#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vrt s GLU 6 N 0.00 4.17 -0.07 0.38 -6.30 -1.26 -5.03 118.70 110.59 1vrt s GLU 6 Ca 0.00 0.30 -0.23 0.00 -2.50 0.00 0.00 54.97 52.54 1vrt s GLU 6 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 34.13 30.54 1vrt s GLU 6 CO 0.00 -0.11 0.69 0.95 0.02 0.00 0.00 175.26 176.81 1vrt s THR 7 N 1.52 5.05 0.00 -1.70 -4.23 -1.26 -4.95 115.64 110.08 1vrt s THR 7 Ca 0.21 1.41 -0.26 0.00 -1.18 0.00 0.00 61.69 61.87 1vrt s THR 7 Cb -0.15 -4.03 -0.04 0.00 1.34 0.00 0.00 72.50 69.62 1vrt s THR 7 CO 0.09 0.25 0.82 0.68 -0.54 0.00 0.00 174.62 175.92 1vrt s VAL 8 N 0.84 4.85 0.32 2.29 -7.23 -1.26 -4.93 120.40 115.27 1vrt s VAL 8 Ca 0.37 1.73 -0.29 0.00 -1.81 0.00 0.00 61.98 61.99 1vrt s VAL 8 Cb -0.17 -4.17 -0.10 0.00 0.56 0.00 0.00 36.38 32.50 1vrt s VAL 8 CO 0.17 0.26 1.18 -2.16 -0.31 0.00 0.00 175.10 174.25 1vrt s PRO 9 N 0.53 4.46 0.07 4.82 0.04 -1.26 -4.25 135.00 139.41 1vrt s PRO 9 Ca 0.43 1.94 0.06 0.00 0.04 0.00 0.00 61.00 63.47 1vrt s PRO 9 Cb -0.20 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1vrt s PRO 9 CO 0.23 0.00 -0.16 0.08 0.04 0.00 0.00 177.00 177.19 1vrt s VAL 10 N -1.20 1.32 0.07 -0.36 1.01 -1.26 -5.08 120.40 114.90 1vrt s VAL 10 Ca 0.48 -1.31 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 1vrt s VAL 10 Cb -0.34 -1.22 -0.00 0.00 0.00 0.00 0.00 36.38 34.81 1vrt s VAL 10 CO 0.44 -0.11 0.18 -0.54 0.00 0.00 0.00 175.10 175.07 1vrt s LYS 11 N -1.65 0.77 0.91 2.72 1.02 -1.26 -4.66 119.74 117.60 1vrt s LYS 11 Ca 0.02 -0.87 -0.12 0.00 0.02 0.00 0.00 55.97 55.02 1vrt s LYS 11 Cb -0.10 0.31 0.14 0.00 -0.52 0.00 0.00 37.83 37.67 1vrt s LYS 11 CO 0.03 -0.23 1.13 -0.51 -0.92 0.00 0.00 175.35 174.84 1vrt s LEU 12 N -2.60 2.02 0.59 3.17 1.43 -1.26 -0.72 118.68 121.31 1vrt s LEU 12 Ca 0.02 1.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.96 1vrt s LEU 12 Cb 0.03 -3.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 1vrt s LEU 12 CO -0.09 -2.56 1.13 -0.54 0.23 0.00 0.00 176.35 174.52 1vrt s LYS 13 N -5.23 3.13 -0.32 1.70 1.02 -0.16 -4.37 119.74 115.51 1vrt s LYS 13 Ca 0.64 1.54 -0.43 0.00 0.02 0.00 0.00 55.97 57.74 1vrt s LYS 13 Cb -0.15 -1.98 -0.18 0.00 -0.52 0.00 0.00 37.83 35.00 1vrt s LYS 13 CO 0.54 -1.01 1.58 -2.30 -0.92 0.00 0.00 175.35 173.24 1vrt n PRO 14 N -1.72 0.53 -0.04 -1.68 -0.02 -1.26 -2.12 135.00 128.69 1vrt n PRO 14 Ca 0.11 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1vrt n PRO 14 Cb 0.51 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1vrt n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vrt n GLY 15 N 3.70 2.54 3.88 -1.23 0.00 -1.26 -5.03 105.19 107.78 1vrt n GLY 15 Ca 0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 1vrt n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vrt s MET 16 N -0.13 3.66 0.47 1.61 -1.94 -0.90 -5.09 119.30 116.97 1vrt s MET 16 Ca 0.00 0.61 0.05 0.00 -1.71 0.00 0.00 55.69 54.65 1vrt s MET 16 Cb 0.00 -2.19 -0.03 0.00 2.01 0.00 0.00 34.83 34.62 1vrt s MET 16 CO 0.00 -0.38 0.16 0.34 -0.01 0.00 0.00 175.02 175.13 1vrt s ASP 17 N -3.89 4.32 0.91 3.03 2.15 -1.26 -4.90 116.67 117.04 1vrt s ASP 17 Ca 0.53 -1.30 -0.12 0.00 0.43 0.00 0.00 52.55 52.09 1vrt s ASP 17 Cb -0.11 -0.02 0.14 0.00 -0.30 0.00 0.00 42.92 42.63 1vrt s ASP 17 CO 0.46 -0.73 1.10 -0.83 -0.17 0.00 0.00 175.17 175.00 1vrt s GLY 18 N -3.95 1.59 0.39 2.66 0.00 -1.26 -5.01 107.32 101.74 1vrt s GLY 18 Ca 0.30 -0.27 -0.23 0.00 0.00 0.00 0.00 44.72 44.52 1vrt s GLY 18 CO 0.17 0.26 0.95 2.56 0.00 0.00 0.00 173.10 177.03 1vrt s PRO 19 N -5.05 4.35 -0.49 2.90 0.04 -1.26 -4.96 135.00 130.53 1vrt s PRO 19 Ca 0.64 1.20 0.07 0.00 0.04 0.00 0.00 61.00 62.95 1vrt s PRO 19 Cb -0.17 -2.40 0.25 0.00 0.04 0.00 0.00 34.50 32.22 1vrt s PRO 19 CO 0.56 0.07 0.61 1.63 0.04 0.00 0.00 177.00 179.90 1vrt n LYS 20 N -0.21 1.41 -4.03 4.56 5.02 -1.25 -0.69 118.16 122.97 1vrt n LYS 20 Ca 0.05 -3.78 -0.36 0.00 -2.02 0.00 0.00 58.31 52.20 1vrt n LYS 20 Cb 0.53 -1.62 -0.08 0.00 -0.02 0.00 0.00 35.03 33.84 1vrt n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1vrt s VAL 21 N -1.67 5.00 0.33 -0.18 1.01 -0.11 -4.89 120.40 119.89 1vrt s VAL 21 Ca 0.37 0.02 -0.28 0.00 0.00 0.00 0.00 61.98 62.09 1vrt s VAL 21 Cb 0.16 -3.19 -0.10 0.00 0.00 0.00 0.00 36.38 33.26 1vrt s VAL 21 CO -0.07 0.56 1.18 -0.75 0.00 0.00 0.00 175.10 176.02 1vrt s LYS 22 N -0.52 4.39 -0.31 2.72 2.20 -1.26 -4.28 119.74 122.67 1vrt s LYS 22 Ca 0.11 1.94 -0.28 0.00 -0.36 0.00 0.00 55.97 57.38 1vrt s LYS 22 Cb -0.12 -3.01 0.01 0.00 -1.51 0.00 0.00 37.83 33.21 1vrt s LYS 22 CO 0.02 -0.06 1.00 -1.14 -0.36 0.00 0.00 175.35 174.82 1vrt s GLN 23 N -1.80 4.06 0.34 4.03 2.00 -1.26 -4.68 119.66 122.35 1vrt s GLN 23 Ca 0.49 0.98 -0.28 0.00 -2.00 0.00 0.00 55.36 54.55 1vrt s GLN 23 Cb -0.34 -3.73 -0.10 0.00 0.80 0.00 0.00 33.01 29.65 1vrt s GLN 23 CO 0.44 -0.83 1.25 -0.46 -0.50 0.00 0.00 175.29 175.20 1vrt s TRP 24 N 3.45 3.11 0.43 1.67 -0.11 -1.26 -4.93 118.94 121.29 1vrt s TRP 24 Ca 0.42 1.48 -0.24 0.00 1.22 0.00 0.00 56.10 58.98 1vrt s TRP 24 Cb -0.13 -3.58 -0.10 0.00 -1.50 0.00 0.00 33.47 28.16 1vrt s TRP 24 CO 0.14 -1.60 0.99 -2.30 -4.62 0.00 0.00 176.95 169.56 1vrt n PRO 25 N 0.68 1.30 -4.37 5.86 -0.02 -1.26 -5.00 135.00 132.18 1vrt n PRO 25 Ca 0.01 0.47 -0.28 0.00 -2.02 0.00 0.00 63.50 61.67 1vrt n PRO 25 Cb 0.43 -2.03 -0.12 0.00 -0.02 0.00 0.00 33.50 31.77 1vrt n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vrt s LEU 26 N -0.51 2.49 0.61 2.45 1.43 -1.26 -5.05 118.68 118.84 1vrt s LEU 26 Ca 0.64 -0.74 -0.13 0.00 -1.03 0.00 0.00 54.13 52.87 1vrt s LEU 26 Cb -0.55 -1.31 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1vrt s LEU 26 CO 0.56 0.15 1.04 0.42 0.23 0.00 0.00 176.35 178.75 1vrt s THR 27 N -1.34 4.23 0.32 5.49 -4.23 -1.26 -4.87 115.64 113.98 1vrt s THR 27 Ca 0.18 0.88 0.07 0.00 -1.18 0.00 0.00 61.69 61.64 1vrt s THR 27 Cb -0.09 -3.57 0.31 0.00 1.34 0.00 0.00 72.50 70.49 1vrt s THR 27 CO 0.09 -0.80 1.78 -0.08 -0.54 0.00 0.00 174.62 175.07 1vrt h GLU 28 N 0.01 0.70 -0.07 3.99 4.81 -2.00 -1.86 114.58 120.16 1vrt h GLU 28 Ca -0.45 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.75 1vrt h GLU 28 Cb 1.20 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 1vrt h GLU 28 CO 0.59 0.46 -0.02 1.49 -0.73 0.00 0.00 179.01 180.80 1vrt h GLU 29 N 0.72 -0.00 -0.27 1.92 4.81 -2.00 -1.83 114.58 117.93 1vrt h GLU 29 Ca 0.58 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.70 1vrt h GLU 29 Cb 0.96 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 1vrt h GLU 29 CO -0.37 -0.00 -0.29 0.87 -0.73 0.00 0.00 179.01 178.49 1vrt h LYS 30 N -0.00 0.54 -0.14 1.92 1.79 -1.74 -2.08 116.57 116.86 1vrt h LYS 30 Ca 0.03 -0.23 -0.01 0.00 -2.18 0.00 0.00 60.65 58.26 1vrt h LYS 30 Cb 0.05 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1vrt h LYS 30 CO -0.07 0.78 0.04 0.82 -1.08 0.00 0.00 179.45 179.94 1vrt h ILE 31 N 0.47 1.18 -0.58 1.86 2.04 -1.13 -0.80 117.51 120.55 1vrt h ILE 31 Ca 0.06 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1vrt h ILE 31 Cb 0.75 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1vrt h ILE 31 CO 0.06 0.16 0.37 0.11 0.00 0.00 0.00 178.15 178.85 1vrt h LYS 32 N 0.04 0.72 -0.18 2.37 1.57 -1.27 0.26 116.57 120.09 1vrt h LYS 32 Ca 0.04 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1vrt h LYS 32 Cb 0.22 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 1vrt h LYS 32 CO -0.00 0.48 -0.22 0.00 -0.57 0.00 0.00 179.45 179.14 1vrt h ALA 33 N 1.23 -0.14 -0.52 3.86 0.00 -1.14 0.82 119.26 123.37 1vrt h ALA 33 Ca 0.22 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 1vrt h ALA 33 Cb -0.04 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1vrt h ALA 33 CO -0.07 -0.66 0.10 -0.07 0.00 0.00 0.00 179.25 178.55 1vrt h LEU 34 N -0.25 0.76 -1.17 0.00 3.38 -0.37 -0.54 115.31 117.12 1vrt h LEU 34 Ca 0.12 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1vrt h LEU 34 Cb 0.43 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1vrt h LEU 34 CO -0.33 0.77 -0.09 0.58 0.09 0.00 0.00 178.44 179.46 1vrt h VAL 35 N 0.77 1.21 -0.02 1.22 2.07 0.34 -1.12 116.25 120.73 1vrt h VAL 35 Ca 0.17 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1vrt h VAL 35 Cb 0.33 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1vrt h VAL 35 CO 0.00 0.30 -0.01 -0.08 0.02 0.00 0.00 177.57 177.81 1vrt h GLU 36 N 0.44 0.03 -0.26 1.57 4.81 0.26 -1.80 114.58 119.63 1vrt h GLU 36 Ca 0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1vrt h GLU 36 Cb 0.43 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1vrt h GLU 36 CO 0.02 0.43 0.17 0.82 -0.73 0.00 0.00 179.01 179.72 1vrt h ILE 37 N -0.36 1.09 0.00 2.32 2.04 -1.00 -2.90 117.51 118.70 1vrt h ILE 37 Ca 0.00 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.59 1vrt h ILE 37 Cb 0.42 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1vrt h ILE 37 CO 0.00 0.08 -0.40 0.00 0.00 0.00 0.00 178.15 177.83 1vrt h THR 39 N 0.00 1.27 0.00 0.00 2.02 -1.12 -2.15 112.91 112.93 1vrt h THR 39 Ca -0.00 -1.31 -0.11 0.00 0.77 0.00 0.00 66.41 65.75 1vrt h THR 39 Cb 0.84 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1vrt h THR 39 CO 0.05 0.46 -0.54 1.05 0.37 0.00 0.00 175.52 176.91 1vrt h GLU 40 N 0.90 0.00 -0.06 6.66 4.11 -1.39 -2.73 114.58 122.06 1vrt h GLU 40 Ca 0.13 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.47 1vrt h GLU 40 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1vrt h GLU 40 CO 0.06 0.54 -0.37 0.52 0.07 0.00 0.00 179.01 179.82 1vrt h MET 41 N 0.00 0.13 -0.21 1.06 2.86 -1.22 -2.50 114.93 115.05 1vrt h MET 41 Ca -0.01 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.41 1vrt h MET 41 Cb 1.32 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.98 1vrt h MET 41 CO 0.07 0.49 -0.53 1.49 1.06 0.00 0.00 176.91 179.49 1vrt h GLU 42 N 0.11 0.73 -0.51 1.72 4.81 -1.25 0.85 114.58 121.05 1vrt h GLU 42 Ca 0.01 -0.51 0.03 0.00 -0.13 0.00 0.00 59.36 58.76 1vrt h GLU 42 Cb 0.71 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.14 1vrt h GLU 42 CO 0.05 1.13 0.34 0.87 -0.73 0.00 0.00 179.01 180.67 1vrt h LYS 43 N 0.45 0.58 -0.00 1.92 1.57 -1.30 0.17 116.57 119.97 1vrt h LYS 43 Ca -0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1vrt h LYS 43 Cb 1.15 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1vrt h LYS 43 CO 0.12 0.39 -0.13 0.39 -0.57 0.00 0.00 179.45 179.65 1vrt n GLU 44 N -4.47 0.29 -1.08 3.15 1.02 -0.96 -4.94 120.64 113.66 1vrt n GLU 44 Ca 0.06 -0.08 -0.03 0.00 -0.02 0.00 0.00 57.16 57.09 1vrt n GLU 44 Cb 0.13 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.04 1vrt n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vrt n GLY 45 N 1.39 0.59 0.08 0.62 0.00 0.61 -4.92 105.19 103.56 1vrt n GLY 45 Ca 0.10 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.38 1vrt n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vrt h LYS 46 N 0.22 0.07 -5.04 1.61 1.79 -1.08 -3.43 116.57 110.71 1vrt h LYS 46 Ca -0.05 -0.11 -0.33 0.00 -2.18 0.00 0.00 60.65 57.97 1vrt h LYS 46 Cb 0.22 0.04 -0.17 0.00 -1.58 0.00 0.00 32.23 30.74 1vrt h LYS 46 CO 0.08 1.01 -0.73 0.96 -1.08 0.00 0.00 179.45 179.69 1vrt s ILE 47 N -2.81 1.04 0.04 1.86 -4.36 -1.20 -0.06 121.20 115.71 1vrt s ILE 47 Ca -0.00 -1.76 0.03 0.00 -0.26 0.00 0.00 60.65 58.65 1vrt s ILE 47 Cb 0.10 -1.51 -0.02 0.00 1.25 0.00 0.00 42.46 42.27 1vrt s ILE 47 CO 0.83 -0.59 -0.09 -0.44 0.24 0.00 0.00 174.94 174.89 1vrt s SER 48 N -2.63 0.95 0.29 4.36 0.01 -0.30 -4.33 113.70 112.05 1vrt s SER 48 Ca 0.09 -0.55 -0.29 0.00 1.31 0.00 0.00 55.95 56.51 1vrt s SER 48 Cb -0.02 0.02 -0.10 0.00 0.21 0.00 0.00 66.02 66.14 1vrt s SER 48 CO 0.00 -0.18 1.17 -0.54 0.41 0.00 0.00 173.24 174.11 1vrt s LYS 49 N -1.57 4.54 0.44 12.44 1.02 -1.26 -1.94 119.74 133.41 1vrt s LYS 49 Ca -0.09 1.94 0.06 0.00 0.02 0.00 0.00 55.97 57.90 1vrt s LYS 49 Cb -0.10 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.02 1vrt s LYS 49 CO 0.01 0.06 0.18 0.96 -0.92 0.00 0.00 175.35 175.64 1vrt s ILE 50 N -1.05 2.06 0.51 2.17 -4.36 -0.90 -4.92 121.20 114.71 1vrt s ILE 50 Ca 0.47 -1.72 0.05 0.00 -0.26 0.00 0.00 60.65 59.19 1vrt s ILE 50 Cb -0.34 -2.78 0.05 0.00 1.25 0.00 0.00 42.46 40.64 1vrt s ILE 50 CO 0.44 0.00 0.45 0.61 0.24 0.00 0.00 174.94 176.68 1vrt n GLY 51 N -1.30 2.62 0.29 6.27 0.00 -1.26 -4.81 105.19 107.00 1vrt n GLY 51 Ca -0.04 -2.28 0.19 0.00 0.00 0.00 0.00 46.02 43.90 1vrt n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vrt h PRO 52 N 0.00 0.00 0.00 1.61 0.13 -2.02 -2.50 132.00 129.22 1vrt h PRO 52 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1vrt h PRO 52 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1vrt h PRO 52 CO 0.48 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.40 1vrt n GLU 53 N -2.87 0.03 -3.60 0.86 0.00 -1.26 -4.41 120.64 109.39 1vrt n GLU 53 Ca -0.02 0.26 -0.39 0.00 0.00 0.00 0.00 57.16 57.01 1vrt n GLU 53 Cb 0.10 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 29.93 1vrt n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1vrt s ASN 54 N -2.94 5.77 0.00 -1.84 3.84 -0.94 -4.94 114.94 113.89 1vrt s ASN 54 Ca 0.07 -0.53 0.28 0.00 0.21 0.00 0.00 52.86 52.89 1vrt s ASN 54 Cb 0.09 -2.06 1.12 0.00 -0.55 0.00 0.00 41.25 39.85 1vrt s ASN 54 CO 0.23 -0.23 1.78 -0.81 -2.79 0.00 0.00 177.10 175.29 1vrt n PRO 55 N 5.04 1.60 -2.11 0.43 -0.04 -1.26 -4.96 135.00 133.69 1vrt n PRO 55 Ca -0.13 -0.87 -0.31 0.00 -0.04 0.00 0.00 63.50 62.15 1vrt n PRO 55 Cb 0.49 -1.48 -0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1vrt n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1vrt s TYR 56 N -1.99 3.58 -0.27 0.54 2.02 -1.26 -4.83 117.35 115.14 1vrt s TYR 56 Ca 0.39 1.26 -0.23 0.00 -0.37 0.00 0.00 57.07 58.12 1vrt s TYR 56 Cb 0.21 -2.67 0.07 0.00 -0.40 0.00 0.00 41.96 39.17 1vrt s TYR 56 CO 0.33 -0.55 0.72 1.21 -1.57 0.00 0.00 175.55 175.70 1vrt s ASN 57 N -3.90 -0.79 -0.03 2.29 3.84 0.14 -4.63 114.94 111.85 1vrt s ASN 57 Ca 0.55 1.45 0.03 0.00 0.21 0.00 0.00 52.86 55.10 1vrt s ASN 57 Cb -0.11 1.44 