#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f1j n THR 6 N 0.00 0.93 0.19 -5.08 -2.24 -1.26 -1.33 114.28 105.49 2f1j n THR 6 Ca 0.00 0.23 0.04 0.00 -2.27 0.00 0.00 64.05 62.05 2f1j n THR 6 Cb 0.00 -1.05 0.43 0.00 -2.10 0.00 0.00 70.33 67.61 2f1j n THR 6 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2f1j h ASP 7 N 0.00 0.04 -2.95 3.42 5.19 -1.98 -3.44 116.42 116.70 2f1j h ASP 7 Ca 0.00 -0.01 -0.53 0.00 -0.62 0.00 0.00 57.03 55.87 2f1j h ASP 7 Cb 0.13 -0.01 0.03 0.00 0.18 0.00 0.00 39.33 39.66 2f1j h ASP 7 CO 0.00 0.29 0.77 -0.76 -3.12 0.00 0.00 179.24 176.42 2f1j s LEU 8 N -8.49 4.37 -0.02 1.55 1.43 -0.44 -4.95 118.68 112.13 2f1j s LEU 8 Ca -0.04 2.37 -0.37 0.00 -1.03 0.00 0.00 54.13 55.07 2f1j s LEU 8 Cb 0.15 -3.59 -0.16 0.00 0.03 0.00 0.00 46.19 42.63 2f1j s LEU 8 CO 0.71 -0.70 1.54 -2.65 0.23 0.00 0.00 176.35 175.48 2f1j n PRO 9 N 4.10 1.40 0.00 1.29 -0.02 -1.26 -0.74 135.00 139.76 2f1j n PRO 9 Ca 0.12 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2f1j n PRO 9 Cb 0.42 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2f1j n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f1j n GLY 10 N 3.29 2.58 3.53 -1.23 0.00 -1.26 -3.67 105.19 108.43 2f1j n GLY 10 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 2f1j n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f1j s VAL 11 N -2.16 4.73 0.15 1.61 1.01 0.08 -5.00 120.40 120.82 2f1j s VAL 11 Ca 0.00 0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.27 2f1j s VAL 11 Cb 0.00 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.13 2f1j s VAL 11 CO 0.00 -0.67 0.21 0.61 0.00 0.00 0.00 175.10 175.24 2f1j n GLY 12 N 5.01 1.67 0.24 4.51 0.00 -1.26 -4.46 105.19 110.91 2f1j n GLY 12 Ca 0.00 -2.11 -0.07 0.00 0.00 0.00 0.00 46.02 43.84 2f1j n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2f1j h PRO 13 N 0.00 0.79 -0.60 1.61 0.11 -1.96 -1.69 132.00 130.26 2f1j h PRO 13 Ca -0.07 -0.09 -0.10 0.00 0.11 0.00 0.00 66.00 65.85 2f1j h PRO 13 Cb 0.31 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2f1j h PRO 13 CO 0.09 0.60 -0.02 0.66 -0.21 0.00 0.00 178.00 179.12 2f1j h SER 14 N 0.76 1.05 -0.12 -2.05 4.64 -2.00 -2.53 113.55 113.30 2f1j h SER 14 Ca 0.20 -0.31 -0.14 0.00 -0.47 0.00 0.00 61.79 61.06 2f1j h SER 14 Cb 0.04 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.84 2f1j h SER 14 CO -0.03 1.11 -0.42 0.74 -0.87 0.00 0.00 176.83 177.36 2f1j h THR 15 N 0.97 1.30 -0.82 2.95 2.02 -1.93 -2.85 112.91 114.54 2f1j h THR 15 Ca 0.17 -1.60 0.07 0.00 0.77 0.00 0.00 66.41 65.82 2f1j h THR 15 Cb 0.59 1.54 -0.05 0.00 -1.74 0.00 0.00 68.15 68.49 2f1j h THR 15 CO 0.04 0.51 0.54 0.00 0.37 0.00 0.00 175.52 176.97 2f1j h ALA 16 N 1.00 1.62 -0.26 6.16 0.00 -1.04 -0.27 119.26 126.46 2f1j h ALA 16 Ca 0.04 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2f1j h ALA 16 Cb 0.95 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2f1j h ALA 16 CO 0.09 0.24 -0.32 0.93 0.00 0.00 0.00 179.25 180.19 2f1j h GLU 17 N 0.88 0.68 -0.72 0.00 5.08 -1.27 -1.42 114.58 117.81 2f1j h GLU 17 Ca 0.36 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2f1j