -1.72 0.00 0.00 179.24 177.80 3m8p h VAL 365 N 0.06 1.34 -0.12 -1.35 2.07 -1.98 0.61 116.25 116.89 3m8p h VAL 365 Ca 0.57 -1.72 0.05 0.00 0.82 0.00 0.00 66.70 66.41 3m8p h VAL 365 Cb 1.17 2.01 -0.06 0.00 -1.52 0.00 0.00 31.29 32.90 3m8p h VAL 365 CO -0.82 0.53 -0.24 0.50 0.02 0.00 0.00 177.57 177.55 3m8p h LYS 366 N 0.23 -0.30 -0.49 1.57 3.64 -1.59 0.97 116.57 120.60 3m8p h LYS 366 Ca -0.01 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3m8p h LYS 366 Cb 1.08 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 3m8p h LYS 366 CO 0.10 -0.20 0.30 1.96 -2.27 0.00 0.00 179.45 179.34 3m8p h GLN 367 N -0.31 0.66 -0.75 1.90 4.20 -1.07 0.16 115.11 119.91 3m8p h GLN 367 Ca 0.10 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3m8p h GLN 367 Cb 0.46 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3m8p h GLN 367 CO -0.30 0.47 0.43 1.25 -0.67 0.00 0.00 178.83 180.00 3m8p h LEU 368 N 0.66 0.92 -1.04 1.46 5.85 0.71 -1.01 115.31 122.86 3m8p h LEU 368 Ca 0.18 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 3m8p h LEU 368 Cb -0.03 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.76 3m8p h LEU 368 CO -0.03 0.74 -0.15 0.71 -0.34 0.00 0.00 178.44 179.36 3m8p h THR 369 N 1.03 0.35 -0.11 1.05 1.35 0.39 -0.93 112.91 116.04 3m8p h THR 369 Ca 0.27 -0.99 -0.13 0.00 -0.55 0.00 0.00 66.41 65.01 3m8p h THR 369 Cb 0.01 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3m8p h THR 369 CO -0.05 0.15 -0.43 -0.33 -0.25 0.00 0.00 175.52 174.61 3m8p h GLU 370 N 0.00 0.48 -0.55 4.72 5.08 0.17 -2.09 114.58 122.40 3m8p h GLU 370 Ca -0.00 -0.37 0.06 0.00 -1.00 0.00 0.00 59.36 58.04 3m8p h GLU 370 Cb 0.74 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.01 3m8p h GLU 370 CO 0.02 1.00 0.26 0.00 -1.00 0.00 0.00 179.01 179.29 3m8p h ALA 371 N 0.48 0.70 -0.56 3.43 0.00 -0.85 0.18 119.26 122.65 3m8p h ALA 371 Ca -0.02 0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.98 3m8p h ALA 371 Cb 1.06 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 3m8p h ALA 371 CO 0.09 -0.10 0.27 0.28 0.00 0.00 0.00 179.25 179.79 3m8p h VAL 372 N 0.50 0.92 -0.27 0.00 2.07 -1.21 0.36 116.25 118.62 3m8p h VAL 372 Ca 0.25 -0.18 -0.14 0.00 0.82 0.00 0.00 66.70 67.45 3m8p h VAL 372 Cb 0.19 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3m8p h VAL 372 CO -0.19 0.09 -0.42 1.56 0.02 0.00 0.00 177.57 178.63 3m8p h GLN 373 N 0.52 0.66 0.01 1.57 4.20 -0.55 -1.41 115.11 120.12 3m8p h GLN 373 Ca 0.25 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 3m8p h GLN 373 Cb 0.19 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.98 