0.00 0.00 -0.55 0.00 0.00 41.25 42.03 1vrt s ASN 57 CO 0.47 -0.24 -0.13 -0.89 -2.79 0.00 0.00 177.10 173.52 1vrt s THR 58 N 0.68 1.10 0.49 -5.21 2.01 -0.52 -0.93 115.64 113.25 1vrt s THR 58 Ca -0.02 -0.53 -0.22 0.00 0.31 0.00 0.00 61.69 61.22 1vrt s THR 58 Cb -0.05 -0.96 -0.07 0.00 0.01 0.00 0.00 72.50 71.44 1vrt s THR 58 CO -0.04 0.33 1.18 -2.84 -0.69 0.00 0.00 174.62 172.55 1vrt s PRO 59 N 0.12 3.61 0.11 4.92 0.02 -1.26 -4.29 135.00 138.23 1vrt s PRO 59 Ca -0.03 1.79 0.06 0.00 0.02 0.00 0.00 61.00 62.83 1vrt s PRO 59 Cb -0.10 -2.31 -0.04 0.00 0.02 0.00 0.00 34.50 32.08 1vrt s PRO 59 CO 0.01 -0.68 -0.14 0.14 -0.33 0.00 0.00 177.00 176.00 1vrt s VAL 60 N -1.57 1.25 0.20 3.83 -7.23 -1.26 -1.47 120.40 114.15 1vrt s VAL 60 Ca 0.66 -1.59 -0.06 0.00 -1.81 0.00 0.00 61.98 59.18 1vrt s VAL 60 Cb -0.29 -1.39 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 1vrt s VAL 60 CO 0.34 -0.36 0.26 -0.36 -0.31 0.00 0.00 175.10 174.67 1vrt s PHE 61 N -1.90 0.73 -0.12 2.82 0.08 0.16 -4.95 117.98 114.80 1vrt s PHE 61 Ca 0.06 -1.04 0.01 0.00 0.12 0.00 0.00 56.93 56.08 1vrt s PHE 61 Cb -0.06 -0.22 0.02 0.00 -0.57 0.00 0.00 43.02 42.18 1vrt s PHE 61 CO 0.03 -0.75 -0.15 0.00 -0.10 0.00 0.00 175.22 174.25 1vrt s ALA 62 N -4.07 1.75 0.31 5.36 0.00 -1.26 0.36 121.76 124.21 1vrt s ALA 62 Ca 0.28 -0.79 0.10 0.00 0.00 0.00 0.00 51.96 51.55 1vrt s ALA 62 Cb 0.04 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 1vrt s ALA 62 CO 0.08 -0.19 -0.09 0.96 0.00 0.00 0.00 175.76 176.52 1vrt s ILE 63 N 1.17 2.59 0.08 0.00 -4.36 -0.27 -4.90 121.20 115.51 1vrt s ILE 63 Ca -0.02 -2.17 -0.11 0.00 -0.26 0.00 0.00 60.65 58.08 1vrt s ILE 63 Cb -0.14 -2.60 -0.06 0.00 1.25 0.00 0.00 42.46 40.91 1vrt s ILE 63 CO -0.05 -0.29 0.42 -0.75 0.24 0.00 0.00 174.94 174.51 1vrt s LYS 64 N -3.61 3.80 0.65 0.37 2.47 -1.26 0.23 119.74 122.39 1vrt s LYS 64 Ca 0.32 0.23 -0.12 0.00 -1.56 0.00 0.00 55.97 54.85 1vrt s LYS 64 Cb -0.02 -3.01 -0.01 0.00 -1.46 0.00 0.00 37.83 33.32 1vrt s LYS 64 CO 0.17 0.57 1.05 0.15 0.16 0.00 0.00 175.35 177.45 1vrt s LYS 65 N -1.83 3.20 0.10 4.03 1.02 -0.67 -4.80 119.74 120.80 1vrt s LYS 65 Ca 0.32 0.94 -0.30 0.00 0.02 0.00 0.00 55.97 56.95 1vrt s LYS 65 Cb -0.14 -2.03 -0.06 0.00 -0.52 0.00 0.00 37.83 35.08 1vrt s LYS 65 CO 0.18 -0.89 1.04 0.21 -0.92 0.00 0.00 175.35 174.97 1vrt s LYS 66 N -4.89 4.61 -1.61 1.68 2.47 -1.26 -3.92 119.74 116.81 1vrt s LYS 66 Ca 0.58 1.57 -0.07 0.00 -1.56 0.00 0.00 55.97 56.48 1vrt s LYS 66 Cb -0.13 -3.36 0.07 0.00 -1.46 0.00 0.00 37.83 32.95 1vrt s LYS 66 CO 0.51 0.06 0.18 -3.47 0.16 0.00 0.00 175.35 172.79 1vrt n ASP 67 N 3.02 0.10 -3.80 1.43 2.03 -1.26 -4.91 116.55 113.15 1vrt n ASP 67 Ca 0.04 -1.24 -0.12 0.00 0.52 0.00 0.00 54.79 53.99 1vrt n ASP 67 Cb 0.48 -1.55 -0.11 0.00 -0.72 0.00 0.00 41.12 39.22 1vrt n ASP 67 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1vrt s SER 68 N -4.00 -0.18 -0.01 1.67 0.15 -1.25 -5.04 113.70 105.03 1vrt s SER 68 Ca 0.25 0.28 0.15 0.00 0.70 0.00 0.00 55.95 57.33 1vrt s SER 68 Cb -0.15 0.41 0.45 0.00 -1.71 0.00 0.00 66.02 65.02 1vrt s SER 68 CO 0.98 -0.20 1.36 1.07 1.20 0.00 0.00 173.24 177.65 1vrt n THR 69 N 2.36 0.74 -3.99 6.45 5.66 -1.26 -4.44 114.28 119.80 1vrt n THR 69 Ca -0.16 -0.68 -0.24 0.00 -3.05 0.00 0.00 64.05 59.91 1vrt n THR 69 Cb 0.57 0.29 -0.03 0.00 -1.55 0.00 0.00 70.33 69.61 1vrt n THR 69 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1vrt s LYS 70 N -1.39 3.30 0.25 1.09 -0.14 -1.26 -5.00 119.74 116.59 1vrt s LYS 70 Ca 0.33 -0.74 -0.02 0.00 -1.36 0.00 0.00 55.97 54.19 1vrt s LYS 70 Cb 0.18 -2.85 -0.04 0.00 -1.68 0.00 0.00 37.83 33.43 1vrt s LYS 70 CO 0.22 0.48 0.47 -1.58 -0.76 0.00 0.00 175.35 174.17 1vrt s TRP 71 N -1.85 3.48 -0.09 3.18 0.52 -1.26 -1.66 118.94 121.26 1vrt s TRP 71 Ca 0.34 0.45 0.04 0.00 0.02 0.00 0.00 56.10 56.95 1vrt s TRP 71 Cb -0.10 -1.95 0.00 0.00 -1.15 0.00 0.00 33.47 30.27 1vrt s TRP 71 CO 0.27 0.28 -0.21 0.50 0.02 0.00 0.00 176.95 177.81 1vrt s ARG 72 N -3.51 2.62 0.01 4.98 3.52 0.14 -4.85 118.95 121.86 1vrt s ARG 72 Ca 0.41 -0.75 -0.30 0.00 -0.13 0.00 0.00 55.73 54.95 1vrt s ARG 72 Cb -0.11 -2.03 -0.04 0.00 -1.56 0.00 0.00 34.95 31.21 1vrt s ARG 72 CO 0.30 0.16 1.05 0.21 -0.81 0.00 0.00 175.30 176.21 1vrt s LYS 73 N 0.37 4.51 -0.12 5.12 2.20 -1.26 -1.11 119.74 129.44 1vrt s LYS 73 Ca -0.16 1.52 0.02 0.00 -0.36 0.00 0.00 55.97 56.99 1vrt s LYS 73 Cb -0.17 -3.43 -0.00 0.00 -1.51 0.00 0.00 37.83 32.71 1vrt s LYS 73 CO 0.07 -0.13 -0.19 -1.17 -0.36 0.00 0.00 175.35 173.57 1vrt s LEU 74 N 1.10 2.34 -0.19 5.43 2.96 0.16 -4.95 118.68 125.53 1vrt s LEU 74 Ca 0.54 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1vrt s LEU 74 Cb -0.23 -1.50 -0.00 0.00 0.50 0.00 0.00 46.19 44.95 1vrt s LEU 74 CO 0.28 0.14 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.65 1vrt s VAL 75 N 0.50 2.98 -1.30 1.68 1.01 -1.26 0.37 120.40 124.38 1vrt s VAL 75 Ca -0.12 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.04 1vrt s VAL 75 Cb -0.17 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 33.94 1vrt s VAL 75 CO 0.05 0.47 1.82 -0.67 0.00 0.00 0.00 175.10 176.77 1vrt n ASP 76 N 4.52 4.56 -0.57 3.32 2.03 -0.54 -4.76 116.55 125.10 1vrt n ASP 76 Ca -0.19 -2.88 0.01 0.00 0.52 0.00 0.00 54.79 52.25 1vrt n ASP 76 Cb 0.51 -1.73 0.06 0.00 -0.72 0.00 0.00 41.12 39.25 1vrt n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1vrt n PHE 77 N 8.78 0.29 -0.30 -0.67 3.72 -1.26 -4.39 117.46 123.63 1vrt n PHE 77 Ca 0.49 -0.11 0.06 0.00 -0.05 0.00 0.00 57.45 57.84 1vrt n PHE 77 Cb 0.45 -0.12 0.21 0.00 -0.94 0.00 0.00 39.48 39.08 1vrt n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vrt h ARG 78 N 0.68 0.68 -0.23 -1.08 3.08 -1.87 0.29 114.38 115.92 1vrt h ARG 78 Ca 0.00 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.86 1vrt h ARG 78 Cb 0.56 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1vrt h ARG 78 CO 0.06 0.45 -0.43 1.49 -1.07 0.00 0.00 179.97 180.46 1vrt h GLU 79 N 0.70 0.69 -0.60 0.04 4.57 -2.01 -2.87 114.58 115.10 1vrt h GLU 79 Ca 0.44 -0.44 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 1vrt h GLU 79 Cb 0.55 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1vrt h GLU 79 CO -0.32 1.06 0.05 1.25 -1.18 0.00 0.00 179.01 179.87 1vrt h LEU 80 N 0.40 1.00 -0.60 1.64 5.85 -1.72 -2.82 115.31 119.05 1vrt h LEU 80 Ca 0.01 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.47 1vrt h LEU 80 Cb 1.03 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 1vrt h LEU 80 CO 0.10 1.04 0.37 0.78 -0.34 0.00 0.00 178.44 180.39 1vrt h ASN 81 N 0.93 0.61 -0.30 1.25 2.35 -0.46 -0.04 115.58 119.92 1vrt h ASN 81 Ca 0.18 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.96 1vrt h ASN 81 Cb 0.50 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.72 1vrt h ASN 81 CO 0.02 0.43 0.20 0.11 -1.65 0.00 0.00 177.43 176.54 1vrt h LYS 82 N 0.74 0.25 -0.01 0.81 1.57 -1.34 -2.57 116.57 116.02 1vrt h LYS 82 Ca 0.24 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1vrt h LYS 82 Cb 0.01 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1vrt h LYS 82 CO -0.10 0.17 -0.34 0.54 -0.57 0.00 0.00 179.45 179.15 1vrt n ARG 83 N -4.49 0.95 -2.78 3.15 1.74 -0.25 -4.94 116.66 110.04 1vrt n ARG 83 Ca 0.03 -0.66 -0.38 0.00 -0.77 0.00 0.00 57.85 56.08 1vrt n ARG 83 Cb 0.19 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.08 1vrt n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1vrt s THR 84 N -2.50 4.19 0.49 0.55 2.01 -0.19 -0.99 115.64 119.20 1vrt s THR 84 Ca 0.22 1.87 -0.21 0.00 0.31 0.00 0.00 61.69 63.88 1vrt s THR 84 Cb 0.19 -4.08 -0.09 0.00 0.01 0.00 0.00 72.50 68.53 1vrt s THR 84 CO 0.54 0.22 0.88 0.00 -0.69 0.00 0.00 174.62 175.57 1vrt n GLN 85 N 0.77 1.02 -2.17 4.92 10.64 0.10 -4.55 117.38 128.12 1vrt n GLN 85 Ca 0.01 0.38 -0.34 0.00 -1.83 0.00 0.00 57.00 55.22 1vrt n GLN 85 Cb 0.49 -1.98 0.01 0.00 -0.86 0.00 0.00 30.24 27.91 1vrt n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1vrt s ASP 86 N -0.97 5.68 -0.53 2.61 1.01 -1.26 -4.96 116.67 118.25 1vrt s ASP 86 Ca 0.68 2.07 -0.17 0.00 0.71 0.00 0.00 52.55 55.83 1vrt s ASP 86 Cb -0.50 -2.57 0.10 0.00 1.01 0.00 0.00 42.92 40.96 1vrt s ASP 86 CO 0.54 -1.24 0.54 -0.36 0.21 0.00 0.00 175.17 174.86 1vrt s PHE 87 N -2.00 3.16 0.00 4.23 0.08 -1.26 -5.12 117.98 117.07 1vrt s PHE 87 Ca 0.70 -1.02 0.00 0.00 0.12 0.00 0.00 56.93 56.73 1vrt s PHE 87 Cb -0.21 -3.66 0.00 0.00 -0.57 0.00 0.00 43.02 38.57 1vrt s PHE 87 CO 0.30 -1.04 0.00 0.91 -0.10 0.00 0.00 175.22 175.29 1vrt n TRP 88 N 5.64 0.00 -3.15 0.36 7.02 -1.26 -5.16 117.44 120.89 1vrt n TRP 88 Ca -0.11 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.42 1vrt n TRP 88 Cb 0.42 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.30 1vrt n TRP 88 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1vrt s LEU 92 N 0.00 -0.55 -0.37 -0.99 1.43 -1.26 -5.28 118.68 111.66 1vrt s LEU 92 Ca 0.00 0.26 0.13 0.00 -1.03 0.00 0.00 54.13 53.49 1vrt s LEU 92 Cb 0.00 1.43 0.40 0.00 0.03 0.00 0.00 46.19 48.05 1vrt s LEU 92 CO 0.00 -0.10 1.03 0.61 0.23 0.00 0.00 176.35 178.12 1vrt n GLY 93 N 5.38 1.77 0.00 -3.19 0.00 -1.26 -4.89 105.19 103.00 1vrt n GLY 93 Ca -0.02 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1vrt n GLY 93 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1vrt n ILE 94 N -0.08 0.00 -1.48 -0.61 0.13 -1.26 -5.11 119.36 110.94 1vrt n ILE 94 Ca 0.09 -0.02 -0.51 0.00 -1.10 0.00 0.00 62.75 61.20 1vrt n ILE 94 Cb 0.78 0.37 -0.05 0.00 -0.84 0.00 0.00 39.64 39.90 1vrt n ILE 94 CO 0.00 0.00 0.00 -2.65 2.80 0.00 0.00 176.55 176.70 1vrt n PRO 95 N -0.21 0.36 -1.63 9.51 -0.02 -1.26 -4.75 135.00 136.99 1vrt n PRO 95 Ca 0.00 0.13 -0.55 0.00 -2.02 0.00 0.00 63.50 61.06 1vrt n PRO 95 Cb 0.00 -1.42 -0.07 0.00 -0.02 0.00 0.00 33.50 32.00 1vrt n PRO 95 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1vrt n HIS 96 N 0.81 1.68 -2.77 6.00 -0.00 -1.26 -4.94 115.22 114.74 1vrt n HIS 96 Ca 0.17 0.62 -0.43 0.00 0.46 0.00 0.00 57.72 58.55 1vrt n HIS 96 Cb 0.20 -2.37 -0.03 0.00 -0.12 0.00 0.00 29.99 27.67 1vrt n HIS 96 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1vrt s PRO 97 N 1.61 4.02 0.00 1.57 0.04 -1.26 -4.90 135.00 136.08 1vrt s PRO 97 Ca 0.90 0.87 0.19 0.00 0.04 0.00 0.00 61.00 63.01 1vrt s PRO 97 Cb -1.02 -3.73 0.94 0.00 0.04 0.00 0.00 34.50 30.73 1vrt s PRO 97 CO 0.54 -0.80 1.60 0.00 0.04 0.00 0.00 177.00 178.38 1vrt n ALA 98 N 6.58 1.99 0.27 8.56 0.00 -1.26 -2.80 120.51 133.85 1vrt n ALA 98 Ca 0.09 -0.09 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1vrt n ALA 98 Cb 0.47 -1.31 0.34 0.00 0.00 0.00 0.00 19.45 18.95 1vrt n ALA 98 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1vrt h GLY 99 N 3.21 0.00 1.77 0.00 0.00 -1.96 -3.32 103.07 102.78 1vrt h GLY 99 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1vrt h GLY 99 CO 0.00 0.00 -0.03 -2.00 0.00 0.00 0.00 176.54 174.51 1vrt h LEU 100 N 0.00 0.27 -1.16 3.11 5.85 -1.83 -2.72 115.31 118.83 1vrt h LEU 100 Ca 0.00 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1vrt h LEU 100 Cb 0.83 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1vrt h LEU 100 CO 0.00 0.35 -0.16 0.07 -0.34 0.00 0.00 178.44 178.36 1vrt h LYS 101 N 0.28 0.00 -0.00 1.25 -0.00 -1.73 -2.99 116.57 113.39 1vrt h LYS 101 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.71 1vrt h LYS 101 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.48 1vrt h LYS 101 CO 0.01 0.16 -0.57 1.63 -0.00 0.00 0.00 179.45 180.68 1vrt n LYS 102 N -3.30 0.34 -1.58 0.07 5.02 -1.03 -3.67 118.16 114.01 1vrt n LYS 102 Ca 0.00 -0.24 -0.34 0.00 -2.02 0.00 0.00 58.31 55.71 1vrt n LYS 102 Cb 0.40 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.99 1vrt n LYS 102 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1vrt s LYS 103 N -2.82 2.38 -0.07 1.97 2.47 -1.13 -4.58 119.74 117.95 1vrt s LYS 103 Ca 0.14 1.73 -0.23 0.00 -1.56 0.00 0.00 55.97 56.05 1vrt s LYS 103 Cb 0.18 -1.87 -0.30 0.00 -1.46 0.00 0.00 37.83 34.38 1vrt s LYS 103 CO 0.69 -1.65 0.82 0.87 0.16 0.00 0.00 175.35 176.24 1vrt h LYS 104 N -0.03 0.23 -6.11 4.03 1.57 -1.64 -2.80 116.57 111.82 1vrt h LYS 104 Ca -0.48 -0.40 -0.60 0.00 -1.87 0.00 0.00 60.65 57.31 1vrt h LYS 104 Cb 1.29 0.15 -0.27 0.00 0.08 0.00 0.00 32.23 33.48 1vrt h LYS 104 CO 0.51 1.19 -0.85 -1.12 -0.57 0.00 0.00 179.45 178.61 1vrt s SER 105 N -6.84 2.51 -0.05 0.86 0.01 0.29 -4.19 113.70 106.30 1vrt s SER 105 Ca -0.16 -0.47 -0.02 0.00 1.31 0.00 0.00 55.95 56.61 1vrt s SER 105 Cb 0.01 -0.23 0.03 0.00 0.21 0.00 0.00 66.02 66.04 1vrt s SER 105 CO 0.79 0.20 0.10 -0.69 0.41 0.00 0.00 173.24 174.05 1vrt s VAL 106 N -0.69 -0.05 -0.07 3.43 1.01 -0.78 -0.87 120.40 122.37 1vrt s VAL 106 Ca 0.08 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.28 1vrt s VAL 106 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 1vrt s VAL 106 CO 0.01 0.08 -0.13 -0.89 0.00 0.00 0.00 175.10 174.17 1vrt s THR 107 N 1.12 3.16 -0.22 3.92 2.01 -0.23 -0.37 115.64 125.04 1vrt s THR 107 Ca -0.09 -0.67 -0.06 0.00 0.31 0.00 0.00 61.69 61.18 1vrt s THR 107 Cb -0.12 -2.