h GLU 17 Cb 0.26 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2f1j h GLU 17 CO -0.13 0.99 0.46 0.87 -1.00 0.00 0.00 179.01 180.20 2f1j h LYS 18 N 0.41 0.96 -0.40 2.33 1.57 -1.13 -1.71 116.57 118.60 2f1j h LYS 18 Ca 0.04 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2f1j h LYS 18 Cb 0.89 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 2f1j h LYS 18 CO 0.08 0.65 -0.14 -0.07 -0.57 0.00 0.00 179.45 179.39 2f1j h LEU 19 N 0.98 0.81 -0.97 2.94 3.38 -0.89 -2.50 115.31 119.05 2f1j h LEU 19 Ca 0.26 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 2f1j h LEU 19 Cb -0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2f1j h LEU 19 CO -0.05 1.01 -0.14 1.62 0.09 0.00 0.00 178.44 180.96 2f1j h VAL 20 N 0.60 1.25 0.00 1.22 3.04 -0.77 -1.42 116.25 120.17 2f1j h VAL 20 Ca 0.09 -1.11 0.00 0.00 -1.01 0.00 0.00 66.70 64.67 2f1j h VAL 20 Cb 0.68 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 2f1j h VAL 20 CO 0.05 0.37 0.00 -0.62 -1.01 0.00 0.00 177.57 176.35 2f1j n GLU 21 N -4.17 0.19 -0.10 4.17 1.02 -0.69 -2.85 120.64 118.22 2f1j n GLU 21 Ca 0.01 0.21 0.12 0.00 -0.02 0.00 0.00 57.16 57.47 2f1j n GLU 21 Cb 0.35 -1.75 0.26 0.00 -0.02 0.00 0.00 31.44 30.28 2f1j n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2f1j n ALA 22 N -1.72 2.47 0.00 0.62 0.00 -0.95 -4.94 120.51 115.99 2f1j n ALA 22 Ca 0.05 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.73 2f1j n ALA 22 Cb 0.38 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2f1j n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f1j n GLY 23 N 1.35 1.98 3.49 0.00 0.00 -1.13 -5.02 105.19 105.86 2f1j n GLY 23 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2f1j n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f1j s TYR 24 N -2.44 2.81 -0.13 1.61 1.51 -0.57 -4.77 117.35 115.38 2f1j s TYR 24 Ca 0.00 -1.00 0.09 0.00 -1.01 0.00 0.00 57.07 55.15 2f1j s TYR 24 Cb 0.00 -4.44 -0.14 0.00 -0.11 0.00 0.00 41.96 37.27 2f1j s TYR 24 CO 0.00 -1.69 -0.00 0.44 -1.11 0.00 0.00 175.55 173.18 2f1j n ILE 25 N 6.06 0.88 -4.05 2.71 -5.35 -1.26 -3.73 119.36 114.61 2f1j n ILE 25 Ca 0.21 -0.49 -0.22 0.00 -0.27 0.00 0.00 62.75 61.98 2f1j n ILE 25 Cb 0.49 -0.76 -0.03 0.00 -1.74 0.00 0.00 39.64 37.60 2f1j n ILE 25 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2f1j s ASP 26 N -4.79 5.89 0.19 7.28 -4.77 -1.26 -4.77 116.67 114.44 2f1j s ASP 26 Ca -0.10 -0.09 -0.11 0.00 -3.30 0.00 0.00 52.55 48.95 2f1j s ASP 26 Cb 0.04 -1.62 0.11 0.00 -1.09 0.00 0.00 42.92 40.37 2f1j s ASP 26 CO 0.48 -0.04 1.79 -0.26 0.70 0.00 0.00 175.17 177.84 2f1j h PHE 27 N 1.42 0.95 -0.69 2.11 0.05 -1.96 -3.01 116.94 115.81 2f1j h PHE 27 Ca -0.50 -0.04 0.03 0.00 3.82 0.00 0.00 57.97 61.28 2f1j h PHE 27 Cb 1.23 -0.30 -0.04 0.00 2.00 0.00 0.00 35.95 38.85 2f1j h PHE 27 CO 0.51 0.70 0.46 0.52 -0.18 0.00 0.00 178.31 180.31 2f1j h MET 28 N 0.93 0.83 0.00 1.51 2.86 -1.96 0.41 114.93 119.51 2f1j h MET 28 Ca 0.23 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.77 2f1j h MET 28 Cb 0.08 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 