3m8p h GLN 373 CO -0.19 0.96 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.70 3m8p h LYS 374 N 0.54 -0.02 -0.44 1.46 3.64 -0.62 0.33 116.57 121.46 3m8p h LYS 374 Ca 0.04 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 3m8p h LYS 374 Cb 0.96 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 3m8p h LYS 374 CO 0.09 0.11 -0.15 0.82 -2.27 0.00 0.00 179.45 178.05 3m8p h ILE 375 N -0.14 1.26 -0.46 2.00 2.04 -0.18 -1.64 117.51 120.40 3m8p h ILE 375 Ca -0.00 -1.24 -0.09 0.00 1.00 0.00 0.00 64.86 64.52 3m8p h ILE 375 Cb 0.14 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 3m8p h ILE 375 CO 0.00 0.42 -0.09 0.74 0.00 0.00 0.00 178.15 179.23 3m8p h THR 376 N 0.74 1.26 -0.71 -0.27 2.02 -1.06 -1.39 112.91 113.50 3m8p h THR 376 Ca 0.12 -1.15 -0.06 0.00 0.77 0.00 0.00 66.41 66.09 3m8p h THR 376 Cb 0.65 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3m8p h THR 376 CO 0.05 0.40 0.22 0.74 0.37 0.00 0.00 175.52 177.29 3m8p h THR 377 N 0.74 1.26 -0.12 3.16 2.02 -0.01 -1.19 112.91 118.77 3m8p h THR 377 Ca 0.13 -0.89 -0.18 0.00 0.77 0.00 0.00 66.41 66.23 3m8p h THR 377 Cb 0.57 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 3m8p h THR 377 CO 0.04 0.35 -0.68 -0.33 0.37 0.00 0.00 175.52 175.26 3m8p h GLU 378 N 1.05 0.52 -0.55 6.66 5.08 -1.14 -2.13 114.58 124.06 3m8p h GLU 378 Ca 0.23 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.17 3m8p h GLU 378 Cb 0.30 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 3m8p h GLU 378 CO -0.01 1.02 0.24 1.03 -1.00 0.00 0.00 179.01 180.28 3m8p h SER 379 N 0.37 0.75 0.04 1.42 0.87 -0.69 -1.31 113.55 114.99 3m8p h SER 379 Ca -0.02 -0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.38 3m8p h SER 379 Cb 1.26 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 3m8p h SER 379 CO 0.12 0.70 -0.02 0.40 -0.53 0.00 0.00 176.83 177.51 3m8p h ILE 380 N 0.75 1.00 -0.70 2.23 2.04 -0.84 -0.02 117.51 121.98 3m8p h ILE 380 Ca 0.19 -0.12 0.09 0.00 1.00 0.00 0.00 64.86 66.02 3m8p h ILE 380 Cb 0.17 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.27 3m8p h ILE 380 CO -0.02 0.03 0.34 0.58 0.00 0.00 0.00 178.15 179.08 3m8p h VAL 381 N -0.10 0.83 0.09 1.67 2.07 -1.14 -0.75 116.25 118.93 3m8p h VAL 381 Ca -0.00 -0.20 -0.20 0.00 0.82 0.00 0.00 66.70 67.12 3m8p h VAL 381 Cb 0.09 0.21 0.02 0.00 -1.52 0.00 0.00 31.29 30.09 3m8p h VAL 381 CO 0.01 0.10 -0.85 0.40 0.02 0.00 0.00 177.57 177.25 3m8p h ILE 382 N 0.57 1.43 0.00 4.57 2.04 -0.90 -3.38 117.51 121.83 3m8p h ILE 382 Ca 0.34 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.84 3m8p h ILE 382 Cb 0.37 2.