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.10 1vrt s THR 107 CO -0.05 0.57 0.02 -0.69 -0.69 0.00 0.00 174.62 173.79 1vrt s VAL 108 N -0.47 3.98 0.05 3.82 1.01 -0.38 -0.26 120.40 128.16 1vrt s VAL 108 Ca 0.06 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 61.82 1vrt s VAL 108 Cb -0.12 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1vrt s VAL 108 CO 0.02 0.40 -0.19 -0.76 0.00 0.00 0.00 175.10 174.57 1vrt s LEU 109 N 1.31 2.60 -0.55 3.92 1.02 0.44 -2.35 118.68 125.06 1vrt s LEU 109 Ca 0.04 -0.46 -0.17 0.00 0.02 0.00 0.00 54.13 53.56 1vrt s LEU 109 Cb -0.15 -1.51 0.11 0.00 0.02 0.00 0.00 46.19 44.67 1vrt s LEU 109 CO 0.01 0.24 0.58 -0.62 0.02 0.00 0.00 176.35 176.59 1vrt s ASP 110 N -1.54 6.19 -0.20 2.29 2.15 -1.26 -0.23 116.67 124.05 1vrt s ASP 110 Ca 0.15 -1.56 0.07 0.00 0.43 0.00 0.00 52.55 51.65 1vrt s ASP 110 Cb -0.10 -2.25 0.52 0.00 -0.30 0.00 0.00 42.92 40.79 1vrt s ASP 110 CO 0.06 -0.95 1.43 1.33 -0.17 0.00 0.00 175.17 176.86 1vrt n VAL 111 N 5.39 2.06 -0.34 1.11 0.24 -0.03 -4.67 118.33 122.09 1vrt n VAL 111 Ca -0.12 -1.05 0.05 0.00 -2.04 0.00 0.00 64.34 61.18 1vrt n VAL 111 Cb 0.42 -0.44 0.20 0.00 -1.47 0.00 0.00 33.84 32.55 1vrt n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1vrt h GLY 112 N 3.62 1.51 2.00 7.63 0.00 -1.90 -2.68 103.07 113.25 1vrt h GLY 112 Ca 0.13 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1vrt h GLY 112 CO 0.46 0.18 0.00 -0.55 0.00 0.00 0.00 176.54 176.63 1vrt h ASP 113 N 0.96 0.00 -0.90 0.19 3.32 -1.94 -2.77 116.42 115.28 1vrt h ASP 113 Ca 0.45 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.61 1vrt h ASP 113 Cb 0.39 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.87 1vrt h ASP 113 CO -0.24 0.00 0.54 0.00 -1.72 0.00 0.00 179.24 177.82 1vrt h ALA 114 N 2.04 1.31 -0.12 3.45 0.00 -1.84 -2.13 119.26 121.98 1vrt h ALA 114 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1vrt h ALA 114 Cb 0.37 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1vrt h ALA 114 CO 0.00 0.17 0.20 1.88 0.00 0.00 0.00 179.25 181.51 1vrt h TYR 115 N 0.89 0.00 0.00 0.00 0.05 -1.68 -2.82 116.97 113.42 1vrt h TYR 115 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.22 1vrt h TYR 115 Cb 0.39 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.13 1vrt h TYR 115 CO -0.04 0.00 0.00 0.74 -1.05 0.00 0.00 178.16 177.81 1vrt h PHE 116 N 0.00 0.00 0.00 4.88 0.04 -1.55 -3.13 116.94 117.19 1vrt h PHE 116 Ca 0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.83 1vrt h PHE 116 Cb 0.47 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.62 1vrt h PHE 116 CO 0.00 0.00 -0.27 -1.13 -0.60 0.00 0.00 178.31 176.31 1vrt n SER 117 N -2.31 0.45 -4.57 2.17 3.41 -1.06 -4.74 113.62 106.97 1vrt n SER 117 Ca 0.04 0.23 -0.36 0.00 -0.26 0.00 0.00 58.87 58.52 1vrt n SER 117 Cb 0.33 -0.21 -0.11 0.00 -0.26 0.00 0.00 64.21 63.97 1vrt n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1vrt s VAL 118 N -3.06 4.73 0.93 -3.33 1.01 -1.19 -5.03 120.40 114.46 1vrt s VAL 118 Ca 0.11 -0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.93 1vrt s VAL 118 Cb 0.16 -3.18 0.15 0.00 0.00 0.00 0.00 36.38 33.51 1vrt s VAL 118 CO 0.63 0.39 1.09 -2.16 0.00 0.00 0.00 175.10 175.05 1vrt s PRO 119 N 1.00 1.02 -0.09 2.72 0.04 -1.26 -2.57 135.00 135.87 1vrt s PRO 119 Ca 0.05 0.71 0.02 0.00 0.04 0.00 0.00 61.00 61.82 1vrt s PRO 119 Cb -0.14 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 1vrt s PRO 119 CO 0.03 -2.37 -0.15 -1.17 0.04 0.00 0.00 177.00 173.38 1vrt s LEU 120 N -6.28 2.65 -0.45 -3.56 2.96 -0.55 -4.54 118.68 108.91 1vrt s LEU 120 Ca 0.64 -0.29 -0.45 0.00 -0.22 0.00 0.00 54.13 53.81 1vrt s LEU 120 Cb -0.18 -1.56 -0.19 0.00 0.50 0.00 0.00 46.19 44.76 1vrt s LEU 120 CO 0.57 0.26 1.50 -0.67 -1.32 0.00 0.00 176.35 176.69 1vrt n ASP 121 N 2.91 1.10 -0.21 3.68 2.03 -1.26 -4.76 116.55 120.03 1vrt n ASP 121 Ca -0.18 1.14 0.27 0.00 0.52 0.00 0.00 54.79 56.54 1vrt n ASP 121 Cb 0.52 -0.84 0.67 0.00 -0.72 0.00 0.00 41.12 40.75 1vrt n ASP 121 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1vrt h GLU 122 N 4.68 0.10 0.00 -0.67 3.07 -1.95 -1.09 114.58 118.72 1vrt h GLU 122 Ca -0.42 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.41 1vrt h GLU 122 Cb 1.31 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 29.20 1vrt h GLU 122 CO 0.92 0.07 -0.30 -0.44 -1.40 0.00 0.00 179.01 177.86 1vrt h ASP 123 N 0.10 0.00 0.47 1.42 5.19 -1.94 -3.30 116.42 118.36 1vrt h ASP 123 Ca 0.46 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.57 1vrt h ASP 123 Cb 1.65 0.00 0.01 0.00 0.18 0.00 0.00 39.33 41.17 1vrt h ASP 123 CO -0.06 0.10 -1.42 0.15 -3.12 0.00 0.00 179.24 174.89 1vrt h PHE 124 N 0.00 0.59 -0.63 4.55 3.57 -1.47 -3.40 116.94 120.14 1vrt h PHE 124 Ca -0.01 -0.43 0.18 0.00 3.53 0.00 0.00 57.97 61.25 1vrt h PHE 124 Cb 1.08 -0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.68 1vrt h PHE 124 CO 0.00 1.40 0.05 0.54 -2.23 0.00 0.00 178.31 178.07 1vrt n ARG 125 N -3.54 -0.05 0.21 1.11 1.74 -1.03 -0.37 116.66 114.73 1vrt n ARG 125 Ca -0.14 0.94 0.14 0.00 -0.77 0.00 0.00 57.85 58.02 1vrt n ARG 125 Cb 1.05 -1.52 0.76 0.00 -1.02 0.00 0.00 32.46 31.74 1vrt n ARG 125 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1vrt h LYS 126 N 0.00 0.00 0.00 5.56 2.10 -1.81 -0.95 116.57 121.47 1vrt h LYS 126 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 1vrt h LYS 126 Cb 0.86 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 1vrt h LYS 126 CO -0.58 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.53 1vrt n TYR 127 N -4.15 0.53 0.26 0.07 4.01 0.51 -2.59 117.16 115.80 1vrt n TYR 127 Ca 0.00 0.21 0.07 0.00 -0.16 0.00 0.00 57.90 58.02 1vrt n TYR 127 Cb 0.24 -0.84 0.23 0.00 -0.31 0.00 0.00 39.34 38.66 1vrt n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1vrt n THR 128 N -1.99 0.94 -1.65 -0.72 -2.24 -0.36 -4.71 114.28 103.56 1vrt n THR 128 Ca 0.03 -0.73 -0.40 0.00 -2.27 0.00 0.00 64.05 60.68 1vrt n THR 128 Cb 0.21 0.17 0.02 0.00 -2.10 0.00 0.00 70.33 68.63 1vrt n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vrt n ALA 129 N 0.82 0.61 -3.01 6.98 0.00 -1.07 -4.45 120.51 120.39 1vrt n ALA 129 Ca 0.17 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.70 1vrt n ALA 129 Cb 0.53 -2.16 -0.06 0.00 0.00 0.00 0.00 19.45 17.76 1vrt n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1vrt s PHE 130 N -1.31 0.44 -0.02 0.00 -0.71 -0.01 -1.43 117.98 114.95 1vrt s PHE 130 Ca 0.66 -0.79 0.01 0.00 -1.04 0.00 0.00 56.93 55.77 1vrt s PHE 130 Cb -0.50 0.08 0.01 0.00 -1.21 0.00 0.00 43.02 41.39 1vrt s PHE 130 CO 0.55 -0.91 -0.04 0.99 -1.34 0.00 0.00 175.22 174.46 1vrt s THR 131 N -4.02 0.40 -0.37 -4.49 2.01 -1.26 -1.60 115.64 106.31 1vrt s THR 131 Ca 0.23 -0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.90 1vrt s THR 131 Cb 0.01 -0.38 0.00 0.00 0.01 0.00 0.00 72.50 72.14 1vrt s THR 131 CO 0.08 0.14 0.52 -0.63 -0.69 0.00 0.00 174.62 174.04 1vrt s ILE 132 N 0.27 5.00 0.84 1.82 1.09 0.70 -4.76 121.20 126.16 1vrt s ILE 132 Ca -0.03 0.26 -0.12 0.00 -1.10 0.00 0.00 60.65 59.66 1vrt s ILE 132 Cb -0.07 -4.00 0.09 0.00 -1.06 0.00 0.00 42.46 37.43 1vrt s ILE 132 CO -0.00 -0.27 1.10 -2.16 -0.10 0.00 0.00 174.94 173.50 1vrt s PRO 133 N 2.42 1.76 0.33 2.79 0.04 -1.26 -1.14 135.00 139.94 1vrt s PRO 133 Ca 0.18 0.63 0.09 0.00 0.04 0.00 0.00 61.00 61.95 1vrt s PRO 133 Cb -0.15 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1vrt s PRO 133 CO 0.14 -1.84 0.01 -1.54 0.04 0.00 0.00 177.00 173.81 1vrt s SER 134 N -3.81 4.23 0.10 6.66 1.04 -1.26 -4.83 113.70 115.82 1vrt s SER 134 Ca 0.62 -0.94 -0.30 0.00 0.48 0.00 0.00 55.95 55.81 1vrt s SER 134 Cb -0.15 -0.57 -0.06 0.00 0.10 0.00 0.00 66.02 65.34 1vrt s SER 134 CO 0.55 -0.21 0.99 -0.63 0.98 0.00 0.00 173.24 174.92 1vrt s ILE 135 N -2.49 4.47 -2.12 -1.02 1.01 -1.26 -3.28 121.20 116.51 1vrt s ILE 135 Ca 0.34 1.99 0.00 0.00 0.00 0.00 0.00 60.65 62.98 1vrt s ILE 135 Cb -0.01 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 38.19 1vrt s ILE 135 CO 0.19 0.28 0.00 -3.20 0.00 0.00 0.00 174.94 172.21 1vrt n ASN 136 N 2.97 -5.61 -2.04 3.58 5.15 -1.26 -2.30 115.26 115.75 1vrt n ASN 136 Ca 0.03 0.39 -0.15 0.00 -0.60 0.00 0.00 54.58 54.26 1vrt n ASN 136 Cb 0.49 -4.88 -0.03 0.00 -0.53 0.00 0.00 39.78 34.83 1vrt n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1vrt n ASN 137 N -1.53 -4.25 0.27 1.20 3.02 -1.20 -4.85 115.26 107.92 1vrt n ASN 137 Ca -0.22 0.22 0.15 0.00 -0.03 0.00 0.00 54.58 54.71 1vrt n ASN 137 Cb 0.69 -3.70 0.76 0.00 -0.61 0.00 0.00 39.78 36.92 1vrt n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1vrt h GLU 138 N 0.00 0.00 -4.59 3.52 5.08 -1.72 -3.43 114.58 113.43 1vrt h GLU 138 Ca -0.33 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.81 1vrt h GLU 138 Cb 1.14 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.23 1vrt h GLU 138 CO 0.42 0.08 -0.70 0.95 -1.00 0.00 0.00 179.01 178.76 1vrt s THR 139 N -3.96 0.61 0.51 1.13 -4.23 -1.26 -5.08 115.64 103.37 1vrt s THR 139 Ca -0.02 -1.75 0.18 0.00 -1.18 0.00 0.00 61.69 58.93 1vrt s THR 139 Cb 0.11 -1.44 0.31 0.00 1.34 0.00 0.00 72.50 72.82 1vrt s THR 139 CO 0.55 -0.79 2.09 -0.65 -0.54 0.00 0.00 174.62 175.29 1vrt h PRO 140 N 3.30 0.04 0.00 3.99 0.11 -1.97 -3.41 132.00 134.06 1vrt h PRO 140 Ca -0.35 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1vrt h PRO 140 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1vrt h PRO 140 CO 0.60 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.83 1vrt n GLY 141 N -1.57 2.45 3.73 -0.55 0.00 -1.26 -4.85 105.19 103.14 1vrt n GLY 141 Ca 0.02 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.26 1vrt n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vrt s ILE 142 N -0.02 4.79 -0.08 -0.61 1.09 -0.29 -4.81 121.20 121.26 1vrt s ILE 142 Ca 0.00 1.75 0.02 0.00 -1.10 0.00 0.00 60.65 61.32 1vrt s ILE 142 Cb 0.00 -4.17 -0.02 0.00 -1.06 0.00 0.00 42.46 37.20 1vrt s ILE 142 CO 0.00 0.29 -0.13 -0.13 -0.10 0.00 0.00 174.94 174.88 1vrt s ARG 143 N 0.34 2.81 0.26 2.79 1.81 -1.26 -0.22 118.95 125.48 1vrt s ARG 143 Ca 0.42 -0.67 0.01 0.00 -1.72 0.00 0.00 55.73 53.77 1vrt s ARG 143 Cb -0.20 -2.49 -0.03 0.00 -0.45 0.00 0.00 34.95 31.78 1vrt s ARG 143 CO 0.24 0.50 0.24 0.71 -0.68 0.00 0.00 175.30 176.31 1vrt s TYR 144 N -0.40 1.28 0.05 -0.53 2.02 -0.63 -2.12 117.35 117.02 1vrt s TYR 144 Ca 0.05 -1.41 -0.13 0.00 -0.37 0.00 0.00 57.07 55.20 1vrt s TYR 144 Cb -0.12 -0.50 0.02 0.00 -0.40 0.00 0.00 41.96 40.95 1vrt s TYR 144 CO 0.02 -0.79 0.29 1.14 -1.57 0.00 0.00 175.55 174.64 1vrt s GLN 145 N -3.81 0.80 0.28 -0.62 -2.07 -0.82 -0.83 119.66 112.60 1vrt s GLN 145 Ca 0.37 -0.54 -0.19 0.00 -1.82 0.00 0.00 55.36 53.18 1vrt s GLN 145 Cb 0.04 0.34 -0.09 0.00 -1.09 0.00 0.00 33.01 32.22 1vrt s GLN 145 CO 0.18 -0.26 0.77 0.71 -1.32 0.00 0.00 175.29 175.38 1vrt s TYR 146 N -2.62 3.56 -0.45 9.60 1.51 -1.26 -1.15 117.35 126.53 1vrt s TYR 146 Ca -0.04 1.42 0.13 0.00 -1.01 0.00 0.00 57.07 57.56 1vrt s TYR 146 Cb -0.01 -2.66 -0.15 0.00 -0.11 0.00 0.00 41.96 39.04 1vrt s TYR 146 CO -0.04 0.22 0.47 0.09 -1.11 0.00 0.00 175.55 175.19 1vrt n ASN 147 N 0.32 0.94 -4.39 2.29 5.03 0.92 -4.71 115.26 115.67 1vrt n ASN 147 Ca 0.00 -0.60 -0.24 0.00 0.87 0.00 0.00 54.58 54.61 1vrt n ASN 147 Cb 0.52 1.14 -0.10 0.00 -1.02 0.00 0.00 39.78 40.32 1vrt n ASN 147 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 1vrt s VAL 148 N -2.35 1.06 0.01 2.41 -7.23 -1.21 -1.48 120.40 111.61 1vrt s VAL 148 Ca 0.02 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 1vrt s VAL 148 Cb 0.09 -2.63 -0.07 0.00 0.56 0.00 0.00 36.38 34.33 1vrt s VAL 148 CO 0.52 0.00 1.63 -0.76 -0.31 0.00 0.00 175.10 176.18 1vrt s LEU 149 N -3.56 4.34 0.50 1.32 1.43 -1.06 -4.64 118.68 117.02 1vrt s LEU 149 Ca 0.31 2.35 -0.07 0.00 -1.03 0.00 0.00 54.13 55.68 1vrt s LEU 149 Cb 0.07 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 1vrt s LEU 149 CO 0.14 -0.88 0.83 -2.16 0.23 0.00 0.00 176.35 174.52 1vrt s PRO 150 N 3.16 3.58 0.12 1.29 0.04 -1.26 -4.19 135.00 137.74 1vrt s PRO 150 Ca 0.73 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.80 1vrt s PRO 150 Cb -0.36 -2.32 -0.06 0.00 0.04 0.00 0.00 34.50 31.80 1vrt s PRO 150 CO 0.31 -0.26 1.06 -0.65 0.04 0.00 0.00 177.00 177.49 1vrt s GLN 151 N -4.74 4.60 0.00 4.56 -0.21 -1.26 -3.72 119.66 118.89 1vrt s GLN 151 Ca 0.49 1.61 0.00 0.00 0.02 0.00 0.00 55.36 57.49 1vrt s GLN 151 Cb -0.10 -3.34 0.00 0.00 1.00 0.00 0.00 33.01 30.57 1vrt s GLN 151 CO 0.45 0.06 0.00 0.41 -2.12 0.00 0.00 175.29 174.09 1vrt n GLY 152 N 2.35 0.55 3.84 3.09 0.00 -1.26 -4.72 105.19 109.04 1vrt n GLY 152 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1vrt n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vrt s TRP 153 N -2.24 3.65 0.05 1.61 -0.00 -1.24 -4.54 118.94 116.22 1vrt s TRP 153 Ca 0.00 0.76 0.33 0.00 -0.00 0.00 0.00 56.10 57.19 1vrt s TRP 153 Cb 0.00 -2.15 1.36 0.00 -0.00 0.00 0.00 33.47 32.68 1vrt s TRP 153 CO 0.00 0.64 1.97 1.57 -0.00 0.00 0.00 176.95 181.13 1vrt h LYS 154 N 5.02 0.00 -0.01 5.86 2.10 -1.91 -2.91 116.57 124.72 1vrt h LYS 154 Ca -0.52 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 57.98 1vrt h LYS 154 Cb 1.22 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.53 1vrt h LYS 154 CO 0.61 0.00 -0.69 0.78 -2.00 0.00 0.00 179.45 178.16 1vrt h GLY 155 N 1.98 0.05 0.56 0.07 0.00 -1.94 -3.34 103.07 100.45 1vrt h GLY 155 Ca 0.00 -0.07 0.06 0.00 0.00 0.00 0.00 47.33 47.32 1vrt h GLY 155 CO 0.00 0.06 0.14 1.76 0.00 0.00 0.00 176.54 178.50 1vrt h SER 156 N 0.03 0.12 -0.33 0.19 0.02 -1.79 -0.23 113.55 111.56 1vrt h SER 156 Ca -0.01 0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.88 1vrt h SER 156 Cb 1.22 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 1vrt h SER 156 CO 0.09 0.10 -0.22 -0.65 -1.14 0.00 0.00 176.83 175.01 1vrt h PRO 157 N 0.30 0.82 0.14 3.45 0.11 -1.76 -1.29 132.00 133.77 1vrt h PRO 157 Ca 0.21 -0.34 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 1vrt h PRO 157 Cb 0.