2f1j h MET 28 CO -0.03 0.55 -0.28 -0.22 1.06 0.00 0.00 176.91 177.99 2f1j h LYS 29 N 0.85 0.00 0.12 1.72 3.64 -1.94 -1.32 116.57 119.65 2f1j h LYS 29 Ca 0.27 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.38 2f1j h LYS 29 Cb 0.03 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2f1j h LYS 29 CO -0.07 0.28 -1.38 0.82 -2.27 0.00 0.00 179.45 176.82 2f1j h ILE 30 N 0.00 1.06 -0.14 2.00 2.04 -1.17 -2.81 117.51 118.48 2f1j h ILE 30 Ca -0.00 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.45 2f1j h ILE 30 Cb 0.74 2.74 -0.01 0.00 -0.74 0.00 0.00 36.82 39.55 2f1j h ILE 30 CO 0.04 0.71 0.09 0.00 0.00 0.00 0.00 178.15 178.99 2f1j h ALA 31 N -0.04 1.90 -0.25 1.87 0.00 -0.15 -1.90 119.26 120.69 2f1j h ALA 31 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2f1j h ALA 31 Cb 1.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.49 2f1j h ALA 31 CO 0.07 0.09 0.00 0.25 0.00 0.00 0.00 179.25 179.66 2f1j n THR 32 N -4.52 0.35 -2.60 0.00 -2.24 -0.50 -4.69 114.28 100.08 2f1j n THR 32 Ca -0.01 -0.68 -0.32 0.00 -2.27 0.00 0.00 64.05 60.77 2f1j n THR 32 Cb 0.08 1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.38 2f1j n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2f1j s ALA 33 N -1.50 3.12 0.30 6.98 0.00 -0.72 -5.04 121.76 124.90 2f1j s ALA 33 Ca 0.32 0.16 -0.11 0.00 0.00 0.00 0.00 51.96 52.33 2f1j s ALA 33 Cb 0.20 -3.04 -0.07 0.00 0.00 0.00 0.00 23.12 20.20 2f1j s ALA 33 CO 0.28 -0.09 0.65 0.95 0.00 0.00 0.00 175.76 177.55 2f1j s THR 34 N -2.45 4.83 0.57 0.00 -4.23 -1.26 -4.93 115.64 108.17 2f1j s THR 34 Ca 0.58 0.61 0.27 0.00 -1.18 0.00 0.00 61.69 61.97 2f1j s THR 34 Cb -0.10 -3.65 0.37 0.00 1.34 0.00 0.00 72.50 70.47 2f1j s THR 34 CO 0.26 -0.21 2.01 0.58 -0.54 0.00 0.00 174.62 176.72 2f1j h VAL 35 N 1.76 0.54 -0.03 2.29 2.07 -1.96 -1.78 116.25 119.13 2f1j h VAL 35 Ca -0.47 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2f1j h VAL 35 Cb 1.18 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 2f1j h VAL 35 CO 0.67 0.00 -0.00 1.23 0.02 0.00 0.00 177.57 179.49 2f1j h GLY 36 N 0.00 0.07 0.43 2.17 0.00 -1.98 -1.88 103.07 101.87 2f1j h GLY 36 Ca 0.17 -0.05 0.07 0.00 0.00 0.00 0.00 47.33 47.52 2f1j h GLY 36 CO -0.00 0.05 0.10 0.83 0.00 0.00 0.00 176.54 177.51 2f1j h GLU 37 N -0.24 0.22 -0.21 4.80 5.08 -1.71 -2.67 114.58 119.85 2f1j h GLU 37 Ca 0.01 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.25 2f1j h GLU 37 Cb 0.33 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2f1j h GLU 37 CO 0.00 0.15 -0.27 -0.07 -1.00 0.00 0.00 179.01 177.82 2f1j h LEU 38 N 0.23 0.61 -2.24 1.33 3.38 -1.57 -3.04 115.31 114.01 2f1j h LEU 38 Ca 0.23 -0.50 0.03 0.00 0.09 0.00 0.00 57.88 57.73 2f1j h LEU 38 Cb 0.29 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2f1j h LEU 38 CO -0.29 0.98 0.12 0.71 0.09 0.00 0.00 178.44 180.05 2f1j h THR 39 N 0.24 0.61 0.00 0.22 1.35 -1.23 0.40 112.91 114.50 2f1j h THR 39 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 2f1j h THR 39 Cb 0.84 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 2f1j h THR 39 CO 0.06 