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.33 3m8p h ILE 382 CO -0.28 0.69 0.00 0.79 0.00 0.00 0.00 178.15 179.35 3m8p n TRP 383 N -4.08 0.00 -1.58 1.37 8.01 -0.05 -4.92 117.44 116.19 3m8p n TRP 383 Ca -0.13 0.00 -0.07 0.00 -1.31 0.00 0.00 57.50 55.99 3m8p n TRP 383 Cb 0.81 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.09 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 0.53 0.58 3.41 6.99 0.00 -0.29 -4.98 105.19 111.43 3m8p n GLY 384 Ca 0.00 -0.68 -0.16 0.00 0.00 0.00 0.00 46.02 45.19 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 -3.30 0.87 0.23 1.61 -2.85 -1.26 -4.98 119.74 110.05 3m8p s LYS 385 Ca 0.00 0.17 -0.10 0.00 -1.00 0.00 0.00 55.97 55.04 3m8p s LYS 385 Cb 0.00 0.40 -0.07 0.00 -2.06 0.00 0.00 37.83 36.10 3m8p s LYS 385 CO 0.00 -0.24 0.55 0.95 0.10 0.00 0.00 175.35 176.70 3m8p s THR 386 N -1.04 4.93 0.38 3.79 -4.23 -1.26 -3.76 115.64 114.45 3m8p s THR 386 Ca -0.10 0.49 -0.08 0.00 -1.18 0.00 0.00 61.69 60.81 3m8p s THR 386 Cb -0.02 -3.62 -0.06 0.00 1.34 0.00 0.00 72.50 70.14 3m8p s THR 386 CO 0.07 -0.06 0.70 -2.16 -0.54 0.00 0.00 174.62 172.63 3m8p s PRO 387 N -2.78 3.69 -0.07 3.99 0.04 -1.26 -4.62 135.00 133.99 3m8p s PRO 387 Ca 0.47 0.26 -0.28 0.00 0.04 0.00 0.00 61.00 61.49 3m8p s PRO 387 Cb -0.11 -2.48 -0.02 0.00 0.04 0.00 0.00 34.50 31.93 3m8p s PRO 387 CO 0.21 0.02 0.93 0.21 0.04 0.00 0.00 177.00 178.42 3m8p s LYS 388 N -3.90 4.46 0.00 4.56 2.36 0.19 -4.21 119.74 123.20 3m8p s LYS 388 Ca 0.48 1.29 -0.07 0.00 -2.55 0.00 0.00 55.97 55.11 3m8p s LYS 388 Cb -0.10 -3.50 -0.05 0.00 -1.05 0.00 0.00 37.83 33.12 3m8p s LYS 388 CO 0.33 -0.17 0.28 -0.06 1.55 0.00 0.00 175.35 177.28 3m8p s PHE 389 N 1.50 3.59 -0.55 4.03 0.40 0.56 -0.82 117.98 126.70 3m8p s PHE 389 Ca 0.47 0.61 -0.08 0.00 -0.60 0.00 0.00 56.93 57.33 3m8p s PHE 389 Cb -0.19 -2.02 0.14 0.00 0.51 0.00 0.00 43.02 41.47 3m8p s PHE 389 CO 0.21 0.62 0.42 0.15 0.70 0.00 0.00 175.22 177.32 3m8p s LYS 390 N -1.67 2.65 -0.14 0.44 1.02 0.07 -0.25 119.74 121.85 3m8p s LYS 390 Ca 0.27 -2.03 -0.18 0.00 0.02 0.00 0.00 55.97 54.05 3m8p s LYS 390 Cb -0.13 -3.96 -0.04 0.00 -0.52 0.00 0.00 37.83 33.18 3m8p s LYS 390 CO 0.15 -1.20 0.47 -0.51 -0.92 0.00 0.00 175.35 173.34 3m8p s LEU 391 N 0.89 4.24 -1.31 3.17 1.43 -0.08 -3.57 118.68 123.44 3m8p s LEU 391 Ca 0.10 0.74 -0.12 0.00 -1.03 0.00 0.00 54.13 53.82 3m8p s LEU 391 Cb -0.23 -2.66 0.13 0.00 0.03 0.00 0.00 46.19 43.46 3m8p s LEU 391 CO -0.03 -0.04 1.88 -0.81 0.23 0.00 0.00 176.35 177.59 3m8p n PRO 392 