#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f0k s SER 7 N 0.00 5.83 0.00 -1.43 0.01 -1.26 -4.76 113.70 112.09 3f0k s SER 7 Ca 0.00 1.53 0.10 0.00 1.31 0.00 0.00 55.95 58.89 3f0k s SER 7 Cb 0.00 -2.52 0.38 0.00 0.21 0.00 0.00 66.02 64.08 3f0k s SER 7 CO 0.00 -1.72 1.28 0.18 0.41 0.00 0.00 173.24 173.39 3f0k n LEU 8 N 10.44 1.10 0.25 2.44 4.77 -1.26 -3.94 117.00 130.81 3f0k n LEU 8 Ca 0.24 -0.53 0.08 0.00 -0.03 0.00 0.00 56.01 55.78 3f0k n LEU 8 Cb 0.46 -0.12 0.63 0.00 -2.33 0.00 0.00 43.42 42.06 3f0k n LEU 8 CO 0.67 0.27 1.01 0.71 -1.33 0.00 0.00 177.39 178.72 3f0k h THR 9 N 1.27 0.96 -0.01 -5.08 1.35 -2.06 -1.67 112.91 107.66 3f0k h THR 9 Ca 0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 3f0k h THR 9 Cb 0.29 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 3f0k h THR 9 CO 0.00 0.07 -0.02 0.59 -0.25 0.00 0.00 175.52 175.91 3f0k n ASN 10 N -4.31 1.23 -4.68 5.36 4.13 -1.25 -4.91 115.26 110.83 3f0k n ASN 10 Ca -0.03 -1.37 -0.42 0.00 1.68 0.00 0.00 54.58 54.44 3f0k n ASN 10 Cb 0.15 0.01 -0.03 0.00 -1.54 0.00 0.00 39.78 38.37 3f0k n ASN 10 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3f0k s SER 11 N -2.04 6.86 0.27 6.41 0.15 -0.63 -4.92 113.70 119.80 3f0k s SER 11 Ca 0.38 2.05 0.03 0.00 0.70 0.00 0.00 55.95 59.12 3f0k s SER 11 Cb 0.21 -2.56 0.37 0.00 -1.71 0.00 0.00 66.02 62.33 3f0k s SER 11 CO 0.35 -0.73 1.67 0.77 1.20 0.00 0.00 173.24 176.51 3f0k h SER 12 N 7.97 0.40 0.37 5.45 4.64 -1.91 -3.31 113.55 127.17 3f0k h SER 12 Ca -0.37 -0.17 -0.32 0.00 -0.47 0.00 0.00 61.79 60.47 3f0k h SER 12 Cb 1.17 -0.11 0.03 0.00 -0.31 0.00 0.00 62.40 63.18 3f0k h SER 12 CO 0.91 0.75 -1.42 -0.07 -0.87 0.00 0.00 176.83 176.13 3f0k h LEU 13 N 0.32 0.73 -0.70 5.97 3.38 -1.97 -3.39 115.31 119.66 3f0k h LEU 13 Ca 0.03 -0.78 0.14 0.00 0.09 0.00 0.00 57.88 57.36 3f0k h LEU 13 Cb 0.82 -0.24 -0.13 0.00 0.09 0.00 0.00 40.66 41.20 3f0k h LEU 13 CO 0.07 1.61 -0.20 0.24 0.09 0.00 0.00 178.44 180.25 3f0k h MET 14 N 0.13 -0.02 0.00 1.13 2.86 -1.91 0.24 114.93 117.37 3f0k h MET 14 Ca -0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3f0k h MET 14 Cb 2.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.78 3f0k h MET 14 CO 0.26 -0.01 0.02 -1.35 1.06 0.00 0.00 176.91 176.89 3f0k h PRO 15 N -0.02 0.00 -0.19 -0.22 0.11 -1.77 -2.20 132.00 127.70 3f0k h PRO 15 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 3f0k h PRO 15 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 3f0k h PRO 15 CO -0.73 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.31 3f0k n THR 16 N -2.76 0.44 -3.07 -1.15 -2.24 0.06 -5.00 114.28 100.56 3f0k n THR 16 Ca -0.02 -0.72 -0.30 0.00 -2.27 0.00 0.00 64.05 60.74 3f0k n THR 16 Cb 0.08 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.21 3f0k n THR 16 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3f0k s LEU 17 N -1.07 3.94 0.21 3.22 1.43 -0.83 -5.03 118.68 120.54 3f0k s LEU 17 Ca 0.21 0.98 -0.29 0.00 -1.03 0.00 0.00 54.13 54.01 3f0k s LEU 17 Cb 0.13 -3.83 -0.17 0.00 0.03 0.00 0.00 46.19 42.35 3f0k s LEU 17 CO 0.18 -0.30 0.63 -3.20 0.23 0.00 0.00 176.35 173.89 3f0k n ASN 18 N -1.05 -0.74 -0.19 2.29 2.85 -1.26 -4.65 115.26 112.50 3f0k n ASN 18 Ca 0.01 1.14 -0.00 0.00 -0.11 0.00 0.00 54.58 55.62 3f0k n ASN 18 Cb 0.54 -1.01 0.24 0.00 1.24 0.00 0.00 39.78 40.79 3f0k n ASN 18 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3f0k h PRO 19 N 1.29 0.94 -0.57 1.20 0.11 -1.97 -0.16 132.00 132.83 3f0k h PRO 19 Ca -0.31 -0.08 -0.11 0.00 0.11 0.00 0.00 66.00 65.61 3f0k h PRO 19 Cb 1.42 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 3f0k h PRO 19 CO 0.58 0.67 -0.06 1.98 -0.21 0.00 0.00 178.00 180.96 3f0k h MET 20 N 0.96 1.05 -0.50 1.05 4.05 -1.98 -1.30 114.93 118.26 3f0k h MET 20 Ca 0.25 -0.36 0.05 0.00 -0.28 0.00 0.00 59.70 59.36 3f0k h MET 20 Cb -0.03 -0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 30.64 3f0k h MET 20 CO -0.05 1.06 0.23 0.82 0.23 0.00 0.00 176.91 179.20 3f0k h ILE 21 N 0.94 0.92 -0.38 1.77 2.04 -1.63 -0.56 117.51 120.61 3f0k h ILE 21 Ca 0.16 -0.16 0.03 0.00 1.00 0.00 0.00 64.86 65.89 3f0k h ILE 21 Cb 0.62 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3f0k h ILE 21 CO 0.04 0.08 0.18 1.56 0.00 0.00 0.00 178.15 180.01 3f0k h GLN 22 N 0.45 0.35 -0.36 2.37 4.20 -0.75 -0.46 115.11 120.92 3f0k h GLN 22 Ca 0.23 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.86 3f0k h GLN 22 Cb 0.17 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 3f0k h GLN 22 CO -0.18 0.23 -0.01 1.96 -0.67 0.00 0.00 178.83 180.17 3f0k h GLN 23 N 0.36 0.57 -0.36 1.46 1.08 -0.84 -1.08 115.11 116.30 3f0k h GLN 23 Ca 0.16 -0.13 -0.15 0.00 -1.45 0.00 0.00 58.65 57.09 3f0k h GLN 23 Cb 0.09 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 3f0k h GLN 23 CO -0.13 0.60 -0.36 -0.07 -0.95 0.00 0.00 178.83 177.92 3f0k h LEU 24 N 0.54 0.89 -0.51 1.46 3.38 -0.69 -0.96 115.31 119.42 3f0k h LEU 24 Ca 0.11 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 3f0k h LEU 24 Cb 0.36 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3f0k h LEU 24 CO 0.01 1.15 0.20 0.00 0.09 0.00 0.00 178.44 179.90 3f0k h ALA 25 N 0.89 0.66 -0.71 1.53 0.00 -0.78 0.39 119.26 121.25 3f0k h ALA 25 Ca 0.06 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3f0k h ALA 25 Cb 0.92 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3f0k h ALA 25 CO 0.09 0.27 0.19 1.25 0.00 0.00 0.00 179.25 181.05 3f0k h LEU 26 N 0.69 1.06 -0.72 0.00 5.85 -1.04 -0.67 115.31 120.48 3f0k h LEU 26 Ca 0.17 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3f0k h LEU 26 Cb 0.20 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3f0k h LEU 26 CO -0.01 1.01 0.37 0.00 -0.34 0.00 0.00 178.44 179.47 3f0k h ALA 27 N 1.09 0.93 -0.05 1.25 0.00 -0.56 0.42 119.26 122.34 3f0k h ALA 27 Ca 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3f0k h ALA 27 Cb 0.35 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3f0k h ALA 27 CO -0.00 0.46 -0.04 0.82 0.00 0.00 0.00 179.25 180.49 3f0k h ILE 28 N 1.00 1.35 -0.85 0.00 2.04 -0.68 -1.59 117.51 118.78 3f0k h ILE 28 Ca 0.25 -1.10 0.12 0.00 1.00 0.00 0.00 64.86 65.13 3f0k h ILE 28 Cb 0.07 1.97 -0.08 0.00 -0.74 0.00 0.00 36.82 38.04 3f0k h ILE 28 CO -0.04 0.30 0.47 0.00 0.00 0.00 0.00 178.15 178.89 3f0k h ALA 29 N 0.59 1.25 -0.42 1.87 0.00 -1.05 -1.60 119.26 119.90 3f0k h ALA 29 Ca 0.01 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3f0k h ALA 29 Cb 0.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3f0k h ALA 29 CO 0.01 0.03 0.02 0.00 0.00 0.00 0.00 179.25 179.30 3f0k h ALA 30 N 1.51 1.25 -0.22 0.00 0.00 -0.81 -0.35 119.26 120.64 3f0k h ALA 30 Ca 0.43 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3f0k h ALA 30 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3f0k h ALA 30 CO -0.30 0.50 -0.36 0.66 0.00 0.00 0.00 179.25 179.75 3f0k h SER 31 N 0.63 0.50 1.58 0.00 4.64 -0.39 -3.14 113.55 117.38 3f0k h SER 31 Ca 0.13 -0.20 -0.02 0.00 -0.47 0.00 0.00 61.79 61.23 3f0k h SER 31 Cb 0.37 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3f0k h SER 31 CO 0.01 0.82 -0.42 -0.50 -0.87 0.00 0.00 176.83 175.87 3f0k h TRP 32 N 0.40 0.00 -0.55 4.77 6.55 -0.81 -3.42 115.95 122.89 3f0k h TRP 32 Ca 0.04 0.00 0.04 0.00 0.95 0.00 0.00 58.89 59.93 3f0k h TRP 32 Cb 0.82 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 29.09 3f0k h TRP 32 CO 0.03 0.08 0.37 -0.56 -1.05 0.00 0.00 178.44 177.30 3f0k h GLN 33 N 0.00 0.57 -0.58 0.49 3.07 -1.02 -1.91 115.11 115.74 3f0k h GLN 33 Ca -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 58.70 3f0k h GLN 33 Cb 1.07 -0.13 0.00 0.00 0.08 0.00 0.00 27.48 28.50 3f0k h GLN 33 CO 0.01 0.38 0.00 0.43 0.09 0.00 0.00 178.83 179.74 3f0k n SER 34 N -4.47 3.59 -4.81 0.06 7.64 -1.26 -4.97 113.62 109.39 3f0k n SER 34 Ca 0.07 -1.99 -0.30 0.00 1.01 0.00 0.00 58.87 57.66 3f0k n SER 34 Cb 0.18 -0.38 0.09 0.00 -1.01 0.00 0.00 64.21 63.09 3f0k n SER 34 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3f0k s LEU 35 N -1.05 2.54 -1.38 -3.43 1.43 -0.72 -4.91 118.68 111.16 3f0k s LEU 35 Ca 0.40 1.22 -0.15 0.00 -1.03 0.00 0.00 54.13 54.58 3f0k s LEU 35 Cb 0.21 -3.81 0.07 0.00 0.03 0.00 0.00 46.19 42.69 3f0k s LEU 35 CO 0.28 -2.00 2.01 -0.81 0.23 0.00 0.00 176.35 176.06 3f0k n PRO 36 N -3.44 3.06 -2.82 1.29 -0.04 -1.26 -4.93 135.00 126.86 3f0k n PRO 36 Ca 0.07 -2.96 -0.35 0.00 -0.04 0.00 0.00 63.50 60.22 3f0k n PRO 36 Cb 0.57 -3.31 -0.07 0.00 -0.04 0.00 0.00 33.50 30.65 3f0k n PRO 36 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3f0k s LEU 37 N 2.57 4.11 0.09 1.53 1.43 -1.26 -4.50 118.68 122.65 3f0k s LEU 37 Ca 0.48 1.73 0.02 0.00 -1.03 0.00 0.00 54.13 55.34 3f0k s LEU 37 Cb 0.10 -4.31 -0.04 0.00 0.03 0.00 0.00 46.19 41.97 3f0k s LEU 37 CO -0.02 -0.24 -0.07 -0.54 0.23 0.00 0.00 176.35 175.71 3f0k s LYS 38 N -2.71 0.82 0.66 1.70 1.02 -0.31 -4.97 119.74 115.94 3f0k s LYS 38 Ca 0.57 -1.26 -0.16 0.00 0.02 0.00 0.00 55.97 55.15 3f0k s LYS 38 Cb -0.13 -0.28 -0.00 0.00 -0.52 0.00 0.00 37.83 36.91 3f0k s LYS 38 CO 0.17 0.01 1.13 -2.14 -0.92 0.00 0.00 175.35 173.60 3f0k s PRO 39 N -3.46 2.74 -0.19 -1.68 0.02 -1.26 -0.62 135.00 130.54 3f0k s PRO 39 Ca 0.09 1.50 0.01 0.00 0.02 0.00 0.00 61.00 62.61 3f0k s PRO 39 Cb 0.02 -1.93 0.02 0.00 0.02 0.00 0.00 34.50 32.63 3f0k s PRO 39 CO -0.03 -1.32 -0.17 -0.47 -0.33 0.00 0.00 177.00 174.68 3f0k s TYR 40 N -2.19 2.85 -0.34 6.54 5.04 -0.78 -4.52 117.35 123.95 3f0k s TYR 40 Ca 0.69 -1.64 -0.29 0.00 -2.44 0.00 0.00 57.07 53.39 3f0k s TYR 40 Cb -0.23 -1.94 0.01 0.00 0.35 0.00 0.00 41.96 40.15 3f0k s TYR 40 CO 0.40 -0.79 1.16 -1.14 -1.34 0.00 0.00 175.55 173.84 3f0k s GLN 41 N 1.29 3.96 0.97 4.97 0.74 -1.26 -4.62 119.66 125.71 3f0k s GLN 41 Ca 0.04 1.03 -0.12 0.00 0.05 0.00 0.00 55.36 56.36 3f0k s GLN 41 Cb -0.14 -3.81 0.17 0.00 1.10 0.00 0.00 33.01 30.33 3f0k s GLN 41 CO -0.11 -1.06 1.09 -0.51 -0.55 0.00 0.00 175.29 174.14 3f0k s LEU 42 N 4.03 1.85 0.37 3.68 1.43 -1.26 -4.85 118.68 123.93 3f0k s LEU 42 Ca 0.49 1.43 -0.26 0.00 -1.03 0.00 0.00 54.13 54.76 3f0k s LEU 42 Cb -0.13 -3.69 -0.12 0.00 0.03 0.00 0.00 46.19 42.29 3f0k s LEU 42 CO 0.21 -3.07 1.02 -2.65 0.23 0.00 0.00 176.35 172.09 3f0k n PRO 43 N -4.16 1.41 -1.74 1.29 -0.02 -1.26 -0.50 135.00 130.02 3f0k n PRO 43 Ca 0.06 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.91 3f0k n PRO 43 Cb 0.56 -1.99 -0.04 0.00 -0.02 0.00 0.00 33.50 32.00 3f0k n PRO 43 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3f0k n GLU 44 N 0.39 -1.58 -4.00 -0.52 1.02 -1.26 -1.86 120.64 112.83 3f0k n GLU 44 Ca 0.09 0.76 -0.29 0.00 -0.02 0.00 0.00 57.16 57.69 3f0k n GLU 44 Cb 0.37 -5.13 -0.01 0.00 -0.02 0.00 0.00 31.44 26.65 3f0k n GLU 44 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3f0k n ASP 45 N -0.97 -2.41 -4.74 1.62 2.03 0.34 -4.85 116.55 107.56 3f0k n ASP 45 Ca -0.14 -0.93 -0.42 0.00 0.52 0.00 0.00 54.79 53.81 3f0k n ASP 45 Cb 0.51 -3.27 -0.01 0.00 -0.72 0.00 0.00 41.12 37.62 3f0k n ASP 45 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 3f0k n LEU 46 N -4.45 4.26 0.00 -2.67 7.94 -0.78 -4.87 117.00 116.44 3f0k n LEU 46 Ca -0.11 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 3f0k n LEU 46 Cb 0.59 -1.58 0.00 0.00 0.53 0.00 0.00 43.42 42.96 3f0k n LEU 46 CO 0.78 0.07 0.00 0.61 -1.11 0.00 0.00 177.39 177.74 3f0k n GLY 47 N 1.90 1.40 3.77 -3.96 0.00 -1.26 -4.64 105.19 102.40 3f0k n GLY 47 Ca 0.08 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3f0k n GLY 47 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3f0k s TYR 48 N 1.32 3.93 -0.04 1.61 6.14 -1.26 -1.62 117.35 127.44 3f0k s TYR 48 Ca 0.00 1.73 -0.10 0.00 0.64 0.00 0.00 57.07 59.35 3f0k s TYR 48 Cb 0.00 -2.85 0.02 0.00 0.42 0.00 0.00 41.96 39.55 3f0k s TYR 48 CO 0.00 0.48 0.22 0.54 0.64 0.00 0.00 175.55 177.43 3f0k s VAL 49 N -1.10 0.04 -0.00 3.14 0.11 -0.23 -5.00 120.40 117.37 3f0k s VAL 49 Ca 0.38 -0.37 -0.07 0.00 -2.93 0.00 0.00 61.98 58.99 3f0k s VAL 49 Cb -0.24 -0.44 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 3f0k s VAL 49 CO 0.28 -0.20 0.13 -0.70 -3.33 0.00 0.00 175.10 171.28 3f0k s GLU 50 N -0.79 0.46 0.04 1.54 2.12 -1.26 -0.68 118.70 120.12 3f0k s GLU 50 Ca -0.09 -0.37 -0.25 0.00 0.36 0.00 0.00 54.97 54.63 3f0k s GLU 50 Cb -0.05 0.19 0.06 0.00 0.26 0.00 0.00 34.13 34.59 3f0k s GLU 50 CO 0.02 -0.11 0.57 0.20 -0.54 0.00 0.00 175.26 175.41 3f0k s GLY 51 N -1.29 -0.50 -0.04 -1.50 0.00 -0.44 -5.00 107.32 98.55 3f0k s GLY 51 Ca -0.14 0.77 -0.09 0.00 0.00 0.00 0.00 44.72 45.26 3f0k s GLY 51 CO 0.01 0.45 0.21 -1.60 0.00 0.00 0.00 173.10 172.17 3f0k s ARG 52 N -2.32 0.42 0.00 2.90 3.52 -1.06 -0.95 118.95 121.46 3f0k s ARG 52 Ca -0.06 -0.05 0.00 0.00 -0.13 0.00 0.00 55.73 55.49 3f0k s ARG 52 Cb -0.01 0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.57 3f0k s ARG 52 CO -0.00 -0.09 0.00 1.28 -0.81 0.00 0.00 175.30 175.67 3f0k n LEU 53 N 2.07 0.00 -0.66 -0.88 4.77 -1.19 -4.87 117.00 116.25 3f0k n LEU 53 Ca -0.18 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 55.92 3f0k n LEU 53 Cb 0.57 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.88 3f0k n LEU 53 CO 0.20 0.00 0.63 -0.62 -1.33 0.00 0.00 177.39 176.28 3f0k n GLU 54 N 0.00 1.76 0.00 3.23 -0.58 -1.26 -4.93 120.64 118.86 3f0k n GLU 54 Ca 0.00 -1.33 0.00 0.00 -0.42 0.00 0.00 57.16 55.41 3f0k n GLU 54 Cb 0.00 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 3f0k n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3f0k n GLY 55 N 1.32 3.47 3.86 0.62 0.00 -1.26 -5.14 105.19 108.07 3f0k n GLY 55 Ca 0.14 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 3f0k n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f0k s GLU 56 N 3.55 3.75 0.17 1.61 0.41 -1.26 -5.02 118.70 121.91 3f0k s GLU 56 Ca 0.00 0.73 -0.17 0.00 -0.41 0.00 0.00 54.97 55.12 3f0k s GLU 56 Cb 0.00 -2.18 -0.07 0.00 -1.78 0.00 0.00 34.13 30.10 3f0k s GLU 56 CO 0.00 -0.34 0.61 0.21 -0.49 0.00 0.00 175.26 175.25 3f0k s LYS 57 N -4.52 4.10 -0.15 1.61 2.20 -1.26 -4.55 119.74 117.16 3f0k s LYS 57 Ca 0.55 0.65 -0.03 0.00 -0.36 0.00 0.00 55.97 56.78 3f0k s LYS 57 Cb -0.10 -2.94 -0.02 0.00 -1.51 0.00 0.00 37.83 33.25 3f0k s LYS 57 CO 0.41 0.46 -0.06 -1.17 -0.36 0.00 0.00 175.35 174.63 3f0k s LEU 58 N -1.89 3.12 -0.02 5.43 2.96 -0.12 -0.34 118.68 127.81 3f0k s LEU 58 Ca 0.39 -0.18 0.07 0.00 -0.22 0.00 0.00 54.13 54.19 3f0k s LEU 58 Cb -0.16 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 3f0k s LEU 58 CO 0.20 0.17 -0.25 -0.69 -1.32 0.00 0.00 176.35 174.46 3f0k s VAL 59 N 0.36 1.95 -0.02 1.68 1.01 -0.21 -1.33 120.40 123.85 3f0k s VAL 59 Ca -0.06 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 60.87 3f0k s VAL 59 Cb -0.15 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.62 3f0k s VAL 59 CO 0.04 0.55 -0.01 -0.63 0.00 0.00 0.00 175.10 175.05 3f0k s ILE 60 N -0.52 0.17 -0.22 2.22 1.01 0.14 -1.29 121.20 122.71 3f0k s ILE 60 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 60.65 60.69 3f0k s ILE 60 Cb -0.10 -0.21 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 3f0k s ILE 60 CO -0.00 0.10 -0.03 -1.61 0.00 0.00 0.00 174.94 173.40 3f0k s GLU 61 N 0.51 3.45 -0.17 2.79 2.02 0.01 -1.07 118.70 126.24 3f0k s GLU 61 Ca -0.05 -0.59 -0.08 0.00 0.02 0.00 0.00 54.97 54.27 3f0k s GLU 61 Cb -0.08 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.07 3f0k s GLU 61 CO -0.01 -0.14 0.11 -0.80 0.02 0.00 0.00 175.26 174.44 3f0k s ASN 62 N 1.36 6.05 -0.04 -0.19 0.01 -0.64 -1.90 114.94 119.59 3f0k s ASN 62 Ca 0.04 0.24 0.05 0.00 -0.71 0.00 0.00 52.86 52.48 3f0k s ASN 62 Cb -0.14 -2.02 -0.01 0.00 0.41 0.00 0.00 41.25 39.49 3f0k s ASN 62 CO -0.01 0.24 -0.18 -0.13 -1.51 0.00 0.00 177.10 175.51 3f0k s ARG 63 N -0.03 1.77 -0.15 -0.60 0.52 -0.11 -4.67 118.95 115.69 3f0k s ARG 63 Ca 0.09 -0.63 -0.10 0.00 -0.52 0.00 0.00 55.73 54.57 3f0k s ARG 63 Cb -0.12 -1.56 0.05 0.00 0.52 0.00 0.00 34.95 33.84 3f0k s ARG 63 CO 0.00 0.27 0.37 0.00 0.02 0.00 0.00 175.30 175.97 3f0k s TYR 65 N 1.08 1.76 0.10 0.00 2.02 -0.12 -1.87 117.35 120.32 3f0k s TYR 65 Ca -0.07 -1.35 -0.11 0.00 -0.37 0.00 0.00 57.07 55.17 3f0k s TYR 65 Cb -0.07 -1.06 0.01 0.00 -0.40 0.00 0.00 41.96 40.44 3f0k s TYR 65 CO -0.09 -0.40 0.25 1.14 -1.57 0.00 0.00 175.55 174.88 3f0k s GLN 66 N -3.69 0.91 0.32 -0.62 -2.07 0.21 -0.08 119.66 114.65 3f0k s GLN 66 Ca 0.28 -0.88 0.05 0.00 -1.82 0.00 0.00 55.36 52.98 3f0k s GLN 66 Cb 0.03 0.38 -0.03 0.00 -1.09 0.00 0.00 33.01 32.30 3f0k s GLN 66 CO 0.17 -0.31 0.29 0.95 -1.32 0.00 0.00 175.29 175.06 3f0k s THR 67 N -3.84 0.00 0.47 3.63 -4.23 -0.31 -1.16 115.64 110.19 3f0k s THR 67 Ca 