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1vrt h PRO 157 CO -0.23 0.97 -0.07 0.00 -0.21 0.00 0.00 178.00 178.46 1vrt h ALA 158 N 1.03 -0.18 0.00 -0.75 0.00 -1.59 0.19 119.26 117.96 1vrt h ALA 158 Ca 0.10 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1vrt h ALA 158 Cb 0.75 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1vrt h ALA 158 CO 0.06 -0.56 -0.24 0.82 0.00 0.00 0.00 179.25 179.33 1vrt h ILE 159 N -0.28 0.96 -0.02 0.00 2.04 -1.06 -2.29 117.51 116.85 1vrt h ILE 159 Ca -0.02 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1vrt h ILE 159 Cb 0.22 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1vrt h ILE 159 CO 0.03 0.24 -0.00 0.33 0.00 0.00 0.00 178.15 178.75 1vrt n PHE 160 N -3.94 0.00 -0.01 1.37 7.35 -0.49 -4.52 117.46 117.22 1vrt n PHE 160 Ca -0.02 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.56 1vrt n PHE 160 Cb 0.32 -0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.10 1vrt n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1vrt h GLN 161 N 3.31 -0.44 0.27 -4.13 5.75 -0.01 -2.36 115.11 117.49 1vrt h GLN 161 Ca 0.00 0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1vrt h GLN 161 Cb 0.70 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.34 1vrt h GLN 161 CO 0.00 -0.29 -0.23 0.77 -2.65 0.00 0.00 178.83 176.43 1vrt h SER 162 N -0.46 -0.59 0.00 -0.69 0.02 -1.79 -1.16 113.55 108.88 1vrt h SER 162 Ca 0.09 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1vrt h SER 162 Cb 0.61 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.34 1vrt h SER 162 CO -0.40 -0.34 0.15 -1.28 -1.14 0.00 0.00 176.83 173.82 1vrt h SER 163 N -0.51 0.00 0.07 3.07 0.87 -1.82 -2.36 113.55 112.86 1vrt h SER 163 Ca -0.01 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.23 1vrt h SER 163 Cb 0.46 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.39 1vrt h SER 163 CO -0.03 0.00 -1.77 0.80 -0.53 0.00 0.00 176.83 175.31 1vrt n MET 164 N -2.64 0.68 -0.16 2.24 0.00 -0.72 -3.10 117.12 113.40 1vrt n MET 164 Ca -0.02 0.38 -0.04 0.00 0.00 0.00 0.00 57.70 58.02 1vrt n MET 164 Cb 0.19 -1.71 0.06 0.00 0.00 0.00 0.00 33.22 31.76 1vrt n MET 164 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 1vrt h THR 165 N -0.38 0.92 0.29 1.12 1.35 -0.75 -0.34 112.91 115.12 1vrt h THR 165 Ca -0.42 -0.16 -0.01 0.00 -0.55 0.00 0.00 66.41 65.28 1vrt h THR 165 Cb 1.74 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 68.57 1vrt h THR 165 CO -0.05 0.08 -0.26 0.11 -0.25 0.00 0.00 175.52 175.15 1vrt h LYS 166 N 0.46 -0.52 0.00 4.72 6.56 -1.60 0.21 116.57 126.40 1vrt h LYS 166 Ca 0.23 0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 1vrt h LYS 166 Cb 0.17 0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.95 1vrt h LYS 166 CO -0.18 -0.34 0.00 1.51 -2.06 0.00 0.00 179.45 178.37 1vrt n ILE 167 N -3.91 0.87 0.34 1.86 3.06 -1.09 -1.99 119.36 118.50 1vrt n ILE 167 Ca -0.06 0.22 0.04 0.00 -2.50 0.00 0.00 62.75 60.44 1vrt n ILE 167 Cb 0.24 -1.20 0.03 0.00 0.54 0.00 0.00 39.64 39.25 1vrt n ILE 167 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1vrt n LEU 168 N -1.23 1.57 0.09 9.51 4.77 -0.04 -4.64 117.00 127.04 1vrt n LEU 168 Ca 0.01 -0.96 -0.04 0.00 -0.03 0.00 0.00 56.01 54.99 1vrt n LEU 168 Cb 0.01 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.27 1vrt n LEU 168 CO 0.01 0.32 0.56 1.05 -1.33 0.00 0.00 177.39 178.00 1vrt h GLU 169 N 1.47 0.25 0.26 3.23 4.11 -0.04 -2.64 114.58 121.21 1vrt h GLU 169 Ca 0.00 -0.14 -0.01 0.00 0.07 0.00 0.00 59.36 59.28 1vrt h GLU 169 Cb 0.32 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1vrt h GLU 169 CO 0.00 0.70 -0.12 -1.00 0.07 0.00 0.00 179.01 178.65 1vrt h PRO 170 N 0.19 -0.33 -0.36 1.06 0.13 -1.82 -2.41 132.00 128.45 1vrt h PRO 170 Ca 0.01 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1vrt h PRO 170 Cb 0.96 0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 1vrt h PRO 170 CO 0.08 -0.09 0.23 0.35 -0.23 0.00 0.00 178.00 178.34 1vrt h PHE 171 N -0.55 0.47 -0.27 1.56 3.57 -1.87 0.75 116.94 120.60 1vrt h PHE 171 Ca -0.04 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.55 1vrt h PHE 171 Cb 0.40 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1vrt h PHE 171 CO -0.01 0.32 0.29 0.00 -2.23 0.00 0.00 178.31 176.68 1vrt h ARG 172 N 0.48 0.00 0.00 1.11 3.08 -1.41 0.35 114.38 117.99 1vrt h ARG 172 Ca 0.13 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 1vrt h ARG 172 Cb -0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1vrt h ARG 172 CO -0.03 0.00 -1.45 1.63 -1.07 0.00 0.00 179.97 179.05 1vrt n LYS 173 N -3.84 0.66 -0.03 0.04 5.02 -0.92 -3.39 118.16 115.70 1vrt n LYS 173 Ca 0.04 -0.07 0.11 0.00 -2.02 0.00 0.00 58.31 56.37 1vrt n LYS 173 Cb 0.43 -1.22 0.52 0.00 -0.02 0.00 0.00 35.03 34.74 1vrt n LYS 173 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1vrt n GLN 174 N -1.90 1.40 -2.54 1.97 -0.06 0.26 -4.13 117.38 112.37 1vrt n GLN 174 Ca -0.04 -0.60 -0.04 0.00 -2.00 0.00 0.00 57.00 54.32 1vrt n GLN 174 Cb 0.33 -1.39 0.07 0.00 -4.06 0.00 0.00 30.24 25.20 1vrt n GLN 174 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1vrt n ASN 175 N -0.21 -1.38 -0.22 1.69 4.13 0.12 -4.96 115.26 114.43 1vrt n ASN 175 Ca 0.17 -2.02 0.00 0.00 1.68 0.00 0.00 54.58 54.41 1vrt n ASN 175 Cb 0.22 0.82 0.00 0.00 -1.54 0.00 0.00 39.78 39.29 1vrt n ASN 175 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1vrt n PRO 176 N -0.72 0.18 0.11 3.52 -0.02 -1.22 -1.68 135.00 135.18 1vrt n PRO 176 Ca -0.13 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.48 1vrt n PRO 176 Cb 0.76 -1.04 0.24 0.00 -0.02 0.00 0.00 33.50 33.44 1vrt n PRO 176 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1vrt h ASP 177 N 0.36 0.00 -2.90 2.55 2.03 -1.93 -3.45 116.42 113.07 1vrt h ASP 177 Ca 0.00 -0.07 -0.64 0.00 -0.73 0.00 0.00 57.03 55.59 1vrt h ASP 177 Cb 0.04 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 38.46 1vrt h ASP 177 CO 0.00 0.04 -0.40 -0.63 -1.03 0.00 0.00 179.24 177.21 1vrt s ILE 178 N -3.17 5.37 -0.13 4.15 1.09 -0.68 -4.65 121.20 123.18 1vrt s ILE 178 Ca 0.07 0.38 -0.05 0.00 -1.10 0.00 0.00 60.65 59.95 1vrt s ILE 178 Cb 0.11 -3.51 -0.04 0.00 -1.06 0.00 0.00 42.46 37.97 1vrt s ILE 178 CO 0.68 0.55 0.07 -0.69 -0.10 0.00 0.00 174.94 175.45 1vrt s VAL 179 N -0.61 4.89 -0.09 2.92 1.01 -0.30 -4.95 120.40 123.27 1vrt s VAL 179 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1vrt s VAL 179 Cb -0.13 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.14 1vrt s VAL 179 CO 0.05 0.57 -0.10 -0.63 0.00 0.00 0.00 175.10 174.99 1vrt s ILE 180 N -0.55 1.06 0.00 2.22 1.01 -1.26 -0.01 121.20 123.67 1vrt s ILE 180 Ca 0.11 -0.38 0.04 0.00 0.00 0.00 0.00 60.65 60.43 1vrt s ILE 180 Cb -0.12 -1.02 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 1vrt s ILE 180 CO 0.02 0.35 -0.14 -0.47 0.00 0.00 0.00 174.94 174.71 1vrt s TYR 181 N 1.14 1.24 -0.07 3.97 5.04 -0.03 -4.98 117.35 123.66 1vrt s TYR 181 Ca -0.06 -0.26 0.04 0.00 -2.44 0.00 0.00 57.07 54.35 1vrt s TYR 181 Cb -0.14 -0.78 -0.00 0.00 0.35 0.00 0.00 41.96 41.38 1vrt s TYR 181 CO -0.02 -0.00 -0.21 -1.14 -1.34 0.00 0.00 175.55 172.84 1vrt s GLN 182 N -0.54 2.49 -0.10 4.97 0.74 -1.26 0.88 119.66 126.84 1vrt s GLN 182 Ca 0.04 -0.76 -0.02 0.00 0.05 0.00 0.00 55.36 54.67 1vrt s GLN 182 Cb -0.06 -1.99 0.04 0.00 1.10 0.00 0.00 33.01 32.10 1vrt s GLN 182 CO -0.00 0.21 0.03 -0.47 -0.55 0.00 0.00 175.29 174.51 1vrt s TYR 183 N 0.22 0.56 0.00 1.67 5.04 -0.41 -5.02 117.35 119.42 1vrt s TYR 183 Ca -0.12 -0.21 0.00 0.00 -2.44 0.00 0.00 57.07 54.30 1vrt s TYR 183 Cb -0.16 -0.77 0.00 0.00 0.35 0.00 0.00 41.96 41.39 1vrt s TYR 183 CO 0.06 -0.37 0.00 -1.33 -1.34 0.00 0.00 175.55 172.57 1vrt n MET 184 N 5.17 0.00 0.00 4.97 2.81 -1.26 -1.00 117.12 127.81 1vrt n MET 184 Ca -0.07 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 55.97 1vrt n MET 184 Cb 0.49 0.00 0.61 0.00 -0.71 0.00 0.00 33.22 33.62 1vrt n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1vrt n ASP 185 N 5.82 0.51 -4.76 7.83 8.00 -1.26 -4.76 116.55 127.94 1vrt n ASP 185 Ca 0.00 -0.63 -0.25 0.00 0.71 0.00 0.00 54.79 54.61 1vrt n ASP 185 Cb 0.00 -0.06 -0.06 0.00 -0.02 0.00 0.00 41.12 40.98 1vrt n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1vrt s ASP 186 N -2.44 5.25 -0.16 -2.24 1.01 -0.17 -0.85 116.67 117.07 1vrt s ASP 186 Ca 0.30 -0.26 0.01 0.00 0.71 0.00 0.00 52.55 53.31 1vrt s ASP 186 Cb 0.20 -1.28 0.01 0.00 1.01 0.00 0.00 42.92 42.87 1vrt s ASP 186 CO 0.47 0.05 -0.20 -0.22 0.21 0.00 0.00 175.17 175.47 1vrt s LEU 187 N -3.25 2.16 -0.34 1.23 2.96 0.67 -1.29 118.68 120.82 1vrt s LEU 187 Ca 0.30 -0.62 -0.11 0.00 -0.22 0.00 0.00 54.13 53.48 1vrt s LEU 187 Cb -0.09 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.12 1vrt s LEU 187 CO 0.22 0.03 0.20 -0.31 -1.32 0.00 0.00 176.35 175.18 1vrt s TYR 188 N 1.09 3.21 -0.36 5.38 1.51 0.25 -0.42 117.35 128.01 1vrt s TYR 188 Ca -0.00 -0.58 -0.10 0.00 -1.01 0.00 0.00 57.07 55.38 1vrt s TYR 188 Cb -0.14 -2.43 0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1vrt s TYR 188 CO -0.08 -0.49 0.19 0.08 -1.11 0.00 0.00 175.55 174.13 1vrt s VAL 189 N 1.63 4.45 -0.01 0.71 1.01 0.65 -0.86 120.40 127.99 1vrt s VAL 189 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 1vrt s VAL 189 Cb -0.18 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1vrt s VAL 189 CO 0.08 -0.20 0.10 -0.83 0.00 0.00 0.00 175.10 174.25 1vrt s GLY 190 N 1.54 2.04 0.21 4.51 0.00 0.98 -1.06 107.32 115.54 1vrt s GLY 190 Ca 0.02 -0.84 -0.20 0.00 0.00 0.00 0.00 44.72 43.69 1vrt s GLY 190 CO 0.06 -0.72 0.60 -1.35 0.00 0.00 0.00 173.10 171.69 1vrt s SER 191 N -1.73 -0.34 -0.01 1.64 1.04 -0.05 -1.16 113.70 113.10 1vrt s SER 191 Ca 0.23 -0.39 0.14 0.00 0.48 0.00 0.00 55.95 56.41 1vrt s SER 191 Cb -0.12 0.63 -0.17 0.00 0.10 0.00 0.00 66.02 66.46 1vrt s SER 191 CO 0.14 -1.11 0.50 0.47 0.98 0.00 0.00 173.24 174.22 1vrt n ASP 192 N -0.39 0.98 -3.99 7.02 8.00 -1.26 -0.54 116.55 126.37 1vrt n ASP 192 Ca -0.10 -0.58 -0.29 0.00 0.71 0.00 0.00 54.79 54.53 1vrt n ASP 192 Cb 0.62 1.19 0.10 0.00 -0.02 0.00 0.00 41.12 43.01 1vrt n ASP 192 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1vrt n LEU 193 N -1.52 -2.35 -4.77 0.64 4.32 -1.26 -4.81 117.00 107.26 1vrt n LEU 193 Ca 0.01 -0.13 -0.39 0.00 -0.02 0.00 0.00 56.01 55.48 1vrt n LEU 193 Cb 0.26 -0.71 -0.04 0.00 -1.62 0.00 0.00 43.42 41.31 1vrt n LEU 193 CO 0.28 -2.80 0.80 -0.70 -1.22 0.00 0.00 177.39 173.75 1vrt s GLU 194 N -2.80 4.40 0.00 3.23 2.56 -1.26 -4.77 118.70 120.05 1vrt s GLU 194 Ca 0.39 1.76 0.00 0.00 0.00 0.00 0.00 54.97 57.12 1vrt s GLU 194 Cb -0.01 -2.92 0.00 0.00 2.00 0.00 0.00 34.13 33.19 1vrt s GLU 194 CO 0.53 0.00 0.73 1.51 -0.56 0.00 0.00 175.26 177.47 1vrt n ILE 195 N 0.64 1.02 -0.06 -3.70 0.13 -1.26 0.88 119.36 117.01 1vrt n ILE 195 Ca 0.01 0.44 -0.20 0.00 -1.10 0.00 0.00 62.75 61.91 1vrt n ILE 195 Cb 0.46 -1.44 -0.13 0.00 -0.84 0.00 0.00 39.64 37.69 1vrt n ILE 195 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1vrt n GLY 196 N -1.23 -0.46 0.27 4.50 0.00 -1.26 -3.44 105.19 103.56 1vrt n GLY 196 Ca 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 1vrt n GLY 196 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1vrt h GLN 197 N 0.01 0.71 0.79 1.61 1.08 0.14 -3.15 115.11 116.29 1vrt h GLN 197 Ca -0.50 -0.22 -0.04 0.00 -1.45 0.00 0.00 58.65 56.43 1vrt h GLN 197 Cb 1.96 -0.06 0.01 0.00 -0.05 0.00 0.00 27.48 29.33 1vrt h GLN 197 CO -0.01 0.79 -0.38 1.25 -0.95 0.00 0.00 178.83 179.54 1vrt h HIS 198 N 0.64 -0.98 -0.54 2.96 2.76 -0.94 -2.21 115.15 116.84 1vrt h HIS 198 Ca 0.11 -0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.39 1vrt h HIS 198 Cb 0.56 0.32 -0.03 0.00 1.55 0.00 0.00 27.41 29.81 1vrt h HIS 198 CO 0.03 -0.60 0.38 0.00 -1.30 0.00 0.00 177.93 176.44 1vrt h ARG 199 N -1.14 0.14 0.09 5.26 3.08 -1.57 0.22 114.38 120.46 1vrt h ARG 199 Ca -0.11 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1vrt h ARG 199 Cb 0.82 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1vrt h ARG 199 CO 0.18 0.10 -0.04 1.15 -1.07 0.00 0.00 179.97 180.28 1vrt h THR 200 N 0.15 1.14 -0.27 2.04 2.02 -1.54 -2.09 112.91 114.35 1vrt h THR 200 Ca 0.26 -1.32 0.05 0.00 0.77 0.00 0.00 66.41 66.17 1vrt h THR 200 Cb 0.82 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 69.14 1vrt h THR 200 CO -0.04 0.30 0.19 0.50 0.37 0.00 0.00 175.52 176.84 1vrt h LYS 201 N -0.78 0.15 -0.02 6.66 1.63 -0.70 -1.02 116.57 122.49 1vrt h LYS 201 Ca -0.01 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1vrt h LYS 201 Cb 0.58 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.18 1vrt h LYS 201 CO 0.02 0.10 -0.02 0.82 -3.45 0.00 0.00 179.45 176.92 1vrt h ILE 202 N 0.15 1.38 -0.55 2.00 1.08 -1.01 -2.52 117.51 118.04 1vrt h ILE 202 Ca 0.12 -1.15 0.08 0.00 -0.39 0.00 0.00 64.86 63.52 1vrt h ILE 202 Cb 0.29 2.10 -0.06 0.00 -3.07 0.00 0.00 36.82 36.08 1vrt h ILE 202 CO -0.02 0.31 0.19 -0.08 -0.69 0.00 0.00 178.15 177.86 1vrt h GLU 203 N -0.41 0.36 -0.38 2.37 4.57 -0.58 -1.05 114.58 119.47 1vrt h GLU 203 Ca 0.00 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.22 1vrt h GLU 203 Cb 0.51 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.96 1vrt h GLU 203 CO 0.01 0.24 0.06 0.93 -1.18 0.00 0.00 179.01 179.07 1vrt h GLU 204 N 0.37 0.18 -0.70 1.92 5.08 -1.19 0.39 114.58 120.63 1vrt h GLU 204 Ca 0.27 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.68 1vrt h GLU 204 Cb 0.31 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1vrt h GLU 204 CO -0.28 0.12 0.46 1.25 -1.00 0.00 0.00 179.01 179.57 1vrt h LEU 205 N 0.18 0.65 -0.23 1.33 6.46 -0.88 0.32 115.31 123.14 1vrt h LEU 205 Ca 0.18 0.00 0.05 0.00 -0.12 0.00 0.00 57.88 57.99 1vrt h LEU 205 Cb 0.22 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 39.96 1vrt h LEU 205 CO -0.25 0.43 -0.09 0.03 -0.62 0.00 0.00 178.44 177.94 1vrt h ARG 206 N 0.75 -0.04 0.00 1.25 3.08 0.10 -0.93 114.38 118.58 1vrt h ARG 206 Ca 0.30 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.20 1vrt h ARG 206 Cb 0.23 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1vrt h ARG 206 CO -0.10 -0.03 -0.72 1.96 -1.07 0.00 0.00 179.97 180.01 1vrt h GLN 207 N -0.04 0.00 0.00 0.04 7.50 -0.62 -0.52 115.11 121.47 1vrt h GLN 207 Ca 0.12 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.27 1vrt h GLN 207 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.75 1vrt h GLN 207 CO -0.27 0.72 0.00 1.58 -1.50 0.00 0.00 178.83 179.36 1vrt n HIS 208 N -3.57 0.00 -0.03 2.96 -0.00 0.10 0.31 115.22 115.00 1vrt n HIS 208 Ca -0.00 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.15 1vrt n HIS 208 Cb 0.73 -0.05 -0.04 0.00 -0.12 0.00 0.00 29.99 30.51 1vrt n HIS 208 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1vrt n LEU 209 N -1.05 0.45 0.07 0.27 4.77 -0.45 -4.50 117.00 116.55 1vrt n LEU 209 Ca 0.11 -0.01 0.01 0.00 -0.03 0.00 0.00 56.01 56.09 1vrt n LEU 209 Cb 0.07 0.07 0.33 0.00 -2.33 0.00 0.00 43.42 41.56 1vrt n LEU 209 CO 0.10 0.20 0.86 -0.07 -1.33 