N 3.96 3.37 -3.53 1.29 -0.04 -1.26 -1.59 135.00 137.20 3m8p n PRO 392 Ca -0.07 -3.34 -0.10 0.00 -0.04 0.00 0.00 63.50 59.95 3m8p n PRO 392 Cb 0.51 -3.07 -0.04 0.00 -0.04 0.00 0.00 33.50 30.87 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 1.51 0.00 0.08 0.52 2.07 -1.26 -4.99 121.20 119.13 3m8p s ILE 393 Ca 0.43 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.36 3m8p s ILE 393 Cb 0.08 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.61 3m8p s ILE 393 CO -0.01 0.00 1.19 -1.58 -1.91 0.00 0.00 174.94 172.63 3m8p s GLN 394 N -2.13 4.45 0.30 3.50 0.74 -1.26 -4.46 119.66 120.79 3m8p s GLN 394 Ca 0.01 1.77 0.04 0.00 0.05 0.00 0.00 55.36 57.24 3m8p s GLN 394 Cb -0.01 -3.33 0.80 0.00 1.10 0.00 0.00 33.01 31.57 3m8p s GLN 394 CO -0.03 -0.22 1.63 -0.22 -0.55 0.00 0.00 175.29 175.90 3m8p h LYS 395 N 6.54 0.16 0.16 1.67 3.64 -1.98 -0.73 116.57 126.03 3m8p h LYS 395 Ca -0.42 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 58.72 3m8p h LYS 395 Cb 1.21 -0.04 0.02 0.00 -0.41 0.00 0.00 32.23 33.02 3m8p h LYS 395 CO 0.80 0.10 -1.04 0.93 -2.27 0.00 0.00 179.45 177.97 3m8p h GLU 396 N 0.16 0.33 -0.68 1.90 3.07 -1.98 0.13 114.58 117.51 3m8p h GLU 396 Ca 0.60 -0.56 0.13 0.00 -0.50 0.00 0.00 59.36 59.02 3m8p h GLU 396 Cb 1.26 0.21 -0.13 0.00 -0.84 0.00 0.00 28.75 29.26 3m8p h GLU 396 CO -0.71 1.27 -0.25 1.15 -1.40 0.00 0.00 179.01 179.07 3m8p h THR 397 N -0.27 0.22 -0.42 1.13 2.02 -1.76 -0.38 112.91 113.45 3m8p h THR 397 Ca -0.19 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.94 3m8p h THR 397 Cb 1.75 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 3m8p h THR 397 CO 0.15 0.00 0.07 -0.25 0.37 0.00 0.00 175.52 175.87 3m8p h TRP 398 N -0.07 0.73 -0.56 3.16 2.91 -0.78 -0.87 115.95 120.47 3m8p h TRP 398 Ca 0.30 -0.10 -0.08 0.00 1.13 0.00 0.00 58.89 60.14 3m8p h TRP 398 Cb 0.54 -0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 28.97 3m8p h TRP 398 CO -0.61 0.71 0.04 0.93 -1.03 0.00 0.00 178.44 178.47 3m8p h GLU 399 N 0.55 0.97 -0.43 2.65 4.39 -0.41 0.29 114.58 122.58 3m8p h GLU 399 Ca 0.13 -0.29 0.03 0.00 0.34 0.00 0.00 59.36 59.57 3m8p h GLU 399 Cb 0.37 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 3m8p h GLU 399 CO 0.01 0.95 0.24 1.15 -1.16 0.00 0.00 179.01 180.19 3m8p h THR 400 N 0.85 1.01 0.00 1.13 2.02 -0.92 -3.35 112.91 113.66 3m8p h THR 400 Ca 0.16 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3m8p h THR 400 Cb 0.49 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 3m8p h THR 400 CO 0.02 0.09 -1.47 0.79 0.37 0.00 0.00 175.52 175.31 3m8p n