0.04 -1.95 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 3f0k s THR 67 Cb 0.04 -2.52 0.30 0.00 1.34 0.00 0.00 72.50 71.67 3f0k s THR 67 CO -0.11 0.00 2.12 -0.65 -0.54 0.00 0.00 174.62 175.44 3f0k h PRO 68 N 2.18 0.00 0.00 3.99 0.11 -2.00 -2.77 132.00 133.51 3f0k h PRO 68 Ca -0.26 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.74 3f0k h PRO 68 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3f0k h PRO 68 CO 0.38 0.09 -1.68 1.04 -0.21 0.00 0.00 178.00 177.62 3f0k n GLN 69 N -3.76 0.64 -4.06 1.05 3.00 -1.26 -4.76 117.38 108.24 3f0k n GLN 69 Ca -0.02 0.02 -0.32 0.00 -0.01 0.00 0.00 57.00 56.67 3f0k n GLN 69 Cb 0.19 -1.67 -0.15 0.00 0.00 0.00 0.00 30.24 28.61 3f0k n GLN 69 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 3f0k s PHE 70 N -3.15 3.12 0.27 1.08 0.40 -1.05 -0.65 117.98 118.00 3f0k s PHE 70 Ca -0.05 -2.20 -0.01 0.00 -0.60 0.00 0.00 56.93 54.06 3f0k s PHE 70 Cb 0.10 -1.88 0.46 0.00 0.51 0.00 0.00 43.02 42.21 3f0k s PHE 70 CO 0.84 -0.86 1.85 -0.09 0.70 0.00 0.00 175.22 177.66 3f0k h ARG 71 N 7.81 0.99 -2.22 0.44 2.43 -0.74 -0.82 114.38 122.27 3f0k h ARG 71 Ca -0.21 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 3f0k h ARG 71 Cb 1.05 -0.22 -0.23 0.00 -0.42 0.00 0.00 29.97 30.15 3f0k h ARG 71 CO 0.47 0.66 -0.12 0.21 -1.51 0.00 0.00 179.97 179.67 3f0k s LYS 72 N -6.00 0.57 -0.29 0.20 2.20 -1.12 -4.66 119.74 110.64 3f0k s LYS 72 Ca -0.12 1.13 0.02 0.00 -0.36 0.00 0.00 55.97 56.64 3f0k s LYS 72 Cb 0.21 0.22 0.08 0.00 -1.51 0.00 0.00 37.83 36.83 3f0k s LYS 72 CO 0.80 -0.17 -0.01 -1.64 -0.36 0.00 0.00 175.35 173.98 3f0k s MET 73 N 1.84 1.60 -0.15 4.03 -1.94 0.89 -0.28 119.30 125.29 3f0k s MET 73 Ca -0.09 -1.42 -0.01 0.00 -1.71 0.00 0.00 55.69 52.46 3f0k s MET 73 Cb -0.08 -2.82 -0.01 0.00 2.01 0.00 0.00 34.83 33.93 3f0k s MET 73 CO -0.17 -0.77 -0.12 -1.58 -0.01 0.00 0.00 175.02 172.37 3f0k s HIS 74 N 1.17 2.84 -0.15 -0.03 5.04 0.04 -0.94 115.29 123.25 3f0k s HIS 74 Ca 0.02 -0.80 0.00 0.00 -1.54 0.00 0.00 55.06 52.74 3f0k s HIS 74 Cb -0.19 -1.91 0.03 0.00 0.04 0.00 0.00 32.58 30.55 3f0k s HIS 74 CO -0.09 -0.34 -0.11 -1.17 -2.34 0.00 0.00 174.74 170.69 3f0k s LEU 75 N 0.68 1.67 -0.06 8.88 2.96 -0.16 -1.78 118.68 130.86 3f0k s LEU 75 Ca -0.06 -0.54 0.03 0.00 -0.22 0.00 0.00 54.13 53.34 3f0k s LEU 75 Cb -0.15 -1.08 -0.03 0.00 0.50 0.00 0.00 46.19 45.43 3f0k s LEU 75 CO 0.02 -0.10 -0.12 -1.61 -1.32 0.00 0.00 176.35 173.22 3f0k s GLU 76 N 1.54 2.65 -0.07 1.98 2.02 0.36 -0.93 118.70 126.24 3f0k s GLU 76 Ca 0.03 -0.66 0.04 0.00 0.02 0.00 0.00 54.97 54.41 3f0k s GLU 76 Cb -0.14 -2.46 -0.02 0.00 0.10 0.00 0.00 34.13 31.62 3f0k s GLU 76 CO -0.09 0.60 -0.18 -0.51 0.02 0.00 0.00 175.26 175.09 3f0k s LEU 77 N -0.65 2.49 0.05 1.80 1.43 -0.80 -0.99 118.68 122.00 3f0k s LEU 77 Ca 0.10 -0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 52.81 3f0k s LEU 77 Cb -0.11 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 3f0k s LEU 77 CO 0.01 0.27 0.09 0.00 0.23 0.00 0.00 176.35 176.96 3f0k s ALA 78 N -0.30 0.00 -0.01 4.21 0.00 0.12 -0.81 121.76 124.96 3f0k s ALA 78 Ca 0.02 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.31 3f0k s ALA 78 Cb -0.13 0.30 0.01 0.00 0.00 0.00 0.00 23.12 23.30 3f0k s ALA 78 CO 0.03 -0.37 -0.02 0.15 0.00 0.00 0.00 175.76 175.55 3f0k s LYS 79 N -3.09 0.33 -0.27 0.00 1.02 -0.41 -0.89 119.74 116.42 3f0k s LYS 79 Ca -0.01 -0.06 -0.08 0.00 0.02 0.00 0.00 55.97 55.84 3f0k s LYS 79 Cb 0.02 -0.38 -0.02 0.00 -0.52 0.00 0.00 37.83 36.92 3f0k s LYS 79 CO -0.07 -0.00 0.10 0.08 -0.92 0.00 0.00 175.35 174.54 3f0k s VAL 80 N 0.34 4.42 0.00 3.17 1.01 0.93 -1.04 120.40 129.23 3f0k s VAL 80 Ca -0.03 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.66 3f0k s VAL 80 Cb -0.06 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3f0k s VAL 80 CO -0.01 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.93 3f0k n GLY 81 N 4.94 2.26 0.87 4.51 0.00 0.54 -2.22 105.19 116.09 3f0k n GLY 81 Ca -0.15 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.74 3f0k n GLY 81 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3f0k n LYS 82 N 14.00 2.08 -0.01 1.61 0.00 -1.26 -4.62 118.16 129.96 3f0k n LYS 82 Ca 0.00 -1.94 0.03 0.00 0.00 0.00 0.00 58.31 56.40 3f0k n LYS 82 Cb 0.00 -1.39 0.04 0.00 0.00 0.00 0.00 35.03 33.68 3f0k n LYS 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3f0k n GLY 83 N 1.10 -0.29 3.44 3.14 0.00 -0.94 -4.83 105.19 106.81 3f0k n GLY 83 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 3f0k n GLY 83 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3f0k s LEU 84 N -0.64 -1.08 -0.00 0.99 2.96 -1.10 -4.15 118.68 115.66 3f0k s LEU 84 Ca 0.09 1.26 0.05 0.00 -0.22 0.00 0.00 54.13 55.30 3f0k s LEU 84 Cb 0.06 2.04 -0.03 0.00 0.50 0.00 0.00 46.19 48.76 3f0k s LEU 84 CO 0.09 -0.23 -0.13 -1.81 -1.32 0.00 0.00 176.35 172.95 3f0k s ASP 85 N 2.82 4.17 -0.00 3.68 1.01 -0.10 -0.05 116.67 128.21 3f0k s ASP 85 Ca 0.01 -0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.04 3f0k s ASP 85 Cb -0.13 -0.86 -0.00 0.00 1.01 0.00 0.00 42.92 42.94 3f0k s ASP 85 CO -0.18 0.30 -0.04 -0.63 0.21 0.00 0.00 175.17 174.82 3f0k s ILE 86 N -0.89 0.34 -0.07 0.77 1.01 -0.07 -0.57 121.20 121.72 3f0k s ILE 86 Ca 0.14 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.63 3f0k s ILE 86 Cb -0.11 -0.29 0.00 0.00 0.01 0.00 0.00 42.46 42.07 3f0k s ILE 86 CO 0.04 0.08 -0.19 -0.22 0.00 0.00 0.00 174.94 174.66 3f0k s LEU 87 N -0.13 1.92 -0.02 2.97 0.20 -0.23 -0.71 118.68 122.68 3f0k s LEU 87 Ca 0.01 -0.43 0.05 0.00 0.69 0.00 0.00 54.13 54.45 3f0k s LEU 87 Cb -0.02 -1.13 -0.01 0.00 -0.43 0.00 0.00 46.19 44.60 3f0k s LEU 87 CO -0.00 0.13 -0.15 -1.58 -0.29 0.00 0.00 176.35 174.46 3f0k s GLN 88 N 0.31 1.29 -0.11 1.98 -0.44 -0.17 -0.72 119.66 121.81 3f0k s GLN 88 Ca -0.12 -0.55 -0.08 0.00 -2.50 0.00 0.00 55.36 52.10 3f0k s GLN 88 Cb -0.15 -1.23 0.04 0.00 -1.64 0.00 0.00 33.01 30.02 3f0k s GLN 88 CO 0.05 0.32 0.28 0.00 0.50 0.00 0.00 175.29 176.44 3f0k s VAL 90 N 0.61 0.28 -0.37 0.00 1.01 -0.74 -0.67 120.40 120.52 3f0k s VAL 90 Ca -0.04 -0.10 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 3f0k s VAL 90 Cb -0.05 -0.28 0.04 0.00 0.00 0.00 0.00 36.38 36.09 3f0k s VAL 90 CO -0.04 0.11 0.18 -0.04 0.00 0.00 0.00 175.10 175.31 3f0k s MET 91 N 0.24 2.70 -0.23 2.72 -1.94 -0.14 -0.78 119.30 121.87 3f0k s MET 91 Ca -0.02 -1.19 -0.22 0.00 -1.71 0.00 0.00 55.69 52.55 3f0k s MET 91 Cb -0.05 -3.65 -0.02 0.00 2.01 0.00 0.00 34.83 33.12 3f0k s MET 91 CO -0.00 -0.74 0.68 -0.06 -0.01 0.00 0.00 175.02 174.88 3f0k s PHE 92 N 1.47 3.32 0.53 -0.03 0.40 0.62 -3.33 117.98 120.96 3f0k s PHE 92 Ca 0.01 0.93 -0.18 0.00 -0.60 0.00 0.00 56.93 57.09 3f0k s PHE 92 Cb -0.20 -2.88 -0.07 0.00 0.51 0.00 0.00 43.02 40.38 3f0k s PHE 92 CO 0.04 -0.30 1.03 -1.25 0.70 0.00 0.00 175.22 175.44 3f0k s PRO 93 N 2.41 3.68 -0.17 0.24 0.04 -1.26 -0.16 135.00 139.77 3f0k s PRO 93 Ca 0.29 1.19 -0.29 0.00 0.04 0.00 0.00 61.00 62.23 3f0k s PRO 93 Cb -0.16 -2.09 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 3f0k s PRO 93 CO 0.09 -0.51 1.19 -1.21 0.04 0.00 0.00 177.00 176.60 3f0k s GLU 94 N -3.73 4.26 0.51 4.56 0.41 0.18 -4.29 118.70 120.60 3f0k s GLU 94 Ca 0.64 1.58 0.19 0.00 -0.41 0.00 0.00 54.97 56.97 3f0k s GLU 94 Cb -0.14 -3.71 1.29 0.00 -1.78 0.00 0.00 34.13 29.79 3f0k s GLU 94 CO 0.28 -0.65 2.07 -1.35 -0.49 0.00 0.00 175.26 175.12 3f0k h PRO 95 N 7.91 0.05 -0.96 0.39 0.11 -1.89 -0.86 132.00 136.75 3f0k h PRO 95 Ca -0.25 -0.00 0.26 0.00 0.11 0.00 0.00 66.00 66.11 3f0k h PRO 95 Cb 1.10 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 3f0k h PRO 95 CO 0.96 0.03 0.66 1.25 -0.21 0.00 0.00 178.00 180.69 3f0k h LEU 96 N 0.05 0.20 -0.18 2.35 5.85 -1.91 -0.28 115.31 121.38 3f0k h LEU 96 Ca 0.13 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3f0k h LEU 96 Cb 0.45 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3f0k h LEU 96 CO -0.01 0.06 -0.62 -1.22 -0.34 0.00 0.00 178.44 176.32 3f0k n TYR 97 N -4.40 0.00 -2.16 1.25 4.01 -0.33 0.06 117.16 115.59 3f0k n TYR 97 Ca 0.21 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.77 3f0k n TYR 97 Cb 0.90 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.79 3f0k n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3f0k n GLY 98 N 1.47 0.11 3.85 2.72 0.00 -0.12 -4.73 105.19 108.49 3f0k n GLY 98 Ca 0.06 -0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 3f0k n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f0k s LEU 99 N -4.97 3.73 0.00 0.99 1.43 -1.26 -4.91 118.68 113.69 3f0k s LEU 99 Ca 0.00 1.49 -0.19 0.00 -1.03 0.00 0.00 54.13 54.40 3f0k s LEU 99 Cb 0.00 -4.40 0.27 0.00 0.03 0.00 0.00 46.19 42.09 3f0k s LEU 99 CO 0.00 -0.50 1.14 -0.81 0.23 0.00 0.00 176.35 176.40 3f0k n PRO 100 N -1.34 -2.54 -3.41 1.29 -0.04 -1.26 -4.72 135.00 122.97 3f0k n PRO 100 Ca 0.06 -1.80 -0.42 0.00 -0.04 0.00 0.00 63.50 61.30 3f0k n PRO 100 Cb 0.54 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 32.39 3f0k n PRO 100 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3f0k s LEU 101 N 0.00 4.81 0.07 1.53 1.43 -0.03 -4.59 118.68 121.90 3f0k s LEU 101 Ca 0.71 -0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 52.88 3f0k s LEU 101 Cb -0.05 -2.