0.00 0.00 177.39 177.14 1vrt h LEU 210 N 0.00 0.32 -0.54 2.23 -0.00 0.36 0.13 115.31 117.82 1vrt h LEU 210 Ca -0.14 -0.08 0.11 0.00 -0.00 0.00 0.00 57.88 57.77 1vrt h LEU 210 Cb 1.30 -0.09 -0.11 0.00 -0.00 0.00 0.00 40.66 41.77 1vrt h LEU 210 CO 0.00 0.49 -0.16 -0.09 -0.00 0.00 0.00 178.44 178.69 1vrt h ARG 211 N 0.32 -0.02 -0.00 1.13 9.65 -0.37 0.24 114.38 125.33 1vrt h ARG 211 Ca 0.06 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1vrt h ARG 211 Cb 0.44 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.03 1vrt h ARG 211 CO 0.03 -0.02 -0.26 0.91 2.80 0.00 0.00 179.97 183.43 1vrt n TRP 212 N -5.40 0.00 0.00 2.20 8.01 -0.85 -4.96 117.44 116.44 1vrt n TRP 212 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 1vrt n TRP 212 Cb 0.30 -0.33 0.00 0.00 -2.01 0.00 0.00 31.31 29.26 1vrt n TRP 212 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1vrt n GLY 213 N 1.47 1.32 3.85 6.99 0.00 0.07 -5.11 105.19 113.78 1vrt n GLY 213 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1vrt n GLY 213 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vrt s LEU 214 N 0.00 3.91 0.52 0.99 2.96 0.30 -4.88 118.68 122.48 1vrt s LEU 214 Ca 0.00 1.36 0.03 0.00 -0.22 0.00 0.00 54.13 55.30 1vrt s LEU 214 Cb 0.00 -4.21 0.01 0.00 0.50 0.00 0.00 46.19 42.48 1vrt s LEU 214 CO 0.00 -0.34 0.17 0.42 -1.32 0.00 0.00 176.35 175.28 1vrt s THR 215 N -2.22 1.40 0.00 3.68 -4.23 -1.26 -2.50 115.64 110.51 1vrt s THR 215 Ca 0.56 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1vrt s THR 215 Cb -0.10 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.55 1vrt s THR 215 CO 0.22 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.91 1vrt n GLY 231 N -1.46 -0.33 3.72 3.99 0.00 -0.99 -4.63 105.19 105.49 1vrt n GLY 231 Ca -0.11 0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1vrt n GLY 231 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1vrt s TYR 232 N 0.00 3.36 -0.20 1.61 6.14 -1.20 -4.91 117.35 122.14 1vrt s TYR 232 Ca 0.00 1.24 0.01 0.00 0.64 0.00 0.00 57.07 58.96 1vrt s TYR 232 Cb 0.00 -3.52 0.05 0.00 0.42 0.00 0.00 41.96 38.91 1vrt s TYR 232 CO 0.00 -1.62 -0.08 -2.00 0.64 0.00 0.00 175.55 172.49 1vrt s GLU 233 N 0.48 1.85 0.39 4.97 2.12 -1.26 -1.25 118.70 126.00 1vrt s GLU 233 Ca 0.58 -0.83 0.08 0.00 0.36 0.00 0.00 54.97 55.16 1vrt s GLU 233 Cb -0.33 -2.39 -0.01 0.00 0.26 0.00 0.00 34.13 31.65 1vrt s GLU 233 CO 0.33 -0.46 0.43 -0.51 -0.54 0.00 0.00 175.26 174.51 1vrt s LEU 234 N 1.43 3.60 -0.45 2.70 1.02 0.50 -4.96 118.68 122.53 1vrt s LEU 234 Ca -0.02 -0.52 0.06 0.00 0.02 0.00 0.00 54.13 53.68 1vrt s LEU 234 Cb -0.17 -2.37 0.21 0.00 0.02 0.00 0.00 46.19 43.88 1vrt s LEU 234 CO -0.08 -0.60 0.58 1.41 0.02 0.00 0.00 176.35 177.69 1vrt n HIS 235 N -1.62 -1.93 0.03 0.29 8.25 -1.26 -1.87 115.22 117.10 1vrt n HIS 235 Ca 0.03 -2.62 0.10 0.00 -0.26 0.00 0.00 57.72 54.97 1vrt n HIS 235 Cb 0.60 0.64 0.54 0.00 1.12 0.00 0.00 29.99 32.89 1vrt n HIS 235 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1vrt h PRO 236 N 4.78 0.28 -0.15 -0.41 0.13 -1.73 -2.66 132.00 132.24 1vrt h PRO 236 Ca 0.09 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.25 1vrt h PRO 236 Cb 0.97 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1vrt h PRO 236 CO 0.30 0.19 0.27 0.38 -0.23 0.00 0.00 178.00 178.90 1vrt h ASP 237 N 0.29 0.00 -0.73 1.44 2.03 -1.56 -1.47 116.42 116.42 1vrt h ASP 237 Ca 0.17 0.00 -0.39 0.00 -0.73 0.00 0.00 57.03 56.08 1vrt h ASP 237 Cb 0.32 0.00 -0.23 0.00 -0.83 0.00 0.00 39.33 38.59 1vrt h ASP 237 CO -0.04 0.00 0.32 0.29 -1.03 0.00 0.00 179.24 178.78 1vrt n LYS 238 N -3.42 2.14 -4.30 4.15 5.02 -1.00 -4.95 118.16 115.80 1vrt n LYS 238 Ca 0.01 -3.14 -0.34 0.00 -2.02 0.00 0.00 58.31 52.82 1vrt n LYS 238 Cb 0.37 -2.04 -0.11 0.00 -0.02 0.00 0.00 35.03 33.23 1vrt n LYS 238 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1vrt s TRP 239 N -3.33 3.12 0.06 2.13 0.51 -0.56 -5.09 118.94 115.78 1vrt s TRP 239 Ca 0.52 -0.06 -0.03 0.00 -2.12 0.00 0.00 56.10 54.42 1vrt s TRP 239 Cb 0.45 -1.94 -0.03 0.00 -0.81 0.00 0.00 33.47 31.14 1vrt s TRP 239 CO 0.05 0.16 0.02 0.95 -0.51 0.00 0.00 176.95 177.62 1vrt s THR 240 N -0.01 0.20 0.48 2.01 -4.23 -1.26 -5.10 115.64 107.73 1vrt s THR 240 Ca 0.03 -1.62 -0.22 0.00 -1.18 0.00 0.00 61.69 58.70 1vrt s THR 240 Cb -0.13 -1.41 -0.07 0.00 1.34 0.00 0.00 72.50 72.24 1vrt s THR 240 CO 0.02 -0.89 1.20 -0.69 -0.54 0.00 0.00 174.62 173.72 1vrt s VAL 241 N -3.75 2.90 -0.45 2.29 1.01 -1.26 -4.82 120.40 116.32 1vrt s VAL 241 Ca 0.05 0.67 -0.11 0.00 0.00 0.00 0.00 61.98 62.58 1vrt s VAL 241 Cb 0.06 -3.33 0.08 0.00 0.00 0.00 0.00 36.38 33.20 1vrt s VAL 241 CO -0.10 -0.02 0.32 -1.58 0.00 0.00 0.00 175.10 173.72 1vrt s GLN 242 N -2.79 2.72 0.81 2.72 2.00 -1.23 -4.97 119.66 118.92 1vrt s GLN 242 Ca 0.66 -1.47 -0.12 0.00 -2.00 0.00 0.00 55.36 52.43 1vrt s GLN 242 Cb -0.31 -3.92 0.08 0.00 0.80 0.00 0.00 33.01 29.66 1vrt s GLN 242 CO 0.37 -1.02 1.11 -1.25 -0.50 0.00 0.00 175.29 173.99 1vrt s PRO 243 N 1.49 1.95 0.01 1.67 0.04 -1.26 -4.67 135.00 134.22 1vrt s PRO 243 Ca 0.04 0.56 -0.30 0.00 0.04 0.00 0.00 61.00 61.34 1vrt s PRO 243 Cb -0.24 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 1vrt s PRO 243 CO 0.03 -1.70 1.01 0.42 0.04 0.00 0.00 177.00 176.80 1vrt s ILE 244 N -3.19 4.76 0.17 0.56 1.01 -1.26 -4.85 121.20 118.40 1vrt s ILE 244 Ca 0.61 1.99 0.10 0.00 0.00 0.00 0.00 60.65 63.35 1vrt s ILE 244 Cb -0.14 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 1vrt s ILE 244 CO 0.54 0.16 -0.18 0.68 0.00 0.00 0.00 174.94 176.14 1vrt s VAL 245 N 0.99 2.74 -0.08 2.92 -7.23 -1.26 -4.87 120.40 113.61 1vrt s VAL 245 Ca 0.53 -1.79 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 1vrt s VAL 245 Cb -0.22 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 1vrt s VAL 245 CO 0.28 -0.07 -0.08 -0.76 -0.31 0.00 0.00 175.10 174.16 1vrt s LEU 246 N -2.62 3.07 0.36 1.32 1.43 -1.26 -5.05 118.68 115.93 1vrt s LEU 246 Ca 0.22 -0.09 -0.28 0.00 -1.03 0.00 0.00 54.13 52.94 1vrt s LEU 246 Cb -0.09 -1.67 -0.11 0.00 0.03 0.00 0.00 46.19 44.35 1vrt s LEU 246 CO 0.12 0.31 1.43 -2.84 0.23 0.00 0.00 176.35 175.60 1vrt s PRO 247 N -0.52 4.18 -0.15 1.29 0.02 -1.26 -4.99 135.00 133.58 1vrt s PRO 247 Ca 0.08 2.46 -0.01 0.00 0.02 0.00 0.00 61.00 63.55 1vrt s PRO 247 Cb -0.12 -3.00 -0.01 0.00 0.02 0.00 0.00 34.50 31.39 1vrt s PRO 247 CO 0.02 -0.43 -0.11 -2.00 -0.33 0.00 0.00 177.00 174.15 1vrt s GLU 248 N -1.95 3.39 0.09 5.54 2.56 -1.26 -5.10 118.70 121.98 1vrt s GLU 248 Ca 0.52 -0.67 -0.10 0.00 0.00 0.00 0.00 54.97 54.72 1vrt s GLU 248 Cb -0.44 -2.72 0.00 0.00 2.00 0.00 0.00 34.13 32.97 1vrt s GLU 248 CO 0.60 0.13 0.23 -1.59 -0.56 0.00 0.00 175.26 174.06 1vrt s LYS 249 N 0.59 0.88 0.06 4.30 -2.85 -1.26 -5.05 119.74 116.41 1vrt s LYS 249 Ca -0.07 -0.91 -0.34 0.00 -1.00 0.00 0.00 55.97 53.65 1vrt s LYS 249 Cb -0.15 0.36 -0.18 0.00 -2.06 0.00 0.00 37.83 35.80 1vrt s LYS 249 CO 0.03 -0.29 1.52 0.22 0.10 0.00 0.00 175.35 176.93 1vrt h ASP 250 N 2.69 -1.16 -3.63 0.03 3.58 -2.07 -3.44 116.42 112.42 1vrt h ASP 250 Ca -0.34 0.06 -0.60 0.00 0.42 0.00 0.00 57.03 56.58 1vrt h ASP 250 Cb 1.21 0.34 -0.20 0.00 1.72 0.00 0.00 39.33 42.40 1vrt h ASP 250 CO 0.54 -0.71 -0.82 -0.44 -2.88 0.00 0.00 179.24 174.94 1vrt s SER 251 N -3.98 2.98 -0.19 2.28 0.01 -1.26 -5.13 113.70 108.42 1vrt s SER 251 Ca -0.18 -0.81 0.01 0.00 1.31 0.00 0.00 55.95 56.28 1vrt s SER 251 Cb 0.03 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 66.08 1vrt s SER 251 CO 0.56 0.07 -0.19 0.26 0.41 0.00 0.00 173.24 174.35 1vrt s TRP 252 N -1.59 2.82 0.66 2.43 0.52 -1.26 -5.05 118.94 117.47 1vrt s TRP 252 Ca 0.15 -1.64 -0.04 0.00 0.02 0.00 0.00 56.10 54.58 1vrt s TRP 252 Cb -0.08 -1.93 0.05 0.00 -1.15 0.00 0.00 33.47 30.36 1vrt s TRP 252 CO 0.07 -0.80 0.95 0.95 0.02 0.00 0.00 176.95 178.14 1vrt s THR 253 N 1.29 2.44 0.22 2.01 -4.23 -1.26 0.43 115.64 116.54 1vrt s THR 253 Ca 0.04 -0.37 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 1vrt s THR 253 Cb -0.13 -3.02 0.17 0.00 1.34 0.00 0.00 72.50 70.85 1vrt s THR 253 CO -0.12 -0.02 1.78 0.58 -0.54 0.00 0.00 174.62 176.30 1vrt h VAL 254 N -0.40 0.87 -0.88 2.29 2.07 -1.09 -0.93 116.25 118.18 1vrt h VAL 254 Ca -0.44 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 66.88 1vrt h VAL 254 Cb 1.31 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1vrt h VAL 254 CO 0.58 0.11 0.58 -1.13 0.02 0.00 0.00 177.57 177.73 1vrt h ASN 255 N 0.61 1.00 -0.28 0.57 -0.00 -1.57 -1.42 115.58 114.49 1vrt h ASN 255 Ca 0.34 -0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.60 1vrt h ASN 255 Cb 0.33 -0.25 -0.01 0.00 -0.00 0.00 0.00 38.32 38.39 1vrt h ASN 255 CO -0.25 0.72 0.14 0.44 -0.00 0.00 0.00 177.43 178.49 1vrt h ASP 256 N 1.18 0.35 -0.54 1.15 3.32 -1.49 -1.72 116.42 118.68 1vrt h ASP 256 Ca 0.32 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1vrt h ASP 256 Cb -0.13 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 1vrt h ASP 256 CO -0.07 0.36 0.28 0.40 -1.72 0.00 0.00 179.24 178.48 1vrt h ILE 257 N 0.32 1.19 -0.17 0.35 2.04 -1.10 -0.26 117.51 119.88 1vrt h ILE 257 Ca 0.10 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 1vrt h ILE 257 Cb 0.09 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1vrt h ILE 257 CO -0.01 0.22 0.03 1.56 0.00 0.00 0.00 178.15 179.94 1vrt h GLN 258 N 0.79 0.27 0.00 2.37 4.20 -0.72 0.11 115.11 122.13 1vrt h GLN 258 Ca 0.20 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 1vrt h GLN 258 Cb 0.07 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1vrt h GLN 258 CO -0.03 0.44 -0.18 0.87 -0.67 0.00 0.00 178.83 179.26 1vrt h LYS 259 N 0.06 0.00 0.45 1.46 1.57 -0.87 -2.15 116.57 117.09 1vrt h LYS 259 Ca 0.05 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1vrt h LYS 259 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1vrt h LYS 259 CO 0.00 0.18 -0.21 1.25 -0.57 0.00 0.00 179.45 180.10 1vrt h LEU 260 N 0.00 -0.51 -1.14 2.94 5.85 -0.23 -1.48 115.31 120.74 1vrt h LEU 260 Ca -0.00 -0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.75 1vrt h LEU 260 Cb 0.35 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 1vrt h LEU 260 CO 0.02 -0.12 0.60 0.58 -0.34 0.00 0.00 178.44 179.19 1vrt h VAL 261 N -0.97 0.88 -0.21 1.05 2.07 -0.62 0.13 116.25 118.58 1vrt h VAL 261 Ca -0.06 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 1vrt h VAL 261 Cb 0.57 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1vrt h VAL 261 CO 0.10 0.16 0.01 1.23 0.02 0.00 0.00 177.57 179.09 1vrt h GLY 262 N 0.86 0.38 0.73 2.17 0.00 -1.37 0.10 103.07 105.94 1vrt h GLY 262 Ca 0.48 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.53 1vrt h GLY 262 CO -0.24 0.25 -0.07 1.70 0.00 0.00 0.00 176.54 178.18 1vrt h LYS 263 N 0.13 -0.20 -0.62 4.80 3.64 -0.81 -2.95 116.57 120.57 1vrt h LYS 263 Ca 0.06 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.57 1vrt h LYS 263 Cb 0.37 0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.14 1vrt h LYS 263 CO 0.01 0.08 0.11 -0.07 -2.27 0.00 0.00 179.45 177.31 1vrt h LEU 264 N -0.49 -0.05 -0.89 5.20 3.38 -0.69 -1.00 115.31 120.78 1vrt h LEU 264 Ca -0.02 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.14 1vrt h LEU 264 Cb 0.38 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 1vrt h LEU 264 CO 0.04 -0.02 0.55 -1.13 0.09 0.00 0.00 178.44 177.96 1vrt h ASN 265 N 0.23 0.85 0.31 -0.43 -1.24 -0.79 0.27 115.58 114.77 1vrt h ASN 265 Ca 0.33 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 57.34 1vrt h ASN 265 Cb 0.51 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.41 1vrt h ASN 265 CO -0.44 0.53 -0.15 -0.25 -1.29 0.00 0.00 177.43 175.83 1vrt h TRP 266 N 0.97 -0.39 -0.09 0.67 7.01 -1.06 -2.80 115.95 120.27 1vrt h TRP 266 Ca 0.40 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.41 1vrt h TRP 266 Cb 0.23 0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 27.41 1vrt h TRP 266 CO -0.03 -0.10 0.09 0.00 -2.79 0.00 0.00 178.44 175.61 1vrt h ALA 267 N -0.04 1.74 0.00 2.65 0.00 -0.75 -1.75 119.26 121.11 1vrt h ALA 267 Ca -0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vrt h ALA 267 Cb 0.46 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1vrt h ALA 267 CO 0.07 -0.14 -0.04 0.66 0.00 0.00 0.00 179.25 179.80 1vrt h SER 268 N 0.00 0.00 1.11 0.00 4.64 -0.20 -0.29 113.55 118.82 1vrt h SER 268 Ca 0.04 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1vrt h SER 268 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1vrt h SER 268 CO -0.00 0.04 -0.15 0.06 -0.87 0.00 0.00 176.83 175.91 1vrt h GLN 269 N 0.00 0.00 0.09 4.77 3.07 -1.38 -2.69 115.11 118.97 1vrt h GLN 269 Ca -0.00 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.42 1vrt h GLN 269 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.81 1vrt h GLN 269 CO 0.01 0.15 -1.76 -0.89 0.09 0.00 0.00 178.83 176.43 1vrt n ILE 270 N -3.26 1.71 -4.01 1.86 5.41 -0.26 -4.73 119.36 116.07 1vrt n ILE 270 Ca 0.01 -0.46 -0.31 0.00 1.00 0.00 0.00 62.75 62.99 1vrt n ILE 270 Cb 0.42 -1.84 -0.15 0.00 -0.71 0.00 0.00 39.64 37.37 1vrt n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1vrt s TYR 271 N -2.50 3.58 -0.06 1.39 1.51 -0.37 -4.99 117.35 115.91 1vrt s TYR 271 Ca -0.24 -2.84 0.30 0.00 -1.01 0.00 0.00 57.07 53.28 1vrt s TYR 271 Cb 0.06 -2.72 1.38 0.00 -0.11 0.00 0.00 41.96 40.57 1vrt s TYR 271 CO 0.71 -0.93 1.90 -1.00 -1.11 0.00 0.00 175.55 175.12 1vrt h PRO 272 N 7.66 0.00 0.00 -1.71 0.13 -1.76 -3.13 132.00 133.19 1vrt h PRO 272 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1vrt h PRO 272 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1vrt h PRO 272 CO 0.51 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.69 1vrt n GLY 273 N -0.42 -0.68 3.63 1.56 0.00 -1.26 -4.70 105.19 103.32 1vrt n GLY 273 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1vrt n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vrt s ILE 274 N -2.58 4.26 0.03 -0.61 1.01 -1.18 -4.93 121.20 117.19 1vrt s ILE 274 Ca 0.11 1.42 0.03 0.00 0.00 0.00 0.00 60.65 62.20 1vrt s ILE 274 Cb 0.08 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 1vrt s ILE 274 CO 0.18 -0.53 0.01 -0.54 0.00 0.00 0.00 174.94 174.05 1vrt s LYS 275 N 4.04 2.72 0.00 2.79 1.02 -1.26 -4.89 119.74 124.16 1vrt s LYS 275 Ca 0.52 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.83 1vrt s LYS 275 Cb -0.14 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.53 1vrt s LYS 275 CO 0.22 0.60 0.39 0.28 -0.92 0.00 0.00 175.35 175.91 1vrt n VAL 276 N 1.09 0.10 -0.25 3.17 0.31 -1.26 -4.89 118.33 116.60 1vrt n VAL 276 Ca -0.13 -0.36 -0.02 0.00 -0.01 0.00 0.00 64.34 63.83 1vrt n VAL 276 Cb 0.52 1.27 0.05 0.00 -0.91 0.00 0.00 33.84 34.77 1vrt n VAL 276 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1vrt h ARG 277 N 0.00 -0.07 -0.14 5.55 2.43 -1.99 0.40 114.38 120.56 1vrt h ARG 277 Ca 0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 1vrt h ARG 277 Cb 0.28 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1vrt h ARG 277 CO 0.00 -0.05 -0.54 1.96 -1.51 0.00 0.00 179.97 179.83 1vrt h GLN 278 N -0.07 0.41 -0.35 0.20 1.08 -1.91 -2.36 115.11 112.12 1vrt h GLN 278 Ca 0.31 -0.25 -0.09 0.00 -1.45 0.00 0.00 58.65 57.16 1vrt h GLN 278 Cb 0.56 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 1vrt h GLN 278 CO -0.76 0.85 -0.13 -0.07 -0.95 0.00 0.00 178.83 177.77 1vrt h LEU 279 N 0.32 0.71 -1.16 1.46 3.38 -1.32 -2.67 115.31 116.03 1vrt h LEU 279 Ca 0.01 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1vrt h LEU 279 Cb 1.