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.80 2f1j n ASP 40 N -4.00 0.00 0.21 5.36 10.43 -1.02 -3.23 116.55 124.31 2f1j n ASP 40 Ca -0.00 0.22 0.15 0.00 2.57 0.00 0.00 54.79 57.72 2f1j n ASP 40 Cb 0.23 -0.40 0.68 0.00 1.84 0.00 0.00 41.12 43.48 2f1j n ASP 40 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 2f1j h ILE 41 N 0.00 0.00 -3.77 0.53 1.08 -0.24 -3.48 117.51 111.63 2f1j h ILE 41 Ca 0.00 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 2f1j h ILE 41 Cb 0.34 1.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 2f1j h ILE 41 CO 0.00 0.00 -0.70 1.21 -0.69 0.00 0.00 178.15 177.97 2f1j n GLU 42 N -2.60 -3.86 0.00 2.37 4.07 -1.20 -4.71 120.64 114.71 2f1j n GLU 42 Ca 0.00 2.92 0.00 0.00 -0.06 0.00 0.00 57.16 60.02 2f1j n GLU 42 Cb 0.18 -3.39 0.00 0.00 -0.06 0.00 0.00 31.44 28.17 2f1j n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2f1j n GLY 43 N 1.34 0.44 3.08 8.31 0.00 -1.26 -5.03 105.19 112.07 2f1j n GLY 43 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2f1j n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f1j s ILE 44 N -2.00 2.38 0.98 -0.61 -1.09 -1.26 -5.02 121.20 114.58 2f1j s ILE 44 Ca 0.00 -1.79 -0.12 0.00 -2.23 0.00 0.00 60.65 56.51 2f1j s ILE 44 Cb 0.00 -2.49 0.18 0.00 -1.58 0.00 0.00 42.46 38.57 2f1j s ILE 44 CO 0.00 -0.21 1.08 -0.94 -1.23 0.00 0.00 174.94 173.65 2f1j s SER 45 N 1.11 2.69 0.41 3.58 1.04 -1.26 -4.36 113.70 116.91 2f1j s SER 45 Ca -0.03 1.44 0.23 0.00 0.48 0.00 0.00 55.95 58.07 2f1j s SER 45 Cb -0.20 -2.12 0.69 0.00 0.10 0.00 0.00 66.02 64.50 2f1j s SER 45 CO -0.05 -3.12 1.73 1.05 0.98 0.00 0.00 173.24 173.82 2f1j h GLU 46 N -1.88 0.00 0.20 4.02 4.11 -1.93 -0.43 114.58 118.65 2f1j h GLU 46 Ca -0.53 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.89 2f1j h GLU 46 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2f1j h GLU 46 CO 0.54 0.24 -0.09 -0.22 0.07 0.00 0.00 179.01 179.55 2f1j h LYS 47 N 0.00 -0.25 -0.63 1.06 1.63 -1.99 -1.69 116.57 114.70 2f1j h LYS 47 Ca -0.00 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2f1j h LYS 47 Cb 0.90 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.56 2f1j h LYS 47 CO 0.03 0.14 0.41 0.00 -3.45 0.00 0.00 179.45 176.58 2f1j h ALA 48 N -0.34 1.54 -0.70 5.00 0.00 -1.92 -0.83 119.26 122.01 2f1j h ALA 48 Ca -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2f1j h ALA 48 Cb 0.51 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2f1j h ALA 48 CO 0.04 0.42 0.30 0.00 0.00 0.00 0.00 179.25 180.02 2f1j h ALA 49 N 1.60 0.90 -0.01 0.00 0.00 -1.05 -1.13 119.26 119.57 2f1j h ALA 49 Ca 0.23 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 2f1j h ALA 49 Cb -0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2f1j h ALA 49 CO -0.05 0.50 -0.83 0.00 0.00 0.00 0.00 179.25 178.87 2f1j h ALA 50 N 1.14 0.58 -0.17 0.00 0.00 -0.63 -2.75 119.26 117.43 2f1j h ALA 50 Ca 0.24 -0.70 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 2f1j h ALA 50 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2f1j h ALA 50 CO -0.02 0.90 -0.17 -0.22 0.00 0.00 0.00 179.25 179.74 