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 3f0k s LEU 101 CO 0.53 -0.44 1.12 0.12 0.23 0.00 0.00 176.35 177.91 3f0k s PHE 102 N 1.90 3.53 0.03 0.29 2.19 -1.21 -0.81 117.98 123.90 3f0k s PHE 102 Ca 0.09 1.46 -0.05 0.00 0.33 0.00 0.00 56.93 58.76 3f0k s PHE 102 Cb -0.18 -3.31 -0.01 0.00 -1.31 0.00 0.00 43.02 38.21 3f0k s PHE 102 CO 0.12 -0.81 0.09 0.20 1.83 0.00 0.00 175.22 176.64 3f0k s GLY 103 N 0.81 0.17 0.02 13.12 0.00 -0.58 -0.96 107.32 119.90 3f0k s GLY 103 Ca 0.55 -0.53 -0.23 0.00 0.00 0.00 0.00 44.72 44.51 3f0k s GLY 103 CO 0.30 -0.66 0.52 0.00 0.00 0.00 0.00 173.10 173.26 3f0k s ASP 105 N -1.76 -0.10 -0.06 0.00 3.68 -0.43 -1.17 116.67 116.84 3f0k s ASP 105 Ca -0.07 0.30 0.02 0.00 2.13 0.00 0.00 52.55 54.93 3f0k s ASP 105 Cb -0.01 0.18 0.01 0.00 -1.45 0.00 0.00 42.92 41.65 3f0k s ASP 105 CO 0.01 -0.15 -0.12 -0.63 0.13 0.00 0.00 175.17 174.41 3f0k s ILE 106 N 1.18 1.11 -0.07 4.11 -1.09 0.10 -0.73 121.20 125.82 3f0k s ILE 106 Ca -0.09 -0.47 0.02 0.00 -2.23 0.00 0.00 60.65 57.88 3f0k s ILE 106 Cb -0.12 -1.01 0.01 0.00 -1.58 0.00 0.00 42.46 39.76 3f0k s ILE 106 CO -0.06 0.35 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.17 3f0k s VAL 107 N 0.60 1.24 0.02 2.92 1.01 -0.17 -1.07 120.40 124.96 3f0k s VAL 107 Ca -0.13 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.32 3f0k s VAL 107 Cb -0.15 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 3f0k s VAL 107 CO 0.03 0.38 -0.07 0.00 0.00 0.00 0.00 175.10 175.45 3f0k s ALA 108 N 0.61 0.50 0.00 5.51 0.00 0.27 -0.64 121.76 128.01 3f0k s ALA 108 Ca -0.15 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.27 3f0k s ALA 108 Cb -0.16 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.94 3f0k s ALA 108 CO 0.04 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.24 3f0k n GLY 109 N 2.08 4.30 0.37 0.00 0.00 -0.17 -0.92 105.19 110.84 3f0k n GLY 109 Ca -0.19 -2.08 0.17 0.00 0.00 0.00 0.00 46.02 43.92 3f0k n GLY 109 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3f0k h PRO 110 N 0.00 0.12 0.00 1.61 0.11 -1.88 0.84 132.00 132.80 3f0k h PRO 110 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3f0k h PRO 110 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3f0k h PRO 110 CO 0.00 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.28 3f0k n GLY 111 N -1.60 -1.10 0.00 -0.55 0.00 -1.26 -5.02 105.19 95.66 3f0k n GLY 111 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3f0k n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0k n GLY 112 N 1.08 -0.31 3.70 -0.02 0.00 0.29 -5.01 105.19 104.91 3f0k n GLY 112 Ca 0.19 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 3f0k n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f0k s VAL 113 N -0.13 3.91 -0.09 1.61 1.01 -1.26 -1.00 120.40 124.45 3f0k s VAL 113 Ca 0.00 1.33 0.09 0.00 0.00 0.00 0.00 61.98 63.40 3f0k s VAL 113 Cb 0.00 -3.85 -0.24 0.00 0.00 0.00 0.00 36.38 32.29 3f0k s VAL 113 CO 0.00 0.06 0.48 -1.54 0.00 0.00 0.00 175.10 174.09 3f0k n SER 114 N 4.55 1.08 -3.77 3.32 3.41 0.19 -4.35 113.62 118.05 3f0k n SER 114 Ca 0.11 0.29 -0.14 0.00 -0.26 0.00 0.00 58.87 58.87 3f0k n SER 114 Cb 0.45 -0.11 -0.15 0.00 -0.26 0.00 0.00 64.21 64.15 3f0k n SER 114 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f0k s ALA 115 N -2.57 -0.17 -0.11 7.33 0.00 -0.94 -4.24 121.76 121.06 3f0k s ALA 115 Ca -0.11 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 52.37 3f0k s ALA 115 Cb 0.07 -0.36 0.03 0.00 0.00 0.00 0.00 23.12 22.86 3f0k s ALA 115 CO 0.80 -0.13 -0.02 0.00 0.00 0.00 0.00 175.76 176.41 3f0k s ALA 116 N 1.00 1.00 -0.06 0.00 0.00 0.02 -1.00 121.76 122.72 3f0k s ALA 116 Ca -0.08 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.53 3f0k s ALA 116 Cb -0.10 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.14 3f0k s ALA 116 CO -0.04 -0.56 -0.16 0.42 0.00 0.00 0.00 175.76 175.41 3f0k s ILE 117 N 1.85 1.41 -0.05 0.00 1.09 0.09 -1.37 121.20 124.23 3f0k s ILE 117 Ca 0.04 -0.67 -0.16 0.00 -1.10 0.00 0.00 60.65 58.75 3f0k s ILE 117 Cb -0.13 -1.24 0.03 0.00 -1.06 0.00 0.00 42.46 40.06 3f0k s ILE 117 CO -0.07 0.41 0.37 0.00 -0.10 0.00 0.00 174.94 175.55 3f0k s ALA 118 N 0.32 -0.93 0.17 9.38 0.00 -0.63 -1.31 121.76 128.76 3f0k s ALA 118 Ca -0.10 0.61 -0.21 0.00 0.00 0.00 0.00 51.96 52.25 3f0k s ALA 118 Cb -0.14 -0.09 0.06 0.00 0.00 0.00 0.00 23.12 22.94 3f0k s ALA 118 CO 0.04 -0.26 0.58 0.34 0.00 0.00 0.00 175.76 176.46 3f0k s ASP 119 N -0.97 -0.46 -0.34 0.00 3.68 -0.41 -0.86 116.67 117.31 3f0k s ASP 119 Ca -0.10 -0.16 -0.03 0.00 2.13 0.00 0.00 52.55 54.38 3f0k s ASP 119 Cb -0.04 0.60 0.06 0.00 -1.45 0.00 0.00 42.92 42.09 3f0k s ASP 119 CO 0.04 -1.01 0.09 -0.76 0.13 0.00 0.00 175.17 173.66 3f0k s LEU 120 N -2.79 4.41 -0.06 -1.34 1.43 -1.26 -1.53 118.68 117.54 3f0k s LEU 120 Ca 0.03 -1.46 -0.06 0.00 -1.03 0.00 0.00 54.13 51.62 3f0k s LEU 120 Cb -0.01 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 3f0k s LEU 120 CO -0.10 -0.36 0.18 -0.44 0.23 0.00 0.00 176.35 175.86 3f0k s SER 121 N 1.48 6.41 0.63 2.29 0.01 0.01 -4.38 113.70 120.14 3f0k s SER 121 Ca -0.00 0.45 -0.16 0.00 1.31 0.00 0.00 55.95 57.55 3f0k s SER 121 Cb -0.21 -2.05 -0.02 0.00 0.21 0.00 0.00 66.02 63.95 3f0k s SER 121 CO -0.01 0.34 1.10 -2.16 0.41 0.00 0.00 173.24 172.92 3f0k s PRO 122 N -1.44 3.00 0.00 12.44 0.04 -1.26 -0.85 135.00 146.94 3f0k s PRO 122 Ca 0.21 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.62 3f0k s PRO 122 Cb -0.12 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.44 3f0k s PRO 122 CO 0.11 -1.09 0.03 0.25 0.04 0.00 0.00 177.00 176.34 3f0k n THR 123 N -2.18 0.00 -1.96 1.26 -2.24 -1.26 -4.81 114.28 103.09 3f0k n THR 123 Ca 0.10 -0.37 -0.34 0.00 -2.27 0.00 0.00 64.05 61.17 3f0k n THR 123 Cb 0.52 1.02 0.03 0.00 -2.10 0.00 0.00 70.33 69.80 3f0k n THR 123 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3f0k s GLN 124 N -0.69 2.98 0.47 -0.78 -0.21 -1.26 -3.79 119.66 116.38 3f0k s GLN 124 Ca 0.00 1.57 0.23 0.00 0.02 0.00 0.00 55.36 57.18 3f0k s GLN 124 Cb 0.00 -1.96 1.15 0.00 1.00 0.00 0.00 33.01 33.20 3f0k s GLN 124 CO 0.00 -1.14 1.96 0.66 -2.12 0.00 0.00 175.29 174.65 3f0k h SER 125 N 0.58 0.00 0.00 5.90 4.64 -1.92 -1.07 113.55 121.68 3f0k h SER 125 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3f0k h SER 125 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3f0k h SER 125 CO 0.55 0.21 0.00 -0.90 -0.87 0.00 0.00 176.83 175.82 3f0k n ASP 126 N -3.71 0.00 -1.16 4.97 3.85 -1.26 -4.90 116.55 114.34 3f0k n ASP 126 Ca -0.01 -1.13 -0.15 0.00 -0.71 0.00 0.00 54.79 52.78 3f0k n ASP 126 Cb 0.32 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.03 3f0k n ASP 126 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3f0k n ARG 127 N -0.90 -1.30 -4.04 0.11 1.74 -0.40 -4.99 116.66 106.88 3f0k n ARG 127 Ca 0.18 1.02 -0.30 0.00 -0.77 0.00 0.00 57.85 57.98 3f0k n ARG 127 Cb 0.08 -5.28 -0.06 0.00 -1.02 0.00 0.00 32.46 26.19 3f0k n ARG 127 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3f0k s GLN 128 N -3.24 2.95 0.68 5.56 -1.52 -1.26 -4.81 119.66 118.01 3f0k s GLN 128 Ca 0.00 -0.67 -0.14 0.00 -1.95 0.00 0.00 55.36 52.60 3f0k s GLN 128 Cb 0.00 -2.76 0.01 0.00 -0.22 0.00 0.00 33.01 30.04 3f0k s GLN 128 CO 0.00 0.57 1.10 -0.51 -0.25 0.00 0.00 175.29 176.19 3f0k s LEU 129 N -2.45 3.32 0.80 2.90 1.43 -1.26 -4.35 118.68 