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1vrt h LEU 279 CO 0.09 0.94 0.39 0.00 0.09 0.00 0.00 178.44 179.96 1vrt h LYS 281 N 0.99 0.00 0.00 0.00 1.57 -1.07 0.21 116.57 118.26 1vrt h LYS 281 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1vrt h LYS 281 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1vrt h LYS 281 CO -0.04 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.12 1vrt n LEU 282 N -4.26 0.00 0.07 2.94 4.77 -1.04 -3.48 117.00 115.99 1vrt n LEU 282 Ca -0.02 0.46 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 1vrt n LEU 282 Cb 0.15 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 40.80 1vrt n LEU 282 CO 0.32 -0.01 0.00 0.18 -1.33 0.00 0.00 177.39 176.54 1vrt n LEU 283 N -1.46 0.69 -4.34 2.23 4.32 0.73 -4.97 117.00 114.21 1vrt n LEU 283 Ca 0.08 0.20 -0.36 0.00 -0.02 0.00 0.00 56.01 55.92 1vrt n LEU 283 Cb 0.31 -0.08 0.07 0.00 -1.62 0.00 0.00 43.42 42.10 1vrt n LEU 283 CO 0.25 -0.10 -0.33 0.54 -1.22 0.00 0.00 177.39 176.54 1vrt n ARG 284 N -2.38 0.05 0.00 3.23 1.74 -1.21 -4.74 116.66 113.34 1vrt n ARG 284 Ca 0.01 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 1vrt n ARG 284 Cb 0.51 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 1vrt n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vrt n GLY 285 N 2.06 -1.15 3.24 -0.13 0.00 -1.26 -4.70 105.19 103.25 1vrt n GLY 285 Ca 0.07 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.08 1vrt n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vrt s THR 286 N -2.98 5.30 0.47 2.61 -4.23 -1.26 -5.04 115.64 110.51 1vrt s THR 286 Ca 0.00 -3.57 -0.07 0.00 -1.18 0.00 0.00 61.69 56.86 1vrt s THR 286 Cb 0.00 -4.22 -0.04 0.00 1.34 0.00 0.00 72.50 69.57 1vrt s THR 286 CO 0.00 -1.14 0.81 -0.54 -0.54 0.00 0.00 174.62 173.21 1vrt s LYS 287 N -1.24 3.61 0.35 3.99 1.02 -1.26 -5.04 119.74 121.16 1vrt s LYS 287 Ca 0.29 0.33 -0.28 0.00 0.02 0.00 0.00 55.97 56.33 1vrt s LYS 287 Cb -0.09 -2.35 -0.10 0.00 -0.52 0.00 0.00 37.83 34.77 1vrt s LYS 287 CO -0.10 -0.20 1.33 0.00 -0.92 0.00 0.00 175.35 175.47 1vrt s ALA 288 N -2.68 3.48 0.56 5.17 0.00 -1.26 -4.88 121.76 122.14 1vrt s ALA 288 Ca 0.49 1.30 0.27 0.00 0.00 0.00 0.00 51.96 54.02 1vrt s ALA 288 Cb -0.10 -3.50 1.48 0.00 0.00 0.00 0.00 23.12 21.00 1vrt s ALA 288 CO 0.42 -0.72 1.99 1.25 0.00 0.00 0.00 175.76 178.70 1vrt h LEU 289 N 3.24 0.00 -1.26 0.00 5.85 -1.97 -1.95 115.31 119.22 1vrt h LEU 289 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1vrt h LEU 289 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1vrt h LEU 289 CO 0.65 0.00 -0.12 0.35 -0.34 0.00 0.00 178.44 178.98 1vrt n THR 290 N -4.05 0.00 -1.92 1.05 -2.24 -1.26 -1.55 114.28 104.31 1vrt n THR 290 Ca 0.07 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1vrt n THR 290 Cb 0.56 0.99 -0.03 0.00 -2.10 0.00 0.00 70.33 69.75 1vrt n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1vrt s GLU 291 N -2.16 4.19 0.28 -0.78 2.12 -0.73 -4.71 118.70 116.91 1vrt s GLU 291 Ca 0.29 2.34 -0.29 0.00 0.36 0.00 0.00 54.97 57.66 1vrt s GLU 291 Cb 0.20 -3.66 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 1vrt s GLU 291 CO 0.39 -0.76 1.20 0.08 -0.54 0.00 0.00 175.26 175.63 1vrt s VAL 292 N 2.86 3.20 -0.36 3.70 1.01 -1.26 -0.95 120.40 128.60 1vrt s VAL 292 Ca 0.75 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.92 1vrt s VAL 292 Cb -0.39 -3.74 0.11 0.00 0.00 0.00 0.00 36.38 32.35 1vrt s VAL 292 CO 0.32 0.26 0.10 -0.63 0.00 0.00 0.00 175.10 175.16 1vrt s ILE 293 N -0.96 1.88 0.21 2.22 -1.09 0.17 -4.89 121.20 118.73 1vrt s ILE 293 Ca 0.48 -2.23 -0.32 0.00 -2.23 0.00 0.00 60.65 56.35 1vrt s ILE 293 Cb -0.35 -2.38 -0.11 0.00 -1.58 0.00 0.00 42.46 38.04 1vrt s ILE 293 CO 0.45 -0.67 1.66 -2.84 -1.23 0.00 0.00 174.94 172.31 1vrt s PRO 294 N 0.90 4.15 0.37 2.79 0.02 -1.26 -4.55 135.00 137.42 1vrt s PRO 294 Ca 0.12 2.53 -0.24 0.00 0.02 0.00 0.00 61.00 63.43 1vrt s PRO 294 Cb -0.20 -3.09 -0.10 0.00 0.02 0.00 0.00 34.50 31.13 1vrt s PRO 294 CO -0.11 -0.70 0.99 -0.51 -0.33 0.00 0.00 177.00 176.34 1vrt s LEU 295 N 0.98 4.18 0.00 -5.54 1.02 -1.26 -5.06 118.68 113.00 1vrt s LEU 295 Ca 0.72 1.89 -0.04 0.00 0.02 0.00 0.00 54.13 56.73 1vrt s LEU 295 Cb -0.48 -4.18 0.05 0.00 0.02 0.00 0.00 46.19 41.60 1vrt s LEU 295 CO 0.33 -0.30 0.23 0.35 0.02 0.00 0.00 176.35 176.99 1vrt n THR 296 N 0.08 0.00 0.09 5.49 -2.24 -1.26 -4.83 114.28 111.61 1vrt n THR 296 Ca 0.04 -0.14 -0.14 0.00 -2.27 0.00 0.00 64.05 61.54 1vrt n THR 296 Cb 0.51 -1.49 -0.10 0.00 -2.10 0.00 0.00 70.33 67.14 1vrt n THR 296 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1vrt h GLU 297 N 0.00 0.28 -0.06 -0.78 3.07 -1.99 -2.61 114.58 112.50 1vrt h GLU 297 Ca -0.08 -0.40 -0.21 0.00 -0.50 0.00 0.00 59.36 58.17 1vrt h GLU 297 Cb 0.23 0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1vrt h GLU 297 CO 0.05 1.15 -0.79 0.93 -1.40 0.00 0.00 179.01 178.95 1vrt h GLU 298 N 0.11 0.63 -0.40 2.33 3.07 -1.99 -2.29 114.58 116.05 1vrt h GLU 298 Ca -0.10 -0.61 -0.03 0.00 -0.50 0.00 0.00 59.36 58.12 1vrt h GLU 298 Cb 1.81 0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 29.85 1vrt h GLU 298 CO 0.18 1.22 0.14 0.00 -1.40 0.00 0.00 179.01 179.14 1vrt h ALA 299 N 0.43 0.52 -0.21 3.43 0.00 -1.86 -1.44 119.26 120.14 1vrt h ALA 299 Ca -0.08 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.71 1vrt h ALA 299 Cb 1.45 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 1vrt h ALA 299 CO 0.16 0.16 -0.08 0.93 0.00 0.00 0.00 179.25 180.42 1vrt h GLU 300 N 0.50 -0.04 -0.75 0.00 4.39 -1.45 -1.98 114.58 115.26 1vrt h GLU 300 Ca 0.13 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 1vrt h GLU 300 Cb 0.24 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 1vrt h GLU 300 CO -0.01 -0.03 0.45 1.25 -1.16 0.00 0.00 179.01 179.51 1vrt h LEU 301 N -0.04 0.90 -0.30 1.33 5.85 -1.24 -2.24 115.31 119.58 1vrt h LEU 301 Ca 0.11 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.82 1vrt h LEU 301 Cb 0.20 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 1vrt h LEU 301 CO -0.24 0.71 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.45 1vrt h GLU 302 N 1.02 0.04 -0.66 1.25 4.81 -0.99 -1.00 114.58 119.05 1vrt h GLU 302 Ca 0.27 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1vrt h GLU 302 Cb -0.03 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1vrt h GLU 302 CO -0.05 0.03 0.41 1.25 -0.73 0.00 0.00 179.01 179.92 1vrt h LEU 303 N 0.04 0.68 -0.44 1.64 6.46 -1.15 -2.09 115.31 120.45 1vrt h LEU 303 Ca 0.14 -0.00 0.05 0.00 -0.12 0.00 0.00 57.88 57.95 1vrt h LEU 303 Cb 0.21 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.95 1vrt h LEU 303 CO -0.28 0.47 0.19 0.00 -0.62 0.00 0.00 178.44 178.21 1vrt h ALA 304 N 1.28 0.55 -0.33 1.25 0.00 -0.75 0.41 119.26 121.66 1vrt h ALA 304 Ca 0.26 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1vrt h ALA 304 Cb 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1vrt h ALA 304 CO -0.10 -0.18 0.03 0.93 0.00 0.00 0.00 179.25 179.93 1vrt h GLU 305 N 0.39 0.57 -0.07 0.00 5.08 -0.89 -1.34 114.58 118.32 1vrt h GLU 305 Ca 0.20 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1vrt h GLU 305 Cb 0.15 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1vrt h GLU 305 CO -0.17 0.67 -0.09 -0.91 -1.00 0.00 0.00 179.01 177.51 1vrt h ASN 306 N 0.39 -0.29 -0.75 1.42 2.35 -1.09 0.17 115.58 117.78 1vrt h ASN 306 Ca 0.10 0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.97 1vrt h ASN 306 Cb 0.40 0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.84 1vrt h ASN 306 CO 0.01 -0.13 0.44 -0.09 -1.65 0.00 0.00 177.43 176.01 1vrt h ARG 307 N -0.13 0.76 -0.14 0.81 2.43 -0.88 -1.12 114.38 116.11 1vrt h ARG 307 Ca 0.06 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1vrt h ARG 307 Cb 0.21 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1vrt h ARG 307 CO -0.15 0.50 0.06 0.93 -1.51 0.00 0.00 179.97 179.81 1vrt h GLU 308 N 0.78 0.14 -0.46 0.20 4.39 -0.20 -2.90 114.58 116.53 1vrt h GLU 308 Ca 0.34 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 60.11 1vrt h GLU 308 Cb 0.22 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.78 1vrt h GLU 308 CO -0.20 0.09 0.07 0.82 -1.16 0.00 0.00 179.01 178.64 1vrt h ILE 309 N 0.14 0.73 0.00 3.13 2.04 0.48 -2.27 117.51 121.76 1vrt h ILE 309 Ca 0.06 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1vrt h ILE 309 Cb 0.01 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1vrt h ILE 309 CO -0.04 0.04 0.00 0.18 0.00 0.00 0.00 178.15 178.33 1vrt n LEU 310 N -5.13 0.00 0.00 1.44 4.77 -0.63 -3.71 117.00 113.74 1vrt n LEU 310 Ca 0.04 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.13 1vrt n LEU 310 Cb 0.22 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.81 1vrt n LEU 310 CO 0.21 0.00 0.83 0.29 -1.33 0.00 0.00 177.39 177.38 1vrt n LYS 311 N -0.68 0.20 -3.72 3.23 5.02 -0.86 -4.47 118.16 116.89 1vrt n LYS 311 Ca 0.07 0.11 -0.10 0.00 -2.02 0.00 0.00 58.31 56.37 1vrt n LYS 311 Cb 0.03 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.49 1vrt n LYS 311 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1vrt s GLU 312 N -2.71 1.11 0.33 1.97 2.02 -1.24 -5.04 118.70 115.13 1vrt s GLU 312 Ca 0.17 -0.82 -0.29 0.00 0.02 0.00 0.00 54.97 54.05 1vrt s GLU 312 Cb 0.14 0.45 -0.12 0.00 0.10 0.00 0.00 34.13 34.71 1vrt s GLU 312 CO 0.34 -0.43 1.52 -2.30 0.02 0.00 0.00 175.26 174.41 1vrt n PRO 313 N -0.22 2.61 -1.59 0.39 -0.02 -1.26 -4.90 135.00 130.00 1vrt n PRO 313 Ca -0.14 0.92 -0.42 0.00 -2.02 0.00 0.00 63.50 61.84 1vrt n PRO 313 Cb 0.63 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1vrt n PRO 313 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1vrt n VAL 314 N 1.35 2.25 -1.61 -1.45 3.14 -1.26 -4.91 118.33 115.84 1vrt n VAL 314 Ca 0.06 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.63 1vrt n VAL 314 Cb 0.37 -1.05 0.05 0.00 -1.06 0.00 0.00 33.84 32.15 1vrt n VAL 314 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 1vrt s HIS 315 N -1.24 3.18 0.00 1.45 3.76 -1.26 -4.35 115.29 116.83 1vrt s HIS 315 Ca 0.62 1.39 0.00 0.00 -0.15 0.00 0.00 55.06 56.92 1vrt s HIS 315 Cb -0.60 -2.86 0.00 0.00 1.11 0.00 0.00 32.58 30.23 1vrt s HIS 315 CO 0.58 -1.17 0.00 0.41 -0.85 0.00 0.00 174.74 173.71 1vrt n GLY 316 N -2.11 2.72 3.70 -2.22 0.00 -1.26 -5.04 105.19 100.98 1vrt n GLY 316 Ca 0.07 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 44.96 1vrt n GLY 316 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1vrt n VAL 317 N 0.00 0.65 -3.98 1.61 0.24 -1.26 -5.00 118.33 110.59 1vrt n VAL 317 Ca 0.00 -0.16 -0.09 0.00 -2.04 0.00 0.00 64.34 62.05 1vrt n VAL 317 Cb 0.00 -1.73 -0.10 0.00 -1.47 0.00 0.00 33.84 30.53 1vrt n VAL 317 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 1vrt s TYR 318 N 0.33 0.27 -0.11 6.34 -0.85 -1.26 -5.06 117.35 117.00 1vrt s TYR 318 Ca 0.70 -0.57 -0.25 0.00 -0.52 0.00 0.00 57.07 56.43 1vrt s TYR 318 Cb -0.58 -0.20 -0.03 0.00 0.38 0.00 0.00 41.96 41.54 1vrt s TYR 318 CO 0.44 -0.26 0.78 -0.47 -1.52 0.00 0.00 175.55 174.52 1vrt s TYR 319 N -2.06 3.51 -0.45 -3.49 5.04 -1.26 -5.02 117.35 113.62 1vrt s TYR 319 Ca -0.10 1.27 -0.14 0.00 -2.44 0.00 0.00 57.07 55.66 1vrt s TYR 319 Cb -0.05 -2.92 0.06 0.00 0.35 0.00 0.00 41.96 39.40 1vrt s TYR 319 CO -0.03 -0.08 0.34 0.34 -1.34 0.00 0.00 175.55 174.79 1vrt s ASP 320 N 1.00 6.02 0.57 4.32 -1.08 -1.26 -4.95 116.67 121.29 1vrt s ASP 320 Ca 0.39 -1.27 0.38 0.00 -0.52 0.00 0.00 52.55 51.52 1vrt s ASP 320 Cb -0.17 -2.13 2.05 0.00 -1.46 0.00 0.00 42.92 41.20 1vrt s ASP 320 CO 0.16 -0.58 2.15 -0.65 0.52 0.00 0.00 175.17 176.78 1vrt h PRO 321 N 8.65 0.00 -0.00 4.34 0.11 -2.00 -0.91 132.00 142.19 1vrt h PRO 321 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1vrt h PRO 321 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1vrt h PRO 321 CO 0.82 0.00 -0.05 -1.13 -0.21 0.00 0.00 178.00 177.43 1vrt n SER 322 N -2.84 0.33 -4.71 -2.05 3.41 -1.26 -4.88 113.62 101.62 1vrt n SER 322 Ca -0.03 -0.66 -0.23 0.00 -0.26 0.00 0.00 58.87 57.69 1vrt n SER 322 Cb 0.08 -0.10 -0.07 0.00 -0.26 0.00 0.00 64.21 63.86 1vrt n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1vrt s LYS 323 N -2.34 2.30 0.41 4.33 -0.14 -0.35 -5.11 119.74 118.85 1vrt s LYS 323 Ca 0.34 -1.60 -0.23 0.00 -1.36 0.00 0.00 55.97 53.13 1vrt s LYS 323 Cb 0.21 -2.12 -0.09 0.00 -1.68 0.00 0.00 37.83 34.15 1vrt s LYS 323 CO 0.43 0.11 1.01 -0.51 -0.76 0.00 0.00 175.35 175.64 1vrt s ASP 324 N -3.82 6.79 -0.27 2.83 1.01 -1.26 -4.95 116.67 117.00 1vrt s ASP 324 Ca 0.37 1.93 -0.15 0.00 0.71 0.00 0.00 52.55 55.40 1vrt s ASP 324 Cb -0.02 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 1vrt s ASP 324 CO 0.22 -0.47 0.40 -0.22 0.21 0.00 0.00 175.17 175.31 1vrt s LEU 325 N -2.83 4.05 -0.13 1.23 2.96 -1.26 -4.38 118.68 118.32 1vrt s LEU 325 Ca 0.59 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.81 1vrt s LEU 325 Cb -0.18 -2.