2f1j h LYS 51 N 0.11 0.42 0.00 0.00 3.64 -0.94 -1.10 116.57 118.69 2f1j h LYS 51 Ca -0.04 -0.22 -0.09 0.00 -1.27 0.00 0.00 60.65 59.04 2f1j h LYS 51 Cb 1.44 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.26 2f1j h LYS 51 CO 0.13 0.78 -0.41 0.00 -2.27 0.00 0.00 179.45 177.68 2f1j h MET 52 N 0.07 0.00 -0.06 1.90 -0.00 -1.28 0.12 114.93 115.68 2f1j h MET 52 Ca 0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.69 2f1j h MET 52 Cb 0.70 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.30 2f1j h MET 52 CO 0.04 0.41 -0.09 0.82 -0.00 0.00 0.00 176.91 178.09 2f1j h ILE 53 N 0.00 1.40 -0.68 -0.10 2.04 -1.42 0.71 117.51 119.46 2f1j h ILE 53 Ca -0.00 -1.33 0.03 0.00 1.00 0.00 0.00 64.86 64.55 2f1j h ILE 53 Cb 0.74 2.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.91 2f1j h ILE 53 CO 0.05 0.37 0.43 -0.03 0.00 0.00 0.00 178.15 178.97 2f1j h MET 54 N -0.30 0.81 0.14 2.37 4.05 -0.98 -1.11 114.93 119.91 2f1j h MET 54 Ca 0.01 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 2f1j h MET 54 Cb 0.64 -0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 31.26 2f1j h MET 54 CO 0.02 0.54 -0.08 0.78 0.23 0.00 0.00 176.91 178.40 2f1j h GLY 55 N 0.84 -0.21 1.31 1.39 0.00 -0.62 -2.39 103.07 103.38 2f1j h GLY 55 Ca 0.28 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.73 2f1j h GLY 55 CO -0.11 -0.09 0.39 0.00 0.00 0.00 0.00 176.54 176.74 2f1j h ALA 56 N 0.65 1.69 -0.28 3.60 0.00 -0.54 -0.17 119.26 124.20 2f1j h ALA 56 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2f1j h ALA 56 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2f1j h ALA 56 CO 0.01 0.25 0.11 0.00 0.00 0.00 0.00 179.25 179.63 2f1j h ARG 57 N 0.70 0.43 -0.12 0.00 3.08 -0.92 -0.99 114.38 116.56 2f1j h ARG 57 Ca 0.24 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 2f1j h ARG 57 Cb 0.08 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2f1j h ARG 57 CO -0.06 0.45 0.06 0.22 -1.07 0.00 0.00 179.97 179.57 2f1j h ASP 58 N 0.31 0.14 -0.89 7.04 1.82 -0.85 0.17 116.42 124.16 2f1j h ASP 58 Ca 0.09 -0.08 0.10 0.00 -0.39 0.00 0.00 57.03 56.75 2f1j h ASP 58 Cb 0.19 -0.04 -0.07 0.00 0.68 0.00 0.00 39.33 40.10 2f1j h ASP 58 CO -0.01 0.18 0.58 -0.07 -1.61 0.00 0.00 179.24 178.31 2f1j h LEU 59 N 0.09 0.79 -1.20 2.28 4.07 -0.91 0.83 115.31 121.27 2f1j h LEU 59 Ca 0.04 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.03 2f1j h LEU 59 Cb 0.07 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.67 2f1j h LEU 59 CO -0.01 0.46 0.00 0.00 -1.08 0.00 0.00 178.44 177.82 2f1j n ASP 61 N 0.41 -3.08 -4.79 0.00 2.03 0.28 -4.97 116.55 106.44 2f1j n ASP 61 Ca 0.15 -0.83 -0.36 0.00 0.52 0.00 0.00 54.79 54.28 2f1j n ASP 61 Cb 0.33 -3.81 -0.07 0.00 -0.72 0.00 0.00 41.12 36.86 2f1j n ASP 61 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2f1j s LEU 62 N -7.05 4.24 0.00 -2.67 1.02 -0.26 -4.95 118.68 109.01 2f1j s LEU 62 Ca 0.38 1.80 0.00 0.00 0.02 0.00 0.00 54.13 56.33 2f1j s LEU 62 Cb -0.19 -4.14 0.00 0.00 0.02 0.00 0.00 46.19 41.87 2f1j s LEU 62 CO 0.83 -0.14 0.00 0.61 0.02 0.00 0.00 176.35 177.68 2f1j n GLY 63 