119.07 3f0k s LEU 129 Ca 0.30 1.92 -0.14 0.00 -1.03 0.00 0.00 54.13 55.18 3f0k s LEU 129 Cb -0.12 -4.54 0.08 0.00 0.03 0.00 0.00 46.19 41.64 3f0k s LEU 129 CO 0.23 -1.65 1.21 -2.84 0.23 0.00 0.00 176.35 173.54 3f0k s PRO 130 N -4.31 1.69 0.24 1.29 0.02 -1.26 -4.71 135.00 127.95 3f0k s PRO 130 Ca 0.65 1.79 -0.05 0.00 0.02 0.00 0.00 61.00 63.40 3f0k s PRO 130 Cb -0.19 -1.78 0.42 0.00 0.02 0.00 0.00 34.50 32.97 3f0k s PRO 130 CO 0.45 -2.19 1.73 0.00 -0.33 0.00 0.00 177.00 176.66 3f0k h ALA 131 N -0.81 0.99 -0.10 -1.55 0.00 -2.00 -1.44 119.26 114.36 3f0k h ALA 131 Ca -0.47 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 3f0k h ALA 131 Cb 1.30 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3f0k h ALA 131 CO 0.47 -0.22 -0.25 0.00 0.00 0.00 0.00 179.25 179.25 3f0k h ALA 132 N 1.53 1.40 -0.36 0.00 0.00 -2.00 -0.96 119.26 118.87 3f0k h ALA 132 Ca 0.39 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3f0k h ALA 132 Cb 0.58 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3f0k h ALA 132 CO -0.39 0.42 -0.21 1.88 0.00 0.00 0.00 179.25 180.95 3f0k h TYR 133 N 0.16 0.91 -0.34 0.00 -1.99 -1.64 -1.62 116.97 112.44 3f0k h TYR 133 Ca 0.03 -0.24 0.01 0.00 2.00 0.00 0.00 58.73 60.53 3f0k h TYR 133 Cb 0.54 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.04 3f0k h TYR 133 CO 0.01 0.99 0.21 1.96 -0.00 0.00 0.00 178.16 181.33 3f0k h GLN 134 N 0.57 0.43 -0.36 4.88 4.20 -0.71 0.49 115.11 124.61 3f0k h GLN 134 Ca 0.08 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.77 3f0k h GLN 134 Cb 0.76 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 3f0k h GLN 134 CO 0.06 0.28 0.23 -0.22 -0.67 0.00 0.00 178.83 178.51 3f0k h LYS 135 N 0.44 0.45 -0.22 1.46 3.64 -1.13 -1.80 116.57 119.42 3f0k h LYS 135 Ca 0.13 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.32 3f0k h LYS 135 Cb -0.03 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3f0k h LYS 135 CO -0.04 0.30 -0.53 0.77 -2.27 0.00 0.00 179.45 177.68 3f0k h SER 136 N 0.46 0.70 -0.38 4.20 0.02 -1.07 -2.87 113.55 114.62 3f0k h SER 136 Ca 0.13 -0.37 -0.07 0.00 -0.84 0.00 0.00 61.79 60.65 3f0k h SER 136 Cb -0.04 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 3f0k h SER 136 CO -0.04 1.10 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.66 3f0k h LEU 137 N 0.49 0.68 -0.39 5.07 3.38 -0.76 -3.09 115.31 120.69 3f0k h LEU 137 Ca 0.01 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.73 3f0k h LEU 137 Cb 1.08 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 3f0k h LEU 137 CO 0.10 0.84 -0.02 0.00 0.09 0.00 0.00 178.44 179.45 3f0k h ALA 138 N 0.86 0.34 0.00 1.53 0.00 -1.30 -1.76 119.26 118.93 3f0k h ALA 138 Ca 0.10 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3f0k h ALA 138 Cb 0.50 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3f0k h ALA 138 CO 0.02 -0.41 0.35 0.93 0.00 0.00 0.00 179.25 180.15 3f0k h GLU 139 N 0.08 0.00 0.00 0.00 5.08 -1.42 0.79 114.58 119.12 3f0k h GLU 139 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3f0k h GLU 139 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 3f0k h GLU 139 CO -0.33 0.00 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.55 3f0k h LEU 140 N 0.00 0.00 0.00 1.33 3.38 -1.36 -3.50 115.31 115.17 3f0k h LEU 140 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3f0k h LEU 140 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3f0k h LEU 140 CO 0.00 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3f0k n GLY 141 N 0.38 -2.48 3.66 0.83 0.00 0.27 -4.83 105.19 103.02 3f0k n GLY 141 Ca 0.01 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.15 3f0k n GLY 141 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f0k s GLN 142 N -3.07 4.26 0.54 1.61 -1.52 -1.26 -5.01 119.66 115.21 3f0k s GLN 142 Ca 0.00 1.56 -0.17 0.00 -1.95 0.00 0.00 55.36 54.80 3f0k s GLN 142 Cb 0.00 -3.70 -0.06 0.00 -0.22 0.00 0.00 33.01 29.03 3f0k s GLN 142 CO 0.00 -0.64 1.03 -1.25 -0.25 0.00 0.00 175.29 174.18 3f0k s PRO 143 N 3.21 3.60 -0.16 2.91 0.04 -1.26 -5.02 135.00 138.32 3f0k s PRO 143 Ca 0.51 1.19 -0.06 0.00 0.04 0.00 0.00 61.00 62.69 3f0k s PRO 143 Cb -0.20 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 3f0k s PRO 143 CO 0.13 -0.58 0.03 -1.21 0.04 0.00 0.00 177.00 175.40 3f0k s GLU 144 N -3.83 3.77 -0.01 4.56 2.02 -1.26 -5.07 118.70 118.87 3f0k s GLU 144 Ca 0.63 -0.40 0.01 0.00 0.02 0.00 0.00 54.97 55.23 3f0k s GLU 144 Cb -0.15 -3.07 0.01 0.00 0.10 0.00 0.00 34.13 31.02 3f0k s GLU 144 CO 0.31 0.32 -0.01 -0.06 0.02 0.00 0.00 175.26 175.83 3f0k s PHE 145 N 0.20 0.25 0.20 1.61 0.40 -1.26 -5.03 117.98 114.35 3f0k s PHE 145 Ca 0.02 -0.02 0.12 0.00 -0.60 0.00 0.00 56.93 56.45 3f0k s PHE 145 Cb -0.13 -0.25 0.29 0.00 0.51 0.00 0.00 43.02 43.45 3f0k s PHE 145 CO 0.01 -0.05 1.56 0.93 0.70 0.00 0.00 175.22 178.37 3f0k h GLU 146 N 6.57 0.00 -2.48 0.44 5.08 -1.98 -3.38 114.58 118.84 3f0k h GLU 146 Ca -0.33 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.43 3f0k h GLU 146 Cb 1.17 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.01 3f0k h GLU 146 CO 0.49 0.64 -0.68 1.04 -1.00 0.00 0.00 179.01 179.50 3f0k n GLN 147 N -3.63 1.88 -2.43 2.33 6.02 -1.26 -5.09 117.38 115.20 3f0k n GLN 147 Ca -0.01 -4.31 -0.37 0.00 -0.01 0.00 0.00 57.00 52.31 3f0k n GLN 147 Cb 0.66 -2.09 -0.03 0.00 1.02 0.00 0.00 30.24 29.81 3f0k n GLN 147 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3f0k s GLN 148 N -1.78 3.98 0.00 -1.09 -1.52 -1.26 -1.14 119.66 116.86 3f0k s GLN 148 Ca 0.34 1.61 0.08 0.00 -1.95 0.00 0.00 55.36 55.44 3f0k s GLN 148 Cb 0.08 -2.46 -0.02 0.00 -0.22 0.00 0.00 33.01 30.38 3f0k s GLN 148 CO -0.09 -0.32 -0.26 1.03 -0.25 0.00 0.00 175.29 175.40 3f0k s ARG 149 N -2.62 2.01 0.08 2.91 0.52 -0.29 -4.88 118.95 116.68 3f0k s ARG 149 Ca 0.61 -0.99 -0.26 0.00 -0.52 0.00 0.00 55.73 54.57 3f0k s ARG 149 Cb -0.24 -2.03 -0.06 0.00 0.52 0.00 0.00 34.95 33.13 3f0k s ARG 149 CO 0.30 0.54 0.79 -1.21 0.02 0.00 0.00 175.30 175.74 3f0k s GLU 150 N -0.86 4.53 0.56 3.54 2.02 -1.26 -4.71 118.70 122.52 3f0k s GLU 150 Ca 0.11 1.13 -0.19 0.00 0.02 0.00 0.00 54.97 56.03 3f0k s GLU 150 Cb -0.10 -3.34 -0.05 0.00 0.10 0.00 0.00 34.13 30.74 3f0k s GLU 150 CO 0.00 0.35 1.17 -0.51 0.02 0.00 0.00 175.26 176.29 3f0k s LEU 151 N -0.32 3.72 0.83 1.80 1.43 -1.26 -5.03 118.68 119.85 3f0k s LEU 151 Ca 0.39 2.30 -0.12 0.00 -1.03 0.00 0.00 54.13 55.67 3f0k s LEU 151 Cb -0.21 -4.57 0.09 0.00 0.03 0.00 0.00 46.19 41.52 3f0k s LEU 151 CO 0.24 -1.40 1.10 -2.16 0.23 0.00 0.00 176.35 174.37 3f0k s PRO 152 N -3.28 1.83 0.33 1.29 0.04 -1.26 -4.86 135.00 129.10 3f0k s PRO 152 Ca 0.75 0.65 0.06 0.00 0.04 0.00 0.00 61.00 62.50 3f0k s PRO 152 Cb -0.27 -1.89 0.72 0.00 0.04 0.00 0.00 34.50 33.10 3f0k s PRO 152 CO 0.30 -1.80 1.87 -1.35 0.04 0.00 0.00 177.00 176.07 3f0k h PRO 153 N -1.22 0.78 0.00 0.56 0.11 -2.02 0.18 132.00 130.39 3f0k h PRO 153 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3f0k h PRO 153 Cb 1.28 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3f0k h PRO 153 CO 0.58 0.51 0.00 0.11 -0.21 0.00 0.00 178.00 179.00 3f0k h TRP 154 N 0.80 0.00 0.00 0.65 5.08 -1.91 -2.24 115.95 118.33 3f0k h TRP 154 Ca 0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.42 3f0k h TRP 154 Cb 0.59 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.75 3f0k h TRP 154 CO -0.00 0.00 0.00 0.41 -1.28 0.00 0.00 178.44 177.57 3f0k n GLY 155 N -1.05 -0.52 0.34 11.11 0.00 0.64 -3.34 105.19 112.37 3f0k n GLY 155 Ca -0.02 -0.04 0.23 0.00 0.00 0.00 0.00 46.02 46.18 3f0k n GLY 155 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3f0k h GLU 156 N 0.00 0.00 0.00 1.61 -0.00 -1.58 -1.70 114.58 112.92 3f0k h GLU 156 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.35 3f0k h GLU 156 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.75 3f0k h GLU 156 CO 0.00 0.00 -0.04 -0.84 -0.00 0.00 0.00 179.01 178.13 3f0k h ILE 157 N 0.00 0.12 -3.86 -1.06 3.07 -1.85 -3.45 117.51 110.48 3f0k h ILE 157 Ca 0.00 -0.49 -0.48 0.00 1.55 0.00 0.00 64.86 65.44 3f0k h ILE 157 Cb 0.04 1.43 -0.00 0.00 -0.27 0.00 0.00 36.82 38.02 3f0k h ILE 157 CO -0.00 0.04 0.20 -0.36 -1.05 0.00 0.00 178.15 176.97 3f0k s PHE 158 N -3.80 3.42 0.88 0.16 0.40 -0.64 -4.19 117.98 114.20 3f0k s PHE 158 Ca -0.00 1.26 -0.14 0.00 -0.60 0.00 0.00 