TRP 401 N -4.87 0.00 -0.11 3.16 7.02 -0.35 -4.63 117.44 117.66 3m8p n TRP 401 Ca 0.02 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.51 3m8p n TRP 401 Cb 0.08 -0.27 0.28 0.00 -2.42 0.00 0.00 31.31 28.99 3m8p n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 3m8p h TRP 402 N 0.00 0.76 0.00 -5.99 5.08 -0.56 -2.55 115.95 112.70 3m8p h TRP 402 Ca 0.00 -0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.96 3m8p h TRP 402 Cb 0.65 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 26.57 3m8p h TRP 402 CO 0.00 0.55 0.00 1.79 -1.28 0.00 0.00 178.44 179.50 3m8p h THR 403 N 0.78 0.00 -0.16 0.12 1.35 -1.82 -2.55 112.91 110.63 3m8p h THR 403 Ca 0.20 -0.39 -0.07 0.00 -0.55 0.00 0.00 66.41 65.59 3m8p h THR 403 Cb 0.05 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 67.75 3m8p h THR 403 CO -0.03 0.00 -0.23 -0.08 -0.25 0.00 0.00 175.52 174.93 3m8p h GLU 404 N 0.00 0.29 0.00 4.72 4.57 -1.77 -3.31 114.58 119.08 3m8p h GLU 404 Ca 0.00 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 3m8p h GLU 404 Cb 0.44 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 3m8p h GLU 404 CO 0.00 0.51 -1.22 0.66 -1.18 0.00 0.00 179.01 177.78 3m8p n TYR 405 N -4.17 0.00 -1.56 0.92 4.01 -1.15 -4.94 117.16 110.27 3m8p n TYR 405 Ca -0.01 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.28 3m8p n TYR 405 Cb 0.35 -0.13 -0.02 0.00 -0.31 0.00 0.00 39.34 39.23 3m8p n TYR 405 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 3m8p n TRP 406 N -1.84 0.97 -1.18 -0.72 -0.00 -0.97 -4.92 117.44 108.78 3m8p n TRP 406 Ca -0.03 0.75 0.00 0.00 -0.00 0.00 0.00 57.50 58.22 3m8p n TRP 406 Cb 0.31 -2.20 0.00 0.00 -0.00 0.00 0.00 31.31 29.42 3m8p n TRP 406 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 3m8p n GLN 407 N 0.79 0.00 -2.65 5.87 1.13 -1.26 -4.55 117.38 116.71 3m8p n GLN 407 Ca 0.11 -0.08 -0.23 0.00 -1.94 0.00 0.00 57.00 54.86 3m8p n GLN 407 Cb 0.31 -0.41 0.12 0.00 0.11 0.00 0.00 30.24 30.36 3m8p n GLN 407 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3m8p s ALA 408 N 0.00 3.83 -0.05 -1.58 0.00 -1.26 -5.03 121.76 117.67 3m8p s ALA 408 Ca 0.00 -1.91 0.04 0.00 0.00 0.00 0.00 51.96 50.09 3m8p s ALA 408 Cb 0.00 -1.89 -0.06 0.00 0.00 0.00 0.00 23.12 21.17 3m8p s ALA 408 CO 0.00 -1.53 0.10 0.25 0.00 0.00 0.00 175.76 174.58 3m8p n THR 409 N -2.85 0.00 -2.53 0.00 -2.24 -1.26 -4.96 114.28 100.43 3m8p n THR 409 Ca 0.17 -0.17 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 3m8p n THR 409 Cb 0.61 0.56 0.04 0.00 -2.10 0.00 0.00 70.33 69.44 3m8p n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3m8p