N 0.26 -0.68 3.75 -3.19 0.00 -1.26 -4.74 105.19 99.32 2f1j n GLY 63 Ca 0.03 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 2f1j n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f1j s PHE 64 N -2.90 3.38 0.04 1.61 0.40 -1.26 -5.03 117.98 114.23 2f1j s PHE 64 Ca 0.00 1.49 0.03 0.00 -0.60 0.00 0.00 56.93 57.85 2f1j s PHE 64 Cb 0.00 -3.45 -0.02 0.00 0.51 0.00 0.00 43.02 40.06 2f1j s PHE 64 CO 0.00 -1.19 -0.10 0.15 0.70 0.00 0.00 175.22 174.78 2f1j s LYS 65 N -0.94 0.66 0.28 0.44 -0.14 -1.26 -5.16 119.74 113.62 2f1j s LYS 65 Ca 0.50 -0.76 -0.14 0.00 -1.36 0.00 0.00 55.97 54.21 2f1j s LYS 65 Cb -0.34 -0.55 0.01 0.00 -1.68 0.00 0.00 37.83 35.27 2f1j s LYS 65 CO 0.41 0.12 0.57 -1.54 -0.76 0.00 0.00 175.35 174.15 2f1j s SER 66 N -1.41 -0.01 1.05 2.83 1.04 -1.26 -4.86 113.70 111.07 2f1j s SER 66 Ca -0.05 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.44 2f1j s SER 66 Cb -0.09 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2f1j s SER 66 CO 0.01 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.57 2f1j n GLY 67 N -0.44 3.00 0.37 7.32 0.00 -1.26 -2.37 105.19 111.81 2f1j n GLY 67 Ca -0.03 -0.33 0.19 0.00 0.00 0.00 0.00 46.02 45.86 2f1j n GLY 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2f1j h ILE 68 N 0.00 0.54 0.00 -0.61 2.10 -2.01 -0.85 117.51 116.68 2f1j h ILE 68 Ca 0.00 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.92 2f1j h ILE 68 Cb 0.00 0.75 -0.00 0.00 -1.09 0.00 0.00 36.82 36.47 2f1j h ILE 68 CO 0.00 0.00 -0.11 0.44 -1.08 0.00 0.00 178.15 177.40 2f1j h ASP 69 N 0.00 0.00 -0.44 2.19 3.32 -1.87 -1.64 116.42 117.98 2f1j h ASP 69 Ca 0.18 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.10 2f1j h ASP 69 Cb 0.85 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 2f1j h ASP 69 CO -0.00 0.11 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.38 2f1j h LEU 70 N 0.00 0.95 -0.70 1.55 3.38 -1.28 -0.84 115.31 118.37 2f1j h LEU 70 Ca -0.00 -0.34 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 2f1j h LEU 70 Cb 0.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2f1j h LEU 70 CO 0.01 1.11 -0.06 -0.07 0.09 0.00 0.00 178.44 179.53 2f1j h LEU 71 N 0.82 0.93 -0.60 1.67 3.38 -1.43 -2.08 115.31 118.01 2f1j h LEU 71 Ca 0.11 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 2f1j h LEU 71 Cb 0.74 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2f1j h LEU 71 CO 0.06 1.02 -0.11 0.11 0.09 0.00 0.00 178.44 179.61 2f1j h LYS 72 N 0.86 1.00 -0.38 1.13 1.57 -1.12 0.10 116.57 119.72 2f1j h LYS 72 Ca 0.15 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2f1j h LYS 72 Cb 0.59 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2f1j h LYS 72 CO 0.04 1.04 0.21 0.37 -0.57 0.00 0.00 179.45 180.54 2f1j h GLN 73 N 0.88 0.53 -0.03 3.15 5.75 -0.97 -2.50 115.11 121.93 2f1j h GLN 73 Ca 0.14 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.53 2f1j h GLN 73 Cb 0.67 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 2f1j h GLN 73 CO 0.05 0.44 -0.18 -0.09 -2.65 0.00 0.00 178.83 176.39 2f1j h ARG 74 N 0.49 0.05 0.00 1.69 9.65 -1.08 -2.69 114.38 