56.93 57.45 3f0k s PHE 158 Cb 0.10 -2.60 0.13 0.00 0.51 0.00 0.00 43.02 41.17 3f0k s PHE 158 CO 0.53 -0.11 1.24 -1.54 0.70 0.00 0.00 175.22 176.05 3f0k s SER 159 N -2.76 3.87 0.18 1.36 1.04 -1.26 -4.92 113.70 111.22 3f0k s SER 159 Ca 0.55 0.56 0.16 0.00 0.48 0.00 0.00 55.95 57.71 3f0k s SER 159 Cb -0.10 -0.85 0.78 0.00 0.10 0.00 0.00 66.02 65.95 3f0k s SER 159 CO 0.25 -2.29 1.50 -1.84 0.98 0.00 0.00 173.24 171.84 3f0k n GLU 160 N -3.53 0.10 0.00 4.02 0.28 -1.26 -1.72 120.64 118.54 3f0k n GLU 160 Ca 0.11 0.48 0.13 0.00 -0.16 0.00 0.00 57.16 57.73 3f0k n GLU 160 Cb 0.60 -1.76 0.37 0.00 1.43 0.00 0.00 31.44 32.08 3f0k n GLU 160 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3f0k n TYR 161 N -1.97 0.00 -1.68 -1.84 4.01 -1.26 -4.97 117.16 109.45 3f0k n TYR 161 Ca 0.01 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.30 3f0k n TYR 161 Cb 0.11 -0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 3f0k n TYR 161 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3f0k s LEU 163 N 0.48 4.35 -0.28 0.00 1.43 -0.04 -4.97 118.68 119.65 3f0k s LEU 163 Ca 0.73 0.51 0.01 0.00 -1.03 0.00 0.00 54.13 54.36 3f0k s LEU 163 Cb -0.64 -2.19 0.16 0.00 0.03 0.00 0.00 46.19 43.54 3f0k s LEU 163 CO 0.43 0.32 0.40 0.12 0.23 0.00 0.00 176.35 177.85 3f0k s PHE 164 N -0.62 -0.95 0.14 0.29 5.99 -1.24 -1.61 117.98 119.99 3f0k s PHE 164 Ca 0.15 0.34 -0.01 0.00 0.00 0.00 0.00 56.93 57.42 3f0k s PHE 164 Cb -0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 43.02 42.69 3f0k s PHE 164 CO 0.04 -0.95 0.06 0.96 -0.00 0.00 0.00 175.22 175.33 3f0k s ILE 165 N 2.53 0.17 -0.31 3.12 -4.36 -0.47 -1.14 121.20 120.74 3f0k s ILE 165 Ca 0.10 -1.93 -0.08 0.00 -0.26 0.00 0.00 60.65 58.48 3f0k s ILE 165 Cb -0.13 -2.10 0.01 0.00 1.25 0.00 0.00 42.46 41.49 3f0k s ILE 165 CO -0.29 -0.43 0.13 -0.60 0.24 0.00 0.00 174.94 173.99 3f0k s ARG 166 N -4.04 3.13 0.34 0.37 3.52 -0.29 -0.80 118.95 121.18 3f0k s ARG 166 Ca 0.25 -0.85 -0.29 0.00 -0.13 0.00 0.00 55.73 54.71 3f0k s ARG 166 Cb 0.07 -3.50 -0.11 0.00 -1.56 0.00 0.00 34.95 29.85 3f0k s ARG 166 CO 0.03 -0.48 1.55 -2.30 -0.81 0.00 0.00 175.30 173.29 3f0k n PRO 167 N 4.92 2.72 0.05 5.12 -0.02 -1.26 -4.32 135.00 142.21 3f0k n PRO 167 Ca -0.14 0.96 0.12 0.00 -2.02 0.00 0.00 63.50 62.42 3f0k n PRO 167 Cb 0.48 -2.72 0.07 0.00 -0.02 0.00 0.00 33.50 31.31 3f0k n PRO 167 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3f0k n SER 168 N 1.18 0.65 -3.32 2.55 3.41 -1.26 -4.89 113.62 111.95 3f0k n SER 168 Ca 0.04 -0.03 -0.01 0.00 -0.26 0.00 0.00 58.87 58.61 3f0k n SER 168 Cb 0.38 0.55 0.02 0.00 -0.26 0.00 0.00 64.21 64.90 3f0k n SER 168 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3f0k n ASN 169 N -2.10 -1.51 -0.17 4.04 0.23 -1.26 -5.03 115.26 109.46 3f0k n ASN 169 Ca 0.02 -1.70 -0.08 0.00 -0.53 0.00 0.00 54.58 52.30 3f0k n ASN 169 Cb 0.45 2.44 0.07 0.00 -2.08 0.00 0.00 39.78 40.66 3f0k n ASN 169 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 3f0k h VAL 170 N 1.94 1.26 -0.54 3.53 2.07 -1.99 -1.53 116.25 120.98 3f0k h VAL 170 Ca -0.24 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.19 3f0k h VAL 170 Cb 1.13 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 3f0k h VAL 170 CO 0.33 0.41 0.24 0.74 0.02 0.00 0.00 177.57 179.31 3f0k h THR 171 N 0.88 0.88 -0.67 2.57 2.02 -1.99 -0.41 112.91 116.19 3f0k h THR 171 Ca 0.15 -0.16 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 3f0k h THR 171 Cb 0.56 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 3f0k h THR 171 CO 0.03 0.08 0.10 -0.33 0.37 0.00 0.00 175.52 175.77 3f0k h GLU 172 N 0.46 1.11 -0.41 6.66 5.08 -1.87 0.03 114.58 125.64 3f0k h GLU 172 Ca 0.25 -0.30 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 3f0k h GLU 172 Cb 0.22 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 3f0k h GLU 172 CO -0.21 1.02 0.07 0.93 -1.00 0.00 0.00 179.01 179.82 3f0k h GLU 173 N 1.03 0.19 -0.12 2.33 5.08 -0.59 0.43 114.58 122.94 3f0k h GLU 173 Ca 0.20 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.40 3f0k h GLU 173 Cb 0.46 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3f0k h GLU 173 CO 0.02 0.13 -0.57 0.93 -1.00 0.00 0.00 179.01 178.51 3f0k h GLU 174 N 0.20 0.36 -0.66 2.33 5.08 -0.85 -1.46 114.58 119.58 3f0k h GLU 174 Ca 0.20 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3f0k h GLU 174 Cb 0.24 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 3f0k h GLU 174 CO -0.27 0.84 0.26 -0.09 -1.00 0.00 0.00 179.01 178.75 3f0k h ARG 175 N 0.28 0.99 -0.05 2.33 2.43 -0.58 0.01 114.38 119.78 3f0k h ARG 175 Ca -0.00 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 3f0k h ARG 175 Cb 1.09 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 3f0k h ARG 175 CO 0.10 0.83 0.02 0.35 -1.51 0.00 0.00 179.97 179.76 3f0k h PHE 176 N 0.94 0.07 -0.97 2.20 3.04 -0.71 -1.06 116.94 120.45 3f0k h PHE 176 Ca 0.22 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.17 3f0k h PHE 176 Cb 0.21 -0.02 -0.05 0.00 2.56 0.00 0.00 35.95 38.65 3f0k h PHE 176 CO 0.01 0.16 0.62 0.28 -2.02 0.00 0.00 178.31 177.36 3f0k h VAL 177 N -0.04 1.26 -0.63 1.41 2.07 -1.07 -0.97 116.25 118.27 3f0k h VAL 177 Ca 0.02 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 66.97 3f0k h VAL 177 Cb 0.11 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 29.71 3f0k h VAL 177 CO -0.00 0.26 0.16 -0.61 0.02 0.00 0.00 177.57 177.39 3f0k h GLN 178 N 1.33 0.98 -0.50 1.57 5.75 -0.85 -0.32 115.11 123.07 3f0k h GLN 178 Ca 0.35 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.58 3f0k h GLN 178 Cb -0.11 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.27 3f0k h GLN 178 CO -0.07 0.87 0.09 -0.09 -2.65 0.00 0.00 178.83 176.98 3f0k h ARG 179 N 0.94 0.77 -0.48 1.69 9.65 -0.43 -0.10 114.38 126.42 3f0k h ARG 179 Ca 0.20 -0.16 -0.13 0.00 -1.10 0.00 0.00 59.98 58.79 3f0k h ARG 179 Cb 0.33 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 3f0k h ARG 179 CO -0.00 0.71 -0.19 0.28 2.80 0.00 0.00 179.97 183.57 3f0k h VAL 180 N 0.74 1.27 -0.59 0.20 2.07 -0.52 0.88 116.25 120.29 3f0k h VAL 180 Ca 0.16 -1.35 0.05 0.00 0.82 0.00 0.00 66.70 66.38 3f0k h VAL 180 Cb 0.32 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 3f0k h VAL 180 CO 0.00 0.47 0.32 0.58 0.02 0.00 0.00 177.57 178.96 3f0k h VAL 181 N 0.82 0.97 -0.64 2.57 2.07 -0.78 -0.36 116.25 120.90 3f0k h VAL 181 Ca 0.11 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 3f0k h VAL 181 Cb 0.77 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3f0k h VAL 181 CO 0.06 0.11 0.32 0.44 0.02 0.00 0.00 177.57 178.52 3f0k h ASP 182 N 0.60 0.83 -0.61 0.57 3.32 -0.56 0.00 116.42 120.58 3f0k h ASP 182 Ca 0.26 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.20 3f0k h ASP 182 Cb 0.16 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 3f0k h ASP 182 CO -0.17 0.72 0.40 -0.26 -1.72 0.00 0.00 179.24 178.22 3f0k h PHE 183 N 0.88 0.77 -0.57 4.55 -1.00 -0.27 -0.69 116.94 120.60 3f0k h PHE 183 Ca 0.22 0.02 -0.06 0.00 2.81 0.00 0.00 57.97 60.96 3f0k h PHE 183 Cb 0.10 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.38 3f0k h PHE 183 CO 0.00 0.48 0.10 -0.07 -1.61 0.00 0.00 178.31 177.21 3f0k h LEU 184 N 0.82 0.86 -0.35 1.54 3.38 -0.76 0.55 115.31 121.35 3f0k h LEU 184 Ca 0.23 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3f0k h LEU 184 Cb -0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 3f0k h LEU 184 CO -0.05 0.86 0.08 1.56 0.09 0.00 0.00 178.44 180.97 3f0k h GLN 185 N 0.86 0.57 -0.37 1.13 4.20 -0.51 0.11 115.11 121.11 3f0k h GLN 185 Ca 0.18 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 3f0k h GLN 185 Cb 0.37 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3f0k h GLN 185 CO 0.01 0.62 0.17 0.82 -0.67 0.00 0.00 178.83 179.77 3f0k h ILE 186 N 0.42 1.17 -0.19 2.54 2.04 -0.94 -2.11 117.51 120.43 3f0k h ILE 186 Ca 0.11 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3f0k h ILE 186 Cb 0.31 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3f0k h ILE 186 CO 0.00 0.19 0.08 -0.74 0.00 0.00 0.00 178.15 177.68 3f0k h HIS 187 N 0.45 0.29 -0.20 1.37 2.76 -0.71 0.98 115.15 120.09 3f0k h HIS 187 Ca 0.13 -0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.19 3f0k h HIS 187 Cb 0.14 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 3f0k h HIS 187 CO -0.01 0.34 -0.23 0.00 -1.30 0.00 0.00 177.93 176.73 3f0k h HIS 189 N 0.33 0.28 -0.22 0.00 6.17 -1.05 -2.75 115.15 117.91 3f0k h HIS 189 Ca 0.05 -0.08 0.02 0.00 0.71 0.00 0.00 60.37 61.07 3f0k h HIS 189 Cb 0.60 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.45 3f0k h HIS 189 CO 0.01 0.64 0.15 1.96 0.71 0.00 0.00 177.93 181.41 3f0k h GLN 190 N -0.16 0.20 0.00 5.26 1.08 -0.55 -0.48 115.11 120.47 3f0k h GLN 190 Ca 0.02 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3f0k h GLN 190 Cb 0.59 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.97 3f0k h GLN 190 CO 0.02 0.13 -0.03 0.66 -0.95 0.00 0.00 178.83 178.67 3f0k h SER 191 N 0.21 0.00 0.69 1.46 4.64 -0.78 -1.70 113.55 118.07 3f0k h SER 191 Ca 0.09 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.19 3f0k h SER 191 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 3f0k h SER 191 CO -0.02 0.03 -1.02 0.40 -0.87 0.00 0.00 176.83 175.35 3f0k h ILE 192 N 0.00 1.55 -0.23 0.95 2.04 -1.02 -3.30 117.51 117.50 3f0k h ILE 192 Ca -0.00 -2.95 0.00 0.00 1.00 0.00 0.00 64.86 62.91 3f0k h ILE 192 Cb 0.06 2.70 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 3f0k h ILE 192 CO 0.00 0.85 0.00 1.33 0.00 0.00 0.00 178.15 180.34 3f0k n VAL 193 N -3.55 0.28 -2.80 1.67 0.24 -0.79 -4.91 118.33 108.48 3f0k n VAL 193 Ca -0.04 -0.59 -0.41 0.00 -2.04 0.00 0.00 64.34 61.26 3f0k n VAL 193 Cb 0.91 1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 34.27 3f0k n VAL 193 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3f0k s ALA 194 N -1.72 3.28 0.20 2.33 0.00 -0.71 -5.09 121.76 120.06 3f0k s ALA 194 Ca 0.35 0.50 0.05 0.00 0.00 0.00 0.00 51.96 52.86 3f0k s ALA 194 Cb 0.21 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 3f0k s ALA 194 CO 0.31 -0.01 0.20 -1.83 0.00 0.00 0.00 175.76 174.43 3f0k s GLU 195 N 0.00 3.04 0.27 0.00 -1.05 -1.26 -5.03 118.70 114.68 3f0k s GLU 195 Ca 0.45 -0.89 -0.30 0.00 -0.15 0.00 0.00 54.97 54.08 3f0k s GLU 195 Cb -0.23 -2.68 -0.13 0.00 -0.44 0.00 0.00 34.13 30.65 3f0k s GLU 195 CO 0.28 0.45 1.42 -2.30 0.95 0.00 0.00 175.26 176.06 3f0k n PRO 196 N -0.80 2.20 -2.68 -4.83 -0.02 -1.26 -4.51 135.00 123.09 3f0k n PRO 196 Ca -0.08 0.78 -0.22 0.00 -2.02 0.00 0.00 63.50 61.96 3f0k n PRO 196 Cb 0.56 -2.45 0.07 0.00 -0.02 0.00 0.00 33.50 31.67 3f0k n PRO 196 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3f0k s LEU 197 N -0.29 3.12 0.92 2.45 1.43 0.11 -5.00 118.68 121.42 3f0k s LEU 197 Ca 0.64 -0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 53.32 3f0k s LEU 197 Cb -0.60 -2.26 0.15 0.00 0.03 0.00 0.00 46.19 43.51 3f0k s LEU 197 CO 0.52 -1.50 1.09 -0.94 0.23 0.00 0.00 176.35 175.75 3f0k s SER 198 N -4.61 3.13 0.30 2.29 1.04 -1.26 -4.72 113.70 109.87 3f0k s SER 198 Ca 0.62 1.67 -0.00 0.00 0.48 0.00 0.00 55.95 58.73 3f0k s SER 198 Cb -0.07 -2.32 0.45 0.00 0.10 0.00 0.00 66.02 64.19 3f0k s SER 198 CO 0.41 -2.88 1.85 -0.08 0.98 0.00 0.00 173.24 173.52 3f0k h GLU 199 N -1.72 0.78 -0.37 4.02 4.81 -1.99 0.18 114.58 120.30 3f0k h GLU 199 Ca -0.49 -0.15 -0.15 0.00 -0.13 0.00 0.00 59.36 58.44 3f0k h GLU 199 Cb 1.28 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 3f0k h GLU 199 CO 0.51 0.70 -0.37 0.00 -0.73 0.00 0.00 179.01 179.12 3f0k h ALA 200 N 1.39 0.54 -0.49 2.92 0.00 -1.99 -1.49 119.26 120.14 3f0k h ALA 200 Ca 0.17 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 3f0k h ALA 200 Cb 0.26 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3f0k h ALA 200 CO -0.00 0.63 -0.14 1.96 0.00 0.00 0.00 179.25 181.69 3f0k h GLN 201 N 0.70 0.97 -0.84 0.00 4.20 -1.84 -0.74 115.11 117.56 3f0k h GLN 201 Ca 0.06 -0.38 0.05 0.00 0.06 0.00 0.00 58.65 58.43 3f0k h GLN 201 Cb 0.96 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.63 3f0k h GLN 201 CO 0.09 1.05 0.53 1.15 -0.67 0.00 0.00 178.83 180.98 3f0k h THR 202 N 0.82 1.09 -0.22 -0.54 2.02 -0.49 -1.49 112.91 114.10 3f0k h THR 202 Ca 0.12 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 3f0k h THR 202 Cb 0.71 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 3f0k h THR 202 CO 0.05 0.18 0.08 0.25 0.37 0.00 0.00 175.52 176.46 3f0k h LEU 203 N 1.01 0.31 -0.25 2.58 5.85 -0.99 0.26 115.31 124.08 3f0k h LEU 203 Ca 0.35 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.95 3f0k h LEU 203 Cb 0.08 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 3f0k h LEU 203 CO -0.14 0.40 -0.14 -0.08 -0.34 0.00 0.00 178.44 178.15 3f0k h GLU 204 N 0.20 -0.11 -0.86 1.25 4.81 -0.71 -0.22 114.58 118.94 3f0k h GLU 204 Ca 0.07 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.40 3f0k h GLU 204 Cb 0.20 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.53 3f0k h GLU 204 CO -0.00 -0.07 0.52 0.45 -0.73 0.00 0.00 179.01 179.17 3f0k h HIS 205 N -0.11 0.94 -0.53 0.92 3.86 -1.16 -2.14 115.15 116.93 3f0k h HIS 205 Ca 0.13 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.39 3f0k h HIS 205 Cb 0.31 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 3f0k h HIS 205 CO -0.31 0.41 0.33 -0.09 0.86 0.00 0.00 177.93 179.14 3f0k h ARG 206 N 0.88 0.66 -0.89 2.45 2.43 -0.48 -1.62 114.38 117.80 3f0k h ARG 206 Ca 0.40 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.60 3f0k h ARG 206 Cb 0.32 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.66 3f0k h ARG 206 CO -0.23 0.43 0.56 1.96 -1.51 0.00 0.00 179.97 181.18 3f0k h GLN 207 N 0.68 0.98 -0.69 0.20 4.20 -0.89 -0.55 115.11 119.03 3f0k h GLN 207 Ca 0.20 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 3f0k h GLN 207 Cb -0.04 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.49 3f0k h GLN 207 CO -0.06 0.65 0.22 0.78 -0.67 0.00 0.00 178.83 179.74 3f0k h GLY 208 N 1.01 1.16 1.04 3.46 0.00 -0.89 -0.96 103.07 107.88 3f0k h GLY 208 Ca 0.39 -0.68 -0.09 0.00 0.00 0.00 0.00 47.33 46.95 3f0k h GLY 208 CO -0.18 0.64 -0.02 -1.61 0.00 0.00 0.00 176.54 175.37 3f0k h GLN 209 N 1.02 0.94 -0.33 4.80 4.15 -0.76 -1.52 115.11 123.40 3f0k h GLN 209 Ca 0.22 -0.31 0.02 0.00 0.77 0.00 0.00 58.65 59.35 3f0k h GLN 209 Cb 0.30 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.88 3f0k h GLN 209 CO -0.01 0.97 0.17 0.82 -1.93 0.00 0.00 178.83 178.85 3f0k h ILE 210 N 0.81 1.00 -0.60 2.39 2.04 -0.89 -1.53 117.51 120.73 3f0k h ILE 210 Ca 0.15 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.93 3f0k h ILE 210 Cb 0.55 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 3f0k h ILE 210 CO 0.03 0.07 0.34 -0.74 0.00 0.00 0.00 178.15 177.85 3f0k h HIS 211 N 0.36 0.64 -0.37 1.37 2.76 -1.04 -0.42 115.15 118.45 3f0k h HIS 211 Ca 0.14 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.38 3f0k h HIS 211 Cb 0.03 -0.20 -0.05 0.00 1.55 0.00 0.00 27.41 28.75 3f0k h HIS 211 CO -0.09 0.33 0.08 -0.92 -1.30 0.00 0.00 177.93 176.03 3f0k h TYR 212 N 0.66 0.14 -0.55 5.26 3.20 -0.93 -0.68 116.97 124.06 3f0k h TYR 212 Ca 0.26 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.10 3f0k h TYR 212 Cb 0.10 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3f0k h TYR 212 CO -0.07 0.03 0.14 0.00 -1.64 0.00 0.00 178.16 176.62 3f0k h GLN 214 N 0.78 1.26 -0.17 0.00 4.20 -0.78 -2.21 115.11 118.20 3f0k h GLN 214 Ca 0.18 -0.10 -0.18 0.00 0.06 0.00 0.00 58.65 58.60 3f0k h GLN 214 Cb 0.33 -0.27 0.01 0.00 0.30 0.00 0.00 27.48 27.84 3f0k h GLN 214 CO 0.00 0.87 -0.60 1.96 -0.67 0.00 0.00 178.83 180.39 3f0k h GLN 215 N 1.28 0.71 -0.44 1.46 1.08 -0.91 -2.94 115.11 115.36 3f0k h GLN 215 Ca 0.34 -0.54 0.11 0.00 -1.45 0.00 0.00 58.65 57.11 3f0k h GLN 215 Cb -0.08 0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 3f0k h GLN 215 CO -0.07 1.15 0.31 1.96 -0.95 0.00 0.00 178.83 181.24 3f0k h GLN 216 N 0.41 0.11 0.00 1.46 1.08 -0.94 0.10 115.11 117.33 3f0k h GLN 216 Ca -0.03 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3f0k h GLN 216 Cb 1.23 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 3f0k h GLN 216 CO 0.13 0.07 0.00 1.04 -0.95 0.00 0.00 178.83 179.12 3f0k n GLN 217 N -4.44 0.18 0.00 1.46 6.02 -0.85 -2.20 117.38 117.56 3f0k n GLN 217 Ca 0.07 0.47 0.12 0.00 -0.01 0.00 0.00 57.00 57.64 3f0k n GLN 217 Cb 0.44 -1.89 0.69 0.00 1.02 0.00 0.00 30.24 30.50 3f0k n GLN 217 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3f0k n LYS 218 N -2.24 0.93 -2.58 -1.09 5.02 0.02 -4.75 118.16 113.48 3f0k n LYS 218 Ca 0.01 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 3f0k n LYS 218 Cb 0.19 -1.