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 1vrt s LEU 325 CO 0.23 -0.21 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.35 1vrt s ILE 326 N 2.12 3.66 -0.13 6.68 1.01 0.22 -0.56 121.20 134.20 1vrt s ILE 326 Ca 0.16 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.38 1vrt s ILE 326 Cb -0.16 -2.56 0.01 0.00 0.01 0.00 0.00 42.46 39.76 1vrt s ILE 326 CO 0.10 0.53 -0.22 0.00 0.00 0.00 0.00 174.94 175.34 1vrt s ALA 327 N 0.06 2.23 -0.05 9.38 0.00 -0.33 -0.83 121.76 132.22 1vrt s ALA 327 Ca -0.02 -1.07 0.05 0.00 0.00 0.00 0.00 51.96 50.92 1vrt s ALA 327 Cb -0.14 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 1vrt s ALA 327 CO 0.03 0.02 -0.19 -1.21 0.00 0.00 0.00 175.76 174.41 1vrt s GLU 328 N 0.75 2.47 0.09 0.00 2.02 -0.90 -0.80 118.70 122.32 1vrt s GLU 328 Ca -0.09 -0.80 0.10 0.00 0.02 0.00 0.00 54.97 54.21 1vrt s GLU 328 Cb -0.16 -2.27 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 1vrt s GLU 328 CO -0.00 0.53 -0.26 0.42 0.02 0.00 0.00 175.26 175.97 1vrt s ILE 329 N -0.51 2.24 -0.04 -1.63 1.01 -1.20 -2.07 121.20 118.99 1vrt s ILE 329 Ca 0.07 -1.56 0.02 0.00 0.00 0.00 0.00 60.65 59.18 1vrt s ILE 329 Cb -0.11 -1.93 0.01 0.00 0.01 0.00 0.00 42.46 40.43 1vrt s ILE 329 CO 0.01 0.23 -0.08 -1.10 0.00 0.00 0.00 174.94 174.00 1vrt s GLN 330 N -1.65 1.02 -0.29 2.79 1.11 0.78 -4.58 119.66 118.83 1vrt s GLN 330 Ca 0.13 -0.26 -0.27 0.00 0.01 0.00 0.00 55.36 54.96 1vrt s GLN 330 Cb -0.10 -0.94 0.01 0.00 -1.01 0.00 0.00 33.01 30.97 1vrt s GLN 330 CO 0.04 0.05 0.99 0.21 0.01 0.00 0.00 175.29 176.59 1vrt s LYS 331 N 0.44 4.09 0.00 2.91 2.20 -1.26 -0.84 119.74 127.28 1vrt s LYS 331 Ca -0.07 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.55 1vrt s LYS 331 Cb -0.11 -3.71 0.00 0.00 -1.51 0.00 0.00 37.83 32.50 1vrt s LYS 331 CO 0.01 -0.77 0.00 1.04 -0.36 0.00 0.00 175.35 175.27 1vrt n GLN 332 N 6.54 0.00 0.00 4.03 1.13 0.06 -4.96 117.38 124.18 1vrt n GLN 332 Ca 0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.16 1vrt n GLN 332 Cb 0.47 -0.17 0.00 0.00 0.11 0.00 0.00 30.24 30.65 1vrt n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vrt n GLY 333 N 2.64 -0.40 2.87 1.08 0.00 -1.14 -4.97 105.19 105.28 1vrt n GLY 333 Ca 0.00 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 1vrt n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1vrt n GLN 334 N -0.34 -2.67 -1.18 1.61 1.13 -1.26 -0.45 117.38 114.22 1vrt n GLN 334 Ca 0.00 0.32 0.00 0.00 -1.94 0.00 0.00 57.00 55.38 1vrt n GLN 334 Cb 0.00 -4.91 0.00 0.00 0.11 0.00 0.00 30.24 25.44 1vrt n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vrt n GLY 335 N -0.81 0.62 3.29 1.08 0.00 -1.26 -4.89 105.19 103.22 1vrt n GLY 335 Ca -0.04 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1vrt n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vrt s GLN 336 N -2.47 1.80 0.02 1.61 -0.21 0.41 -0.73 119.66 120.08 1vrt s GLN 336 Ca 0.00 -0.95 0.01 0.00 0.02 0.00 0.00 55.36 54.44 1vrt s GLN 336 Cb 0.00 -1.84 -0.02 0.00 1.00 0.00 0.00 33.01 32.15 1vrt s GLN 336 CO 0.00 0.49 -0.04 -1.58 -2.12 0.00 0.00 175.29 172.04 1vrt s TRP 337 N -0.68 0.36 0.13 0.91 0.52 0.17 -0.76 118.94 119.60 1vrt s TRP 337 Ca 0.10 -0.49 0.10 0.00 0.02 0.00 0.00 56.10 55.83 1vrt s TRP 337 Cb -0.09 -0.24 -0.04 0.00 -1.15 0.00 0.00 33.47 31.95 1vrt s TRP 337 CO 0.00 -0.15 -0.25 0.95 0.02 0.00 0.00 176.95 177.52 1vrt s THR 338 N -1.35 2.14 -0.01 2.01 -4.23 -0.02 -0.53 115.64 113.65 1vrt s THR 338 Ca -0.13 -1.74 -0.11 0.00 -1.18 0.00 0.00 61.69 58.53 1vrt s THR 338 Cb -0.09 -1.92 0.01 0.00 1.34 0.00 0.00 72.50 71.84 1vrt s THR 338 CO -0.01 0.03 0.22 -0.72 -0.54 0.00 0.00 174.62 173.60 1vrt s TYR 339 N -1.16 -0.07 0.04 3.99 -0.85 -1.08 -0.16 117.35 118.05 1vrt s TYR 339 Ca 0.13 0.09 0.04 0.00 -0.52 0.00 0.00 57.07 56.81 1vrt s TYR 339 Cb -0.10 0.02 -0.02 0.00 0.38 0.00 0.00 41.96 42.25 1vrt s TYR 339 CO 0.06 -0.32 -0.12 -0.65 -1.52 0.00 0.00 175.55 173.00 1vrt s GLN 340 N -1.26 0.78 -0.19 -3.49 1.11 -0.88 -1.29 119.66 114.44 1vrt s GLN 340 Ca -0.13 -0.69 0.01 0.00 0.01 0.00 0.00 55.36 54.56 1vrt s GLN 340 Cb -0.06 -0.73 0.02 0.00 -1.01 0.00 0.00 33.01 31.23 1vrt s GLN 340 CO 0.03 0.18 -0.18 0.42 0.01 0.00 0.00 175.29 175.74 1vrt s ILE 341 N -0.88 2.03 0.30 1.08 1.01 0.16 -2.12 121.20 122.78 1vrt s ILE 341 Ca -0.01 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 59.65 1vrt s ILE 341 Cb -0.08 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.49 1vrt s ILE 341 CO 0.01 0.47 0.32 -0.72 0.00 0.00 0.00 174.94 175.01 1vrt s TYR 342 N 1.28 1.30 0.00 3.97 1.13 -0.01 0.34 117.35 125.36 1vrt s TYR 342 Ca 0.03 -1.41 0.00 0.00 -1.41 0.00 0.00 57.07 54.28 1vrt s TYR 342 Cb -0.14 -0.42 0.00 0.00 -1.10 0.00 0.00 41.96 40.30 1vrt s TYR 342 CO -0.12 -0.90 0.00 1.04 -2.51 0.00 0.00 175.55 173.06 1vrt n GLN 343 N -0.50 3.59 -4.72 -3.49 6.02 -1.26 0.73 117.38 117.75 1vrt n GLN 343 Ca 0.04 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.79 1vrt n GLN 343 Cb 0.63 -0.97 -0.15 0.00 1.02 0.00 0.00 30.24 30.76 1vrt n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1vrt s GLU 344 N -1.95 1.36 0.30 -1.09 2.12 -1.26 -4.90 118.70 113.29 1vrt s GLU 344 Ca 0.00 -0.54 -0.29 0.00 0.36 0.00 0.00 54.97 54.50 1vrt s GLU 344 Cb 0.00 -1.27 -0.13 0.00 0.26 0.00 0.00 34.13 32.99 1vrt s GLU 344 CO 0.00 0.29 1.19 -2.30 -0.54 0.00 0.00 175.26 173.90 1vrt n PRO 345 N 2.88 1.79 0.00 4.30 -0.02 -1.26 -2.18 135.00 140.51 1vrt n PRO 345 Ca -0.16 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1vrt n PRO 345 Cb 0.54 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1vrt n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1vrt n PHE 346 N 0.50 0.00 -3.48 6.00 3.72 -1.26 -4.86 117.46 118.08 1vrt n PHE 346 Ca 0.08 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.08 1vrt n PHE 346 Cb 0.34 -0.20 -0.04 0.00 -0.94 0.00 0.00 39.48 38.64 1vrt n PHE 346 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1vrt n LYS 347 N -1.89 3.10 -2.69 -1.08 5.02 -0.92 -4.90 118.16 114.80 1vrt n LYS 347 Ca 0.00 -4.48 -0.41 0.00 -2.02 0.00 0.00 58.31 51.39 1vrt n LYS 347 Cb 0.00 -2.47 -0.04 0.00 -0.02 0.00 0.00 35.03 32.51 1vrt n LYS 347 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1vrt s ASN 348 N 0.21 7.42 0.02 4.39 0.01 -1.26 -4.15 114.94 121.58 1vrt s ASN 348 Ca 0.30 1.80 -0.06 0.00 -0.71 0.00 0.00 52.86 54.19 1vrt s ASN 348 Cb -0.07 -2.58 -0.29 0.00 0.41 0.00 0.00 41.25 38.72 1vrt s ASN 348 CO -0.09 -0.15 0.94 -0.07 -1.51 0.00 0.00 177.10 176.22 1vrt h LEU 349 N 5.91 0.48 -7.30 0.60 3.38 -0.49 -3.48 115.31 114.41 1vrt h LEU 349 Ca -0.42 -0.60 -0.08 0.00 0.09 0.00 0.00 57.88 56.87 1vrt h LEU 349 Cb 1.21 -0.16 -0.17 0.00 0.09 0.00 0.00 40.66 41.63 1vrt h LEU 349 CO 0.73 1.48 -0.06 -0.75 0.09 0.00 0.00 178.44 179.94 1vrt s LYS 350 N -2.62 0.93 0.17 1.13 2.20 -0.98 -5.00 119.74 115.56 1vrt s LYS 350 Ca -0.08 -0.21 0.03 0.00 -0.36 0.00 0.00 55.97 55.35 1vrt s LYS 350 Cb 0.06 0.42 -0.05 0.00 -1.51 0.00 0.00 37.83 36.76 1vrt s LYS 350 CO 0.87 -0.31 -0.04 0.95 -0.36 0.00 0.00 175.35 176.46 1vrt s THR 351 N -2.09 0.91 0.01 3.43 -4.23 -1.26 -0.66 115.64 111.75 1vrt s THR 351 Ca -0.08 -2.01 -0.01 0.00 -1.18 0.00 0.00 61.69 58.41 1vrt s THR 351 Cb -0.01 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.81 1vrt s THR 351 CO 0.01 -0.58 0.06 0.61 -0.54 0.00 0.00 174.62 174.18 1vrt n GLY 352 N -0.24 1.35 3.23 3.99 0.00 -0.41 -3.54 105.19 109.57 1vrt n GLY 352 Ca -0.08 -0.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.87 1vrt n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vrt s LYS 353 N -2.00 0.68 -0.07 1.61 2.47 -1.26 -2.64 119.74 118.52 1vrt s LYS 353 Ca 0.01 -0.28 -0.03 0.00 -1.56 0.00 0.00 55.97 54.12 1vrt s LYS 353 Cb -0.00 0.30 0.04 0.00 -1.46 0.00 0.00 37.83 36.71 1vrt s LYS 353 CO 0.00 -0.19 0.15 -0.47 0.16 0.00 0.00 175.35 175.00 1vrt s TYR 354 N -1.59 -0.17 -0.09 4.03 6.14 0.32 -4.98 117.35 121.01 1vrt s TYR 354 Ca -0.12 0.53 -0.01 0.00 0.64 0.00 0.00 57.07 58.11 1vrt s TYR 354 Cb -0.04 -0.14 0.03 0.00 0.42 0.00 0.00 41.96 42.23 1vrt s TYR 354 CO 0.03 -0.20 -0.03 0.00 0.64 0.00 0.00 175.55 175.99 1vrt s ALA 355 N 1.52 0.94 0.00 3.97 0.00 -1.26 0.42 121.76 127.35 1vrt s ALA 355 Ca -0.05 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1vrt s ALA 355 Cb -0.12 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.19 1vrt s ALA 355 CO -0.06 -0.45 0.00 2.89 0.00 0.00 0.00 175.76 178.14 1vrt n ARG 356 N 5.07 0.00 0.00 0.00 1.85 0.09 -5.00 116.66 118.67 1vrt n ARG 356 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 1vrt n ARG 356 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 1vrt n ARG 356 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1vrt n THR 362 N 0.00 0.00 -4.11 8.89 -2.24 -1.26 -5.07 114.28 110.49 1vrt n THR 362 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1vrt n THR 362 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 1vrt n THR 362 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1vrt s ASN 363 N 0.00 0.26 0.26 3.42 2.20 -1.26 -5.08 114.94 114.74 1vrt s ASN 363 Ca 0.00 -1.14 -0.01 0.00 -0.94 0.00 0.00 52.86 50.77 1vrt s ASN 363 Cb 0.00 0.32 0.52 0.00 -2.00 0.00 0.00 41.25 40.09 1vrt s ASN 363 CO 0.00 -0.76 1.78 0.44 -2.94 0.00 0.00 177.10 175.62 1vrt h ASP 364 N 2.81 0.61 -0.27 3.54 5.19 -2.05 -2.35 116.42 123.89 1vrt h ASP 364 Ca -0.34 0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 56.10 1vrt h ASP 364 Cb 1.20 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.68 1vrt h ASP 364 CO 0.57 0.28 -0.02 0.58 -3.12 0.00 0.00 179.24 177.53 1vrt h VAL 365 N 0.70 1.27 -0.67 -1.35 2.07 -1.99 -0.93 116.25 115.35 1vrt h VAL 365 Ca 0.46 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 67.02 1vrt h VAL 365 Cb 0.59 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1vrt h VAL 365 CO -0.33 0.31 0.42 0.50 0.02 0.00 0.00 177.57 178.49 1vrt h LYS 366 N 0.27 0.80 -0.42 1.57 3.64 -1.90 -0.86 116.57 119.67 1vrt h LYS 366 Ca 0.07 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1vrt h LYS 366 Cb 0.46 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1vrt h LYS 366 CO 0.02 0.53 0.22 1.96 -2.27 0.00 0.00 179.45 179.91 1vrt h GLN 367 N 0.83 0.60 -0.64 1.90 4.20 -1.29 -2.15 115.11 118.57 1vrt h GLN 367 Ca 0.26 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.93 1vrt h GLN 367 Cb -0.00 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.62 1vrt h GLN 367 CO -0.10 0.49 0.39 1.25 -0.67 0.00 0.00 178.83 180.19 1vrt h LEU 368 N 0.55 0.62 -0.61 1.46 6.46 -0.52 -0.97 115.31 122.31 1vrt h LEU 368 Ca 0.15 0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.84 1vrt h LEU 368 Cb 0.08 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 39.86 1vrt h LEU 368 CO -0.02 0.43 0.08 0.71 -0.62 0.00 0.00 178.44 179.02 1vrt h THR 369 N 0.75 1.26 -0.19 1.05 1.35 -0.72 -0.73 112.91 115.69 1vrt h THR 369 Ca 0.26 -1.03 -0.06 0.00 -0.55 0.00 0.00 66.41 65.03 1vrt h THR 369 Cb 0.04 0.74 -0.01 0.00 -1.73 0.00 0.00 68.15 67.20 1vrt h THR 369 CO -0.11 0.38 -0.16 -0.33 -0.25 0.00 0.00 175.52 175.05 1vrt h GLU 370 N 0.92 0.32 -0.01 4.72 5.08 -1.12 -0.81 114.58 123.68 1vrt h GLU 370 Ca 0.18 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.30 1vrt h GLU 370 Cb 0.45 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1vrt h GLU 370 CO 0.02 0.48 -0.73 0.00 -1.00 0.00 0.00 179.01 177.77 1vrt h ALA 371 N 1.54 0.76 -0.19 3.43 0.00 -0.40 -2.08 119.26 122.32 1vrt h ALA 371 Ca 0.06 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 1vrt h ALA 371 Cb 0.46 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1vrt h ALA 371 CO 0.03 0.88 -0.27 0.28 0.00 0.00 0.00 179.25 180.17 1vrt h VAL 372 N 0.04 1.34 -0.62 0.00 2.07 -0.31 -0.68 116.25 118.09 1vrt h VAL 372 Ca -0.01 -1.47 -0.08 0.00 0.82 0.00 0.00 66.70 65.95 1vrt h VAL 372 Cb 1.30 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.87 1vrt h VAL 372 CO 0.10 0.45 0.08 1.56 0.02 0.00 0.00 177.57 179.78 1vrt h GLN 373 N 0.19 1.04 -0.13 1.57 4.20 -1.19 0.09 115.11 120.89 1vrt h GLN 373 Ca 0.02 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.42 1vrt h GLN 373 Cb 0.84 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 1vrt h GLN 373 CO 0.06 0.99 0.03 -0.22 -0.67 0.00 0.00 178.83 179.02 1vrt h LYS 374 N 0.95 0.21 -0.19 1.46 3.64 -1.31 -1.40 116.57 119.94 1vrt h LYS 374 Ca 0.19 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 1vrt h LYS 374 Cb 0.46 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1vrt h LYS 374 CO 0.02 0.37 -0.13 0.82 -2.27 0.00 0.00 179.45 178.27 1vrt h ILE 375 N 0.02 1.19 -0.22 2.00 2.04 -0.94 -2.11 117.51 119.50 1vrt h ILE 375 Ca 0.04 -0.85 -0.11 0.00 1.00 0.00 0.00 64.86 64.94 1vrt h ILE 375 Cb 0.26 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1vrt h ILE 375 CO 0.00 0.27 -0.28 0.74 0.00 0.00 0.00 178.15 178.89 1vrt h THR 376 N 0.30 1.33 -0.29 -0.27 2.02 -0.72 -1.98 112.91 113.29 1vrt h THR 376 Ca 0.06 -1.47 0.03 0.00 0.77 0.00 0.00 66.41 65.80 1vrt h THR 376 Cb 0.41 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.55 1vrt h THR 376 CO 0.02 0.45 0.11 0.74 0.37 0.00 0.00 175.52 177.21 1vrt h THR 377 N 0.25 0.93 -0.18 3.16 2.02 -1.01 -1.56 112.91 116.52 1vrt h THR 377 Ca 0.03 -0.08 0.05 0.00 0.77 0.00 0.00 66.41 67.18 1vrt h THR 377 Cb 0.85 0.67 -0.06 0.00 -1.74 0.00 0.00 68.15 67.86 1vrt h THR 377 CO 0.07 0.04 -0.26 -0.33 0.37 0.00 0.00 175.52 175.41 1vrt h GLU 378 N 0.24 -0.28 -0.81 6.66 5.08 -1.30 0.11 114.58 124.27 1vrt h GLU 378 Ca 0.13 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.61 1vrt h GLU 378 Cb 0.09 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.33 1vrt h GLU 378 CO -0.13 -0.19 0.45 0.77 -1.00 0.00 0.00 179.01 178.91 1vrt h SER 379 N -0.30 0.62 0.36 1.42 0.02 -0.95 0.16 113.55 114.89 1vrt h SER 379 Ca 0.12 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1vrt h SER 379 Cb 0.47 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1vrt h SER 379 CO -0.35 0.35 -0.18 0.40 -1.14 0.00 0.00 176.83 175.91 1vrt h ILE 380 N 0.74 0.64 -0.91 3.27 2.04 -0.12 0.24 117.51 123.40 1vrt h ILE 380 Ca 0.40 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.30 1vrt h ILE 380 Cb 0.39 0.