s TRP 410 N -2.04 2.88 -0.04 4.78 1.48 -1.26 -4.67 118.94 120.07 3m8p s TRP 410 Ca -0.01 0.11 -0.02 0.00 -1.06 0.00 0.00 56.10 55.13 3m8p s TRP 410 Cb 0.03 -2.86 0.03 0.00 -1.16 0.00 0.00 33.47 29.51 3m8p s TRP 410 CO 0.16 -1.00 0.05 0.42 -4.06 0.00 0.00 176.95 172.52 3m8p s ILE 411 N -2.88 -0.05 0.83 0.66 1.01 -1.26 -5.03 121.20 114.48 3m8p s ILE 411 Ca 0.58 0.39 -0.12 0.00 0.00 0.00 0.00 60.65 61.50 3m8p s ILE 411 Cb -0.10 -0.19 0.09 0.00 0.01 0.00 0.00 42.46 42.27 3m8p s ILE 411 CO 0.40 0.19 1.15 -2.16 0.00 0.00 0.00 174.94 174.52 3m8p s PRO 412 N 2.14 1.76 0.38 2.79 0.04 -1.26 -4.93 135.00 135.92 3m8p s PRO 412 Ca 0.05 0.23 -0.21 0.00 0.04 0.00 0.00 61.00 61.11 3m8p s PRO 412 Cb -0.12 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 3m8p s PRO 412 CO -0.03 -1.76 0.90 -1.21 0.04 0.00 0.00 177.00 174.94 3m8p s GLU 413 N -5.43 4.26 -0.11 4.56 0.41 -1.26 -4.96 118.70 116.16 3m8p s GLU 413 Ca 0.62 1.07 -0.21 0.00 -0.41 0.00 0.00 54.97 56.04 3m8p s GLU 413 Cb -0.12 -2.37 0.05 0.00 -1.78 0.00 0.00 34.13 29.90 3m8p s GLU 413 CO 0.51 0.08 0.52 1.67 -0.49 0.00 0.00 175.26 177.55 3m8p s TRP 414 N -2.01 -0.50 0.16 1.61 -2.14 -1.26 -0.32 118.94 114.48 3m8p s TRP 414 Ca 0.58 1.05 0.04 0.00 2.66 0.00 0.00 56.10 60.42 3m8p s TRP 414 Cb -0.11 0.23 -0.05 0.00 -3.10 0.00 0.00 33.47 30.45 3m8p s TRP 414 CO 0.16 -0.41 -0.07 -1.83 -2.66 0.00 0.00 176.95 172.15 3m8p s GLU 415 N -0.56 1.11 -0.06 3.25 -1.05 0.66 -4.91 118.70 117.13 3m8p s GLU 415 Ca -0.07 -1.50 -0.01 0.00 -0.15 0.00 0.00 54.97 53.24 3m8p s GLU 415 Cb -0.03 -0.56 -0.03 0.00 -0.44 0.00 0.00 34.13 33.07 3m8p s GLU 415 CO 0.04 0.01 0.01 -0.06 0.95 0.00 0.00 175.26 176.22 3m8p s PHE 416 N -3.40 3.17 -0.02 4.83 0.08 -1.26 -0.91 117.98 120.47 3m8p s PHE 416 Ca 0.19 0.18 -0.16 0.00 0.12 0.00 0.00 56.93 57.27 3m8p s PHE 416 Cb 0.04 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 3m8p s PHE 416 CO 0.02 0.48 0.35 0.54 -0.10 0.00 0.00 175.22 176.51 3m8p s VAL 417 N -0.96 0.05 -0.25 -0.44 0.11 -0.62 -4.88 120.40 113.41 3m8p s VAL 417 Ca 0.15 -0.42 -0.14 0.00 -2.93 0.00 0.00 61.98 58.64 3m8p s VAL 417 Cb -0.11 -0.65 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 3m8p s VAL 417 CO 0.05 -0.23 0.33 0.20 -3.33 0.00 0.00 175.10 172.12 3m8p s ASN 418 N -1.29 6.26 -0.28 3.54 0.01 -1.26 -4.10 114.94 117.82 3m8p s ASN 418 Ca -0.13 0.29 -0.28 0.00 -0.71 0.00 0.00 52.86 52.03 3m8p s ASN 418 Cb -0.05 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 3m8p s ASN 418 CO 0.05 -0.11 2.03 -0.89 -1.51 0.00 0.00 177.10 