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 3f0k n LYS 218 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3f0k s ASN 219 N -1.79 6.32 0.25 4.39 3.04 -0.93 -4.82 114.94 121.40 3f0k s ASN 219 Ca 0.35 -0.96 0.24 0.00 0.04 0.00 0.00 52.86 52.53 3f0k s ASN 219 Cb 0.16 -2.55 0.96 0.00 -1.54 0.00 0.00 41.25 38.28 3f0k s ASN 219 CO 0.27 -1.66 1.72 0.47 -3.04 0.00 0.00 177.10 174.87 3f0k n ASP 220 N 9.01 0.69 -0.03 -4.21 10.43 -1.26 -1.84 116.55 129.34 3f0k n ASP 220 Ca 0.17 0.66 -0.15 0.00 2.57 0.00 0.00 54.79 58.03 3f0k n ASP 220 Cb 0.50 -0.81 -0.09 0.00 1.84 0.00 0.00 41.12 42.56 3f0k n ASP 220 CO 0.00 0.00 0.00 0.11 -1.07 0.00 0.00 177.20 176.24 3f0k h LYS 221 N 0.00 0.35 -0.36 -1.24 1.79 -1.99 -0.68 116.57 114.43 3f0k h LYS 221 Ca 0.00 -0.28 -0.01 0.00 -2.18 0.00 0.00 60.65 58.18 3f0k h LYS 221 Cb 0.41 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 3f0k h LYS 221 CO 0.00 0.91 0.18 1.15 -1.08 0.00 0.00 179.45 180.61 3f0k h THR 222 N -0.13 1.16 -0.85 -0.16 2.02 -1.93 -3.15 112.91 109.86 3f0k h THR 222 Ca -0.02 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 3f0k h THR 222 Cb 0.97 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 3f0k h THR 222 CO 0.07 0.17 0.49 -0.09 0.37 0.00 0.00 175.52 176.53 3f0k h ARG 223 N 0.45 1.18 -0.63 6.66 2.43 -1.25 -2.19 114.38 121.02 3f0k h ARG 223 Ca 0.13 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3f0k h ARG 223 Cb 0.11 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 3f0k h ARG 223 CO -0.02 0.85 0.19 -0.09 -1.51 0.00 0.00 179.97 179.39 3f0k h ARG 224 N 1.18 0.99 -0.45 0.20 2.43 -1.14 0.13 114.38 117.73 3f0k h ARG 224 Ca 0.30 -0.22 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3f0k h ARG 224 Cb -0.00 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 3f0k h ARG 224 CO -0.05 0.88 0.25 0.28 -1.51 0.00 0.00 179.97 179.81 3f0k h VAL 225 N 0.92 1.01 -0.51 0.20 2.07 -1.41 -0.79 116.25 117.73 3f0k h VAL 225 Ca 0.20 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 3f0k h VAL 225 Cb 0.31 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 3f0k h VAL 225 CO -0.00 0.09 0.03 -0.07 0.02 0.00 0.00 177.57 177.63 3f0k h LEU 226 N 0.49 0.87 -1.02 2.57 3.38 -0.80 -2.98 115.31 117.81 3f0k h LEU 226 Ca 0.19 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3f0k h LEU 226 Cb 0.05 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3f0k h LEU 226 CO -0.11 0.95 0.41 -0.33 0.09 0.00 0.00 178.44 179.45 3f0k h GLU 227 N 0.76 1.09 0.00 1.13 5.08 -0.45 -0.03 114.58 122.17 3f0k h GLU 227 Ca 0.15 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3f0k h GLU 227 Cb 0.48 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3f0k h GLU 227 CO 0.02 0.82 -0.20 0.87 -1.00 0.00 0.00 179.01 179.52 3f0k h LYS 228 N 1.09 0.00 0.00 2.33 1.57 -1.00 0.08 116.57 120.65 3f0k h LYS 228 Ca 0.27 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.70 3f0k h LYS 228 Cb 0.06 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 3f0k h LYS 228 CO -0.04 0.20 -2.19 0.00 -0.57 0.00 0.00 179.45 176.84 3f0k n ALA 229 N -2.36 1.49 0.00 3.86 0.00 -1.01 -4.05 120.51 118.44 3f0k n ALA 229 Ca -0.02 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.27 3f0k n ALA 229 Cb 0.29 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.37 3f0k n ALA 229 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3f0k n PHE 230 N -2.87 0.00 0.00 0.00 3.01 -0.06 -2.58 117.46 114.97 3f0k n PHE 230 Ca -0.29 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.17 3f0k n PHE 230 Cb 1.12 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.59 3f0k n PHE 230 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3f0k n GLY 231 N 1.01 0.08 0.08 1.37 0.00 0.01 -4.45 105.19 103.29 3f0k n GLY 231 Ca 0.00 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.11 3f0k n GLY 231 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3f0k h GLU 232 N 0.00 -0.08 -0.35 1.61 4.81 -1.92 -1.18 114.58 117.47 3f0k h GLU 232 Ca 0.00 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3f0k h GLU 232 Cb 0.00 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3f0k h GLU 232 CO 0.00 -0.06 0.19 0.00 -0.73 0.00 0.00 179.01 178.41 3f0k h ALA 233 N 0.87 0.45 -0.58 2.92 0.00 -1.99 -0.18 119.26 120.76 3f0k h ALA 233 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3f0k h ALA 233 Cb 0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3f0k h ALA 233 CO -0.01 -0.01 0.37 2.35 0.00 0.00 0.00 179.25 181.95 3f0k h TRP 234 N 0.44 0.70 -0.57 0.00 7.01 -1.76 -0.72 115.95 121.06 3f0k h TRP 234 Ca 0.12 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.05 3f0k h TRP 234 Cb 0.07 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 26.87 3f0k h TRP 234 CO -0.03 0.43 0.01 0.00 -2.79 0.00 0.00 178.44 176.06 3f0k h ALA 235 N 1.23 0.93 -0.47 2.65 0.00 -0.85 0.10 119.26 122.84 3f0k h ALA 235 Ca 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3f0k h ALA 235 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3f0k h ALA 235 CO -0.07 0.64 0.23 1.49 0.00 0.00 0.00 179.25 181.55 3f0k h GLU 236 N 0.91 0.68 -0.72 0.00 4.57 -0.77 -0.10 114.58 119.14 3f0k h GLU 236 Ca 0.17 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.20 3f0k h GLU 236 Cb 0.52 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 3f0k h GLU 236 CO 0.03 0.57 0.27 -0.09 -1.18 0.00 0.00 179.01 178.60 3f0k h ARG 237 N 0.62 1.09 -0.24 1.92 2.43 -0.78 -1.84 114.38 117.57 3f0k h ARG 237 Ca 0.16 -0.21 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 3f0k h ARG 237 Cb 0.11 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3f0k h ARG 237 CO -0.02 0.91 0.04 -0.92 -1.51 0.00 0.00 179.97 178.47 3f0k h TYR 238 N 1.05 0.43 -0.37 2.20 3.20 -0.50 0.16 116.97 123.14 3f0k h TYR 238 Ca 0.24 -0.06 -0.13 0.00 3.14 0.00 0.00 58.73 61.92 3f0k h TYR 238 Cb 0.24 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3f0k h TYR 238 CO 0.02 0.53 -0.29 0.52 -1.64 0.00 0.00 178.16 177.30 3f0k h MET 239 N 0.21 0.78 0.00 1.82 2.86 -0.98 0.46 114.93 120.09 3f0k h MET 239 Ca 0.07 -0.35 -0.03 0.00 -2.06 0.00 0.00 59.70 57.33 3f0k h MET 239 Cb 0.33 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 3f0k h MET 239 CO 0.01 0.98 -1.03 0.66 1.06 0.00 0.00 176.91 178.58 3f0k h SER 240 N 0.67 0.00 0.00 1.22 4.64 -1.25 -0.60 113.55 118.23 3f0k h SER 240 Ca 0.08 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.26 3f0k h SER 240 Cb 0.82 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.89 3f0k h SER 240 CO 0.07 0.10 -1.52 0.00 -0.87 0.00 0.00 176.83 174.61 3f0k n GLN 241 N -2.73 2.06 -0.13 4.77 1.13 0.54 -3.72 117.38 119.29 3f0k n GLN 241 Ca -0.01 0.01 -0.26 0.00 -1.94 0.00 0.00 57.00 54.80 3f0k n GLN 241 Cb 0.60 -1.19 -0.09 0.00 0.11 0.00 0.00 30.24 29.67 3f0k n GLN 241 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3f0k n VAL 242 N -2.42 1.52 -0.04 5.09 0.31 -0.12 -4.58 118.33 118.09 3f0k n VAL 242 Ca -0.13 -0.30 -0.07 0.00 -0.01 0.00 0.00 64.34 63.83 3f0k n VAL 242 Cb 0.72 -1.96 -0.06 0.00 -0.91 0.00 0.00 33.84 31.63 3f0k n VAL 242 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3f0k h LEU 243 N -1.00 -0.02 -5.74 7.52 3.38 -1.09 -3.43 115.31 114.93 3f0k h LEU 243 Ca -0.59 -0.45 -0.56 0.00 0.09 0.00 0.00 57.88 56.38 3f0k h LEU 243 Cb 1.51 0.01 -0.41 0.00 0.09 0.00 0.00 40.66 41.86 3f0k h LEU 243 CO -0.36 0.69 -0.85 0.49 0.09 0.00 0.00 178.44 178.50 3f0k n PHE 244 N -4.73 2.34 -2.34 1.13 3.01 -0.23 -5.05 117.46 111.59 3f0k n PHE 244 Ca -0.05 -3.92 -0.41 0.00 1.01 0.00 0.00 57.45 54.07 3f0k n PHE 244 Cb 0.23 -0.47 -0.03 0.00 -0.01 0.00 0.00 39.48 39.20 3f0k n PHE 244 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 3f0k s ASP 245 N -2.72 7.03 -0.32 4.37 -4.77 -1.24 -4.66 116.67 114.36 3f0k s ASP 245 Ca 0.43 2.22 -0.20 0.00 -3.30 0.00 0.00 52.55 51.70 3f0k s ASP 245 Cb 0.26 -2.60 -0.01 0.00 -1.09 0.00 0.00 42.92 39.49 3f0k s ASP 245 CO -0.10 -0.44 0.64 -0.69 0.70 0.00 0.00 175.17 175.28 3f0k s VAL 246 N 0.29 4.92 -2.09 2.11 1.01 -1.26 -4.94 120.40 120.46 3f0k s VAL 246 Ca 0.56 0.81 0.31 0.00 0.00 0.00 0.00 61.98 63.66 3f0k s VAL 246 Cb -0.33 -4.02 0.85 0.00 0.00 0.00 0.00 36.38 32.88 3f0k s VAL 246 CO 0.35 -0.18 2.15 2.30 0.00 0.00 0.00 175.10 179.71