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.05 1vrt h ILE 380 CO -0.26 0.00 0.60 0.58 0.00 0.00 0.00 178.15 179.07 1vrt h VAL 381 N -0.49 1.11 0.08 1.67 2.07 -0.14 0.62 116.25 121.17 1vrt h VAL 381 Ca -0.05 -0.38 -0.23 0.00 0.82 0.00 0.00 66.70 66.86 1vrt h VAL 381 Cb 0.38 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1vrt h VAL 381 CO 0.07 0.20 -1.19 0.40 0.02 0.00 0.00 177.57 177.07 1vrt h ILE 382 N 1.10 1.12 0.00 4.57 2.04 -0.53 -3.37 117.51 122.44 1vrt h ILE 382 Ca 0.38 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.87 1vrt h ILE 382 Cb 0.10 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1vrt h ILE 382 CO -0.13 0.63 -0.47 0.79 0.00 0.00 0.00 178.15 178.97 1vrt n TRP 383 N -4.09 0.00 -1.72 1.37 8.01 0.75 -4.95 117.44 116.80 1vrt n TRP 383 Ca -0.24 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 55.94 1vrt n TRP 383 Cb 0.81 -0.03 -0.00 0.00 -2.01 0.00 0.00 31.31 30.08 1vrt n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1vrt n GLY 384 N 1.36 0.37 3.21 6.99 0.00 0.21 -4.93 105.19 112.39 1vrt n GLY 384 Ca 0.01 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 1vrt n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vrt s LYS 385 N -3.47 0.88 -0.02 1.61 2.20 -1.23 -4.91 119.74 114.80 1vrt s LYS 385 Ca 0.00 -1.10 -0.02 0.00 -0.36 0.00 0.00 55.97 54.49 1vrt s LYS 385 Cb 0.00 0.32 -0.04 0.00 -1.51 0.00 0.00 37.83 36.60 1vrt s LYS 385 CO 0.00 -0.27 0.15 0.95 -0.36 0.00 0.00 175.35 175.82 1vrt s THR 386 N -3.91 5.23 0.68 3.43 -4.23 -1.26 -2.58 115.64 113.00 1vrt s THR 386 Ca 0.10 -0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 60.33 1vrt s THR 386 Cb 0.05 -3.42 0.04 0.00 1.34 0.00 0.00 72.50 70.52 1vrt s THR 386 CO -0.07 0.36 1.01 -2.84 -0.54 0.00 0.00 174.62 172.53 1vrt s PRO 387 N -1.80 2.49 -0.27 3.99 0.02 -1.26 -4.70 135.00 133.46 1vrt s PRO 387 Ca 0.25 -0.04 -0.11 0.00 0.02 0.00 0.00 61.00 61.12 1vrt s PRO 387 Cb -0.12 -2.16 -0.05 0.00 0.02 0.00 0.00 34.50 32.19 1vrt s PRO 387 CO 0.16 -1.08 0.18 0.21 -0.33 0.00 0.00 177.00 176.14 1vrt s LYS 388 N -5.22 3.96 0.28 5.54 2.36 0.28 -4.22 119.74 122.72 1vrt s LYS 388 Ca 0.58 -0.32 -0.08 0.00 -2.55 0.00 0.00 55.97 53.60 1vrt s LYS 388 Cb -0.11 -3.62 -0.06 0.00 -1.05 0.00 0.00 37.83 32.99 1vrt s LYS 388 CO 0.46 -0.13 0.59 -0.06 1.55 0.00 0.00 175.35 177.76 1vrt s PHE 389 N 1.62 3.45 -0.29 4.03 0.40 -0.51 -1.18 117.98 125.49 1vrt s PHE 389 Ca 0.07 0.83 0.03 0.00 -0.60 0.00 0.00 56.93 57.26 1vrt s PHE 389 Cb -0.15 -2.24 0.08 0.00 0.51 0.00 0.00 43.02 41.21 1vrt s PHE 389 CO 0.09 0.17 -0.03 0.15 0.70 0.00 0.00 175.22 176.31 1vrt s LYS 390 N -3.23 1.80 -0.19 0.44 1.02 0.02 -1.17 119.74 118.43 1vrt s LYS 390 Ca 0.47 -1.53 -0.09 0.00 0.02 0.00 0.00 55.97 54.85 1vrt s LYS 390 Cb -0.11 -2.96 -0.05 0.00 -0.52 0.00 0.00 37.83 34.20 1vrt s LYS 390 CO 0.26 -0.74 0.10 -0.51 -0.92 0.00 0.00 175.35 173.53 1vrt s LEU 391 N 1.07 4.03 -1.36 3.17 1.43 -0.36 -3.26 118.68 123.39 1vrt s LEU 391 Ca 0.00 0.17 -0.13 0.00 -1.03 0.00 0.00 54.13 53.14 1vrt s LEU 391 Cb -0.19 -2.03 0.09 0.00 0.03 0.00 0.00 46.19 44.09 1vrt s LEU 391 CO -0.07 0.19 1.99 -0.81 0.23 0.00 0.00 176.35 177.88 1vrt n PRO 392 N 3.43 3.16 -3.47 1.29 -0.04 -1.26 -1.52 135.00 136.59 1vrt n PRO 392 Ca -0.16 -3.06 -0.13 0.00 -0.04 0.00 0.00 63.50 60.10 1vrt n PRO 392 Cb 0.52 -3.20 -0.03 0.00 -0.04 0.00 0.00 33.50 30.74 1vrt n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1vrt s ILE 393 N 2.46 0.00 0.23 0.52 2.07 -1.26 -5.02 121.20 120.20 1vrt s ILE 393 Ca 0.46 0.00 -0.24 0.00 -1.41 0.00 0.00 60.65 59.46 1vrt s ILE 393 Cb 0.10 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.60 1vrt s ILE 393 CO -0.03 0.00 0.81 -1.10 -1.91 0.00 0.00 174.94 172.71 1vrt s GLN 394 N -2.75 4.47 0.18 3.50 -0.21 -1.26 -4.52 119.66 119.08 1vrt s GLN 394 Ca -0.02 1.11 -0.21 0.00 0.02 0.00 0.00 55.36 56.26 1vrt s GLN 394 Cb -0.01 -3.01 0.12 0.00 1.00 0.00 0.00 33.01 31.11 1vrt s GLN 394 CO -0.05 0.43 1.59 -0.22 -2.12 0.00 0.00 175.29 174.93 1vrt h LYS 395 N 3.70 -0.17 -0.73 2.91 3.64 -1.97 -1.68 116.57 122.27 1vrt h LYS 395 Ca -0.47 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.02 1vrt h LYS 395 Cb 1.20 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.01 1vrt h LYS 395 CO 0.66 -0.11 0.48 0.93 -2.27 0.00 0.00 179.45 179.13 1vrt h GLU 396 N -0.17 0.58 -0.04 1.90 3.07 -1.98 0.64 114.58 118.58 1vrt h GLU 396 Ca 0.22 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.99 1vrt h GLU 396 Cb 0.54 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1vrt h GLU 396 CO -0.65 0.39 -0.20 1.15 -1.40 0.00 0.00 179.01 178.30 1vrt h THR 397 N 0.60 1.48 0.82 1.13 2.02 -1.73 -2.73 112.91 114.49 1vrt h THR 397 Ca 0.34 -1.70 -0.04 0.00 0.77 0.00 0.00 66.41 65.78 1vrt h THR 397 Cb 0.50 2.48 0.01 0.00 -1.74 0.00 0.00 68.15 69.41 1vrt h THR 397 CO -0.12 0.47 -0.39 -0.25 0.37 0.00 0.00 175.52 175.60 1vrt h TRP 398 N -0.38 -1.02 -1.03 3.16 2.91 -0.65 -1.92 115.95 117.01 1vrt h TRP 398 Ca -0.01 -0.02 0.30 0.00 1.13 0.00 0.00 58.89 60.28 1vrt h TRP 398 Cb 0.87 0.34 -0.04 0.00 -0.51 0.00 0.00 29.16 29.81 1vrt h TRP 398 CO 0.15 -0.63 0.75 0.93 -1.03 0.00 0.00 178.44 178.60 1vrt h GLU 399 N -1.11 0.00 -0.01 2.65 4.39 0.15 -1.21 114.58 119.43 1vrt h GLU 399 Ca -0.11 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.54 1vrt h GLU 399 Cb 0.85 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.50 1vrt h GLU 399 CO 0.19 0.00 -0.18 1.15 -1.16 0.00 0.00 179.01 179.01 1vrt h THR 400 N 0.00 1.55 0.00 1.13 2.02 -1.12 -3.41 112.91 113.07 1vrt h THR 400 Ca 0.49 -1.85 0.00 0.00 0.77 0.00 0.00 66.41 65.82 1vrt h THR 400 Cb 1.99 2.72 0.00 0.00 -1.74 0.00 0.00 68.15 71.12 1vrt h THR 400 CO -0.01 0.50 -1.88 0.79 0.37 0.00 0.00 175.52 175.30 1vrt n TRP 401 N -4.57 0.00 -0.34 3.16 7.02 -0.68 -4.60 117.44 117.42 1vrt n TRP 401 Ca -0.09 0.00 0.20 0.00 -1.02 0.00 0.00 57.50 56.58 1vrt n TRP 401 Cb 0.46 -0.44 0.42 0.00 -2.42 0.00 0.00 31.31 29.33 1vrt n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 1vrt h TRP 402 N 0.00 0.93 0.00 -5.99 5.08 -1.49 0.41 115.95 114.89 1vrt h TRP 402 Ca 0.00 0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.00 1vrt h TRP 402 Cb 0.89 -0.27 0.00 0.00 -3.00 0.00 0.00 29.16 26.79 1vrt h TRP 402 CO 0.00 0.03 0.00 1.79 -1.28 0.00 0.00 178.44 178.98 1vrt h THR 403 N 0.51 0.00 -0.35 0.12 1.35 -1.85 0.10 112.91 112.79 1vrt h THR 403 Ca 0.65 -0.32 -0.08 0.00 -0.55 0.00 0.00 66.41 66.12 1vrt h THR 403 Cb 1.35 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 68.89 1vrt h THR 403 CO -0.46 0.00 -0.11 -0.33 -0.25 0.00 0.00 175.52 174.37 1vrt h GLU 404 N 0.00 0.61 -0.01 4.72 4.39 -1.21 -3.28 114.58 119.80 1vrt h GLU 404 Ca 0.00 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1vrt h GLU 404 Cb 0.41 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1vrt h GLU 404 CO 0.00 0.71 -0.07 0.66 -1.16 0.00 0.00 179.01 179.15 1vrt n TYR 405 N -4.19 0.00 -2.47 4.33 4.01 -0.72 -4.90 117.16 113.22 1vrt n TYR 405 Ca 0.01 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.36 1vrt n TYR 405 Cb 0.33 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.33 1vrt n TYR 405 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1vrt s TRP 406 N -0.82 3.42 0.00 -0.72 -0.11 0.28 -4.86 118.94 116.13 1vrt s TRP 406 Ca 0.07 1.66 0.00 0.00 1.22 0.00 0.00 56.10 59.05 1vrt s TRP 406 Cb 0.06 -3.25 0.00 0.00 -1.50 0.00 0.00 33.47 28.78 1vrt s TRP 406 CO 0.13 -0.67 0.00 1.04 -4.62 0.00 0.00 176.95 172.83 1vrt n GLN 407 N 0.65 2.94 -1.51 5.86 6.02 -1.26 -4.42 117.38 125.66 1vrt n GLN 407 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.69 1vrt n GLN 407 Cb 0.46 -0.35 0.06 0.00 1.02 0.00 0.00 30.24 31.44 1vrt n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vrt s ALA 408 N -0.43 2.48 -2.58 -1.58 0.00 -1.26 -4.95 121.76 113.44 1vrt s ALA 408 Ca 0.00 0.26 0.24 0.00 0.00 0.00 0.00 51.96 52.45 1vrt s ALA 408 Cb 0.00 -3.24 0.57 0.00 0.00 0.00 0.00 23.12 20.44 1vrt s ALA 408 CO 0.00 -1.42 1.47 0.25 0.00 0.00 0.00 175.76 176.06 1vrt n THR 409 N -3.09 0.19 -4.57 0.00 -2.24 -1.26 -4.91 114.28 98.40 1vrt n THR 409 Ca 0.09 -0.48 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 1vrt n THR 409 Cb 0.53 0.87 -0.11 0.00 -2.10 0.00 0.00 70.33 69.53 1vrt n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1vrt s TRP 410 N -1.81 2.51 -0.15 4.78 1.48 -1.26 -4.70 118.94 119.79 1vrt s TRP 410 Ca 0.34 -0.63 -0.04 0.00 -1.06 0.00 0.00 56.10 54.71 1vrt s TRP 410 Cb 0.20 -1.73 0.05 0.00 -1.16 0.00 0.00 33.47 30.84 1vrt s TRP 410 CO 0.30 0.45 0.08 0.42 -4.06 0.00 0.00 176.95 174.14 1vrt s ILE 411 N -2.68 -0.01 0.90 0.66 1.01 -1.26 -5.05 121.20 114.77 1vrt s ILE 411 Ca 0.35 -0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.77 1vrt s ILE 411 Cb 0.08 -0.56 0.13 0.00 0.01 0.00 0.00 42.46 42.12 1vrt s ILE 411 CO 0.18 -0.19 1.09 -2.16 0.00 0.00 0.00 174.94 173.87 1vrt s PRO 412 N 2.11 1.26 0.39 2.79 0.04 -1.26 -4.92 135.00 135.40 1vrt s PRO 412 Ca 0.02 0.73 -0.16 0.00 0.04 0.00 0.00 61.00 61.63 1vrt s PRO 412 Cb -0.15 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 1vrt s PRO 412 CO -0.08 -2.22 0.84 -1.21 0.04 0.00 0.00 177.00 174.37 1vrt s GLU 413 N -4.99 4.02 0.08 4.56 2.02 -1.26 -4.99 118.70 118.15 1vrt s GLU 413 Ca 0.63 0.80 -0.16 0.00 0.02 0.00 0.00 54.97 56.27 1vrt s GLU 413 Cb -0.17 -2.31 0.03 0.00 0.10 0.00 0.00 34.13 31.78 1vrt s GLU 413 CO 0.56 0.01 0.37 1.67 0.02 0.00 0.00 175.26 177.89 1vrt s TRP 414 N -2.20 -0.18 0.19 1.61 -2.14 -1.26 -1.42 118.94 113.55 1vrt s TRP 414 Ca 0.57 -0.04 0.02 0.00 2.66 0.00 0.00 56.10 59.31 1vrt s TRP 414 Cb -0.10 0.19 -0.05 0.00 -3.10 0.00 0.00 33.47 30.42 1vrt s TRP 414 CO 0.21 -0.62 0.02 -1.83 -2.66 0.00 0.00 176.95 172.07 1vrt s GLU 415 N -3.21 1.19 -0.12 3.25 -1.05 -0.31 -4.93 118.70 113.51 1vrt s GLU 415 Ca -0.01 -1.59 0.00 0.00 -0.15 0.00 0.00 54.97 53.23 1vrt s GLU 415 Cb 0.01 -0.31 -0.02 0.00 -0.44 0.00 0.00 34.13 33.38 1vrt s GLU 415 CO -0.08 -0.15 -0.13 -0.06 0.95 0.00 0.00 175.26 175.79 1vrt s PHE 416 N -3.65 2.81 0.28 4.83 0.08 -1.26 -1.23 117.98 119.85 1vrt s PHE 416 Ca 0.27 -0.58 0.04 0.00 0.12 0.00 0.00 56.93 56.78 1vrt s PHE 416 Cb 0.06 -1.83 -0.06 0.00 -0.57 0.00 0.00 43.02 40.63 1vrt s PHE 416 CO 0.06 -0.16 0.03 0.14 -0.10 0.00 0.00 175.22 175.19 1vrt s VAL 417 N 0.24 1.09 -0.63 -0.44 -7.23 -0.58 -4.91 120.40 107.95 1vrt s VAL 417 Ca -0.09 -2.02 -0.06 0.00 -1.81 0.00 0.00 61.98 58.00 1vrt s VAL 417 Cb -0.15 -2.60 0.16 0.00 0.56 0.00 0.00 36.38 34.35 1vrt s VAL 417 CO 0.05 -0.13 0.48 0.20 -0.31 0.00 0.00 175.10 175.39 1vrt s ASN 418 N -3.40 5.64 0.19 4.85 0.01 -1.26 -4.23 114.94 116.74 1vrt s ASN 418 Ca 0.33 -2.61 -0.33 0.00 -0.71 0.00 0.00 52.86 49.55 1vrt s ASN 418 Cb 0.07 -1.95 -0.14 0.00 0.41 0.00 0.00 41.25 39.64 1vrt s ASN 418 CO 0.13 -0.48 1.54 0.41 -1.51 0.00 0.00 177.10 177.18 1vrt n THR 419 N 3.90 0.31 -2.71 1.60 -1.04 -1.26 -4.97 114.28 110.12 1vrt n THR 419 Ca 0.06 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.05 61.57 1vrt n THR 419 Cb 0.40 -1.56 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 1vrt n THR 419 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1vrt s PRO 420 N 0.48 4.55 0.61 -2.82 0.02 -1.26 -4.96 135.00 131.62 1vrt s PRO 420 Ca 0.75 1.42 0.29 0.00 0.02 0.00 0.00 61.00 63.48 1vrt s PRO 420 Cb -0.65 -3.47 1.60 0.00 0.02 0.00 0.00 34.50 31.99 1vrt s PRO 420 CO 0.41 -0.07 1.98 -1.35 -0.33 0.00 0.00 177.00 177.64 1vrt h PRO 421 N 6.83 0.00 -0.20 5.54 0.11 -2.02 -2.25 132.00 140.00 1vrt h PRO 421 Ca -0.40 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.50 1vrt h PRO 421 Cb 1.21 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.33 1vrt h PRO 421 CO 0.76 0.00 -0.70 -0.07 -0.21 0.00 0.00 178.00 177.78 1vrt h LEU 422 N 0.00 0.96 -0.82 2.35 3.38 -2.01 -3.26 115.31 115.92 1vrt h LEU 422 Ca 0.12 -0.59 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 1vrt h LEU 422 Cb 0.81 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1vrt h LEU 422 CO -0.00 1.39 0.22 1.62 0.09 0.00 0.00 178.44 181.77 1vrt h VAL 423 N 0.59 1.26 -0.32 1.22 3.04 -1.81 -2.34 116.25 117.88 1vrt h VAL 423 Ca -0.03 -0.88 0.03 0.00 -1.01 0.00 0.00 66.70 64.81 1vrt h VAL 423 Cb 1.32 0.46 -0.03 0.00 -2.01 0.00 0.00 31.29 31.03 1vrt h VAL 423 CO 0.15 0.35 0.12 0.50 -1.01 0.00 0.00 177.57 177.68 1vrt h LYS 424 N 1.06 0.26 -0.49 4.17 3.64 -1.64 -2.30 116.57 121.27 1vrt h LYS 424 Ca 0.23 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.69 1vrt h LYS 424 Cb 0.29 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.98 1vrt h LYS 424 CO -0.01 0.17 0.05 1.25 -2.27 0.00 0.00 179.45 178.65 1vrt h LEU 425 N 0.27 -0.09 0.00 5.20 6.46 -1.54 -1.05 115.31 124.56 1vrt h LEU 425 Ca 0.14 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 1vrt h LEU 425 Cb 0.10 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 1vrt h LEU 425 CO -0.13 -0.02 0.00 0.79 -0.62 0.00 0.00 178.44 178.46 1vrt n TRP 426 N -5.17 0.00 -4.38 1.25 8.01 -0.88 -4.68 117.44 111.60 1vrt n TRP 426 Ca 0.05 0.00 -0.26 0.00 -1.31 0.00 0.00 57.50 55.99 1vrt n TRP 426 Cb 0.25 -0.20 -0.12 0.00 -2.01 0.00 0.00 31.31 29.23 1vrt n TRP 426 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 1vrt s TYR 427 N -2.41 2.13 0.00 -5.99 2.02 -0.40 -4.86 117.35 107.85 1vrt s TYR 427 Ca 0.14 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 1vrt s TYR 427 Cb 0.08 -1.09 0.00 0.00 -0.40 0.00 0.00 41.96 40.55 1vrt s TYR 427 CO 0.17 0.40 0.00 0.94 -1.57 0.00 0.00 175.55 175.49