176.66 3m8p s THR 419 N 1.74 3.23 -0.21 1.60 2.01 -1.26 -4.93 115.64 117.82 3m8p s THR 419 Ca 0.14 0.23 -0.34 0.00 0.31 0.00 0.00 61.69 62.03 3m8p s THR 419 Cb -0.15 -3.31 -0.11 0.00 0.01 0.00 0.00 72.50 68.94 3m8p s THR 419 CO 0.09 -0.20 2.03 -0.81 -0.69 0.00 0.00 174.62 175.04 3m8p n PRO 420 N 8.62 1.73 0.11 4.92 -0.05 -1.26 -4.86 135.00 144.21 3m8p n PRO 420 Ca 0.27 0.57 0.20 0.00 -0.05 0.00 0.00 63.50 64.48 3m8p n PRO 420 Cb 0.46 -2.66 0.72 0.00 -0.05 0.00 0.00 33.50 31.97 3m8p n PRO 420 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 175.50 174.45 3m8p h PRO 421 N 11.12 0.00 -0.06 0.54 0.13 -2.02 -1.83 132.00 139.89 3m8p h PRO 421 Ca -0.40 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.66 3m8p h PRO 421 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3m8p h PRO 421 CO 0.97 0.00 -0.23 -0.07 -0.23 0.00 0.00 178.00 178.44 3m8p h LEU 422 N 0.00 0.32 -1.04 1.56 3.38 -2.00 -3.18 115.31 114.34 3m8p h LEU 422 Ca 0.18 -0.63 0.16 0.00 0.09 0.00 0.00 57.88 57.68 3m8p h LEU 422 Cb 1.18 -0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.74 3m8p h LEU 422 CO -0.00 0.89 0.62 -0.37 0.09 0.00 0.00 178.44 179.67 3m8p h VAL 423 N -0.24 0.79 -0.74 1.22 -1.51 -1.71 1.21 116.25 115.27 3m8p h VAL 423 Ca -0.01 -0.29 0.17 0.00 -1.23 0.00 0.00 66.70 65.34 3m8p h VAL 423 Cb 0.87 -0.12 -0.12 0.00 -2.13 0.00 0.00 31.29 29.80 3m8p h VAL 423 CO 0.05 0.15 0.13 0.50 -1.23 0.00 0.00 177.57 177.17 3m8p h LYS 424 N 0.84 0.20 0.05 5.19 3.11 -1.60 -2.34 116.57 122.03 3m8p h LYS 424 Ca 0.54 -0.01 -0.26 0.00 -2.81 0.00 0.00 60.65 58.11 3m8p h LYS 424 Cb 0.75 -0.05 0.01 0.00 -1.00 0.00 0.00 32.23 31.94 3m8p h LYS 424 CO -0.32 0.13 -1.08 1.25 -2.81 0.00 0.00 179.45 176.62 3m8p h LEU 425 N 0.21 0.66 -1.12 5.20 5.85 0.14 -3.07 115.31 123.19 3m8p h LEU 425 Ca 0.42 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3m8p h LEU 425 Cb 0.73 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.56 3m8p h LEU 425 CO -0.56 1.39 0.00 -0.50 -0.34 0.00 0.00 178.44 178.43 3m8p h TRP 426 N 0.24 0.00 -3.63 1.25 6.55 -0.50 -3.30 115.95 116.56 3m8p h TRP 426 Ca -0.12 0.00 -0.75 0.00 0.95 0.00 0.00 58.89 58.97 3m8p h TRP 426 Cb 1.75 0.00 -0.31 0.00 -0.86 0.00 0.00 29.16 29.74 3m8p h TRP 426 CO 0.08 0.00 -0.04 0.71 -1.05 0.00 0.00 178.44 178.14 3m8p s TYR 427 N -3.49 3.73 0.00 0.49 2.02 -1.04 -4.79 117.35 114.27 3m8p s TYR 427 Ca 0.02 -2.48 0.00 0.00 -0.37 0.00 0.00 57.07 54.24 3m8p s TYR 427 Cb 0.09 -3.53 0.00 0.00 -0.40 0.00 0.00 41.96 38.12 3m8p s TYR 427 CO 0.43 -0.90 0.00 0.94 -1.57 0.00 0.00 175.55 174.46