122.48 2f1j h ARG 74 Ca 0.13 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2f1j h ARG 74 Cb 0.06 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2f1j h ARG 74 CO -0.02 0.23 0.00 0.77 2.80 0.00 0.00 179.97 183.75 2f1j h SER 75 N 0.05 0.00 0.41 -3.80 0.02 -0.51 -2.76 113.55 106.96 2f1j h SER 75 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2f1j h SER 75 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2f1j h SER 75 CO 0.02 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.06 2f1j n THR 76 N -2.62 0.73 -2.82 -2.27 -2.24 -1.02 -4.51 114.28 99.54 2f1j n THR 76 Ca 0.01 0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.55 2f1j n THR 76 Cb 0.26 -0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 67.53 2f1j n THR 76 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2f1j s VAL 77 N -2.77 4.63 0.33 2.28 1.01 -1.04 -4.90 120.40 119.93 2f1j s VAL 77 Ca 0.11 1.27 0.06 0.00 0.00 0.00 0.00 61.98 63.42 2f1j s VAL 77 Cb 0.10 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 2f1j s VAL 77 CO 0.26 -0.46 0.48 -1.66 0.00 0.00 0.00 175.10 173.72 2f1j s TRP 78 N 3.37 3.17 0.00 5.22 1.48 -1.26 -4.80 118.94 126.12 2f1j s TRP 78 Ca 0.38 -0.15 0.03 0.00 -1.06 0.00 0.00 56.10 55.30 2f1j s TRP 78 Cb -0.13 -1.97 -0.01 0.00 -1.16 0.00 0.00 33.47 30.21 2f1j s TRP 78 CO 0.17 0.02 -0.10 0.15 -4.06 0.00 0.00 176.95 173.13 2f1j s LYS 79 N -4.19 0.75 -0.20 3.25 1.02 0.10 -1.72 119.74 118.75 2f1j s LYS 79 Ca 0.44 -0.40 -0.09 0.00 0.02 0.00 0.00 55.97 55.93 2f1j s LYS 79 Cb -0.09 -0.72 -0.05 0.00 -0.52 0.00 0.00 37.83 36.45 2f1j s LYS 79 CO 0.31 0.19 0.12 -1.17 -0.92 0.00 0.00 175.35 173.88 2f1j s LEU 80 N -0.41 4.06 0.56 3.17 2.96 0.24 0.38 118.68 129.64 2f1j s LEU 80 Ca 0.02 0.15 -0.19 0.00 -0.22 0.00 0.00 54.13 53.90 2f1j s LEU 80 Cb -0.04 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 2f1j s LEU 80 CO -0.00 0.15 1.12 -0.55 -1.32 0.00 0.00 176.35 175.75 2f1j s SER 81 N 0.53 5.68 0.00 3.68 0.15 -0.31 0.11 113.70 123.54 2f1j s SER 81 Ca 0.06 2.14 0.22 0.00 0.70 0.00 0.00 55.95 59.08 2f1j s SER 81 Cb -0.12 -2.58 0.11 0.00 -1.71 0.00 0.00 66.02 61.73 2f1j s SER 81 CO 0.00 -1.25 1.15 0.35 1.20 0.00 0.00 173.24 174.69 2f1j n THR 82 N -1.43 0.00 -0.96 6.45 -2.24 -1.26 -4.87 114.28 109.97 2f1j n THR 82 Ca 0.11 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2f1j n THR 82 Cb 0.51 1.39 0.00 0.00 -2.10 0.00 0.00 70.33 70.13 2f1j n THR 82 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2f1j n SER 83 N 0.81 0.00 -4.28 3.42 7.64 -1.26 -4.73 113.62 115.22 2f1j n SER 83 Ca 0.12 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.65 2f1j n SER 83 Cb 0.52 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.58 2f1j n SER 83 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2f1j s SER 84 N -3.02 3.98 0.10 6.43 0.15 -1.26 -4.05 113.70 116.03 2f1j s SER 84 Ca 0.00 -0.44 -0.21 0.00 0.70 0.00 0.00 55.95 56.00 2f1j s SER 84 Cb 0.00 -1.65 -0.11 0.00 -1.71 0.00 0.00 66.02 62.55 2f1j s SER 84 CO 0.00 0.02 1.71 0.28 1.20 0.00 0.00 173.24 176.45 2f1j h SER 85 N 7.79 0.14 -0.44 5.45 0.02 -1.89 -1.09 113.55 123.54 2f1j h SER 85 Ca -0.39 -0.06 0.08 0.00 -0.84 0.00 0.00 61.79 60.58 2f1j h SER 85 Cb 1.17 -0.04 -0.07 0.00 0.14 0.00 0.00 62.40 63.60 2f1j h SER 85 CO 0.60 0.16 0.04 -0.33 -1.14 0.00 0.00 176.83 176.17 2f1j h GLU 86 N 0.11 0.16 0.13 3.45 4.39 -1.81 -1.09 114.58 119.92 2f1j h GLU 86 Ca 0.04 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2f1j h GLU 86 Cb 0.05 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2f1j h GLU 86 CO -0.01 0.10 -0.06 1.25 -1.16 0.00 0.00 179.01 179.13 2f1j h LEU 87 N 0.16 -0.15 -0.82 1.33 5.85 -1.81 -1.97 115.31 117.91 2f1j h LEU 87 Ca 0.22 -0.24 0.14 0.00 0.84 0.00 0.00 57.88 58.84 2f1j h LEU 87 Cb 0.30 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.28 2f1j h LEU 87 CO -0.33 0.16 0.40 0.44 -0.34 0.00 0.00 178.44 178.78 2f1j h ASP 88 N -0.47 0.47 0.10 1.25 3.45 -1.03 -0.09 116.42 120.10 2f1j h ASP 88 Ca -0.02 0.09 -0.00 0.00 0.43 0.00 0.00 57.03 57.53 2f1j h ASP 88 Cb 0.38 0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 2f1j h ASP 88 CO 0.03 0.20 -0.05 -1.28 -1.57 0.00 0.00 179.24 176.57 2f1j h SER 89 N 0.59 -0.11 0.11 6.45 0.87 -1.10 0.26 113.55 120.61 2f1j h SER 89 Ca 0.44 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 61.00 2f1j h SER 89 Cb 0.63 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2f1j h SER 89 CO -0.36 -0.08 -0.03 0.58 -0.53 0.00 0.00 176.83 176.41 2f1j h VAL 90 N -0.14 0.44 -0.00 2.23 2.07 -0.50 0.75 116.25 121.10 2f1j h VAL 90 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2f1j h VAL 90 Cb 0.10 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2f1j h VAL 90 CO 0.02 0.03 -0.15 0.18 0.02 0.00 0.00 177.57 177.67 2f1j n LEU 91 N -3.65 0.36 -0.16 2.57 4.77 -0.14 -4.90 117.00 115.84 2f1j n LEU 91 Ca -0.03 0.12 -0.01 0.00 -0.03 0.00 0.00 56.01 56.06 2f1j n LEU 91 Cb 0.12 -0.27 -0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2f1j n LEU 91 CO 0.27 0.07 -0.02 0.61 -1.33 0.00 0.00 177.39 176.99 2f1j n GLY 92 N 1.37 0.35 0.00 -0.72 0.00 0.26 -4.17 105.19 102.27 2f1j n GLY 92 Ca 0.11 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2f1j n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f1j n GLY 93 N -1.38 4.21 0.00 -0.02 0.00 0.84 -5.02 105.19 103.82 2f1j n GLY 93 Ca -0.02 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2f1j n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f1j n GLY 94 N 0.00 -0.02 3.69 -0.02 0.00 -1.18 -4.74 105.19 102.91 2f1j n GLY 94 Ca 0.00 -1.34 -0.44 0.00 0.00 0.00 0.00 46.02 44.24 2f1j n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f1j n LEU 95 N 0.00 3.43 -4.79 0.99 4.77 0.12 -4.58 117.00 116.94 2f1j n LEU 95 Ca 0.00 1.09 -0.39 0.00 -0.03 0.00 0.00 56.01 56.68 2f1j n LEU 95 Cb 0.00 -1.48 -0.06 0.00 -2.33 0.00 0.00 43.42 39.55 2f1j n LEU 95 CO 0.00 -0.14 0.31 -1.61 -1.33 0.00 0.00 177.39 174.61 2f1j s GLU 96 N 0.77 4.30 0.65 3.23 2.02 -1.26 -0.59 118.70 127.82 2f1j s GLU 96 Ca 0.76 0.79 -0.10 0.00 0.02 0.00 0.00 54.97 56.44 2f1j s GLU 96 Cb -0.62 -3.29 -0.01 0.00 0.10 0.00 0.00 34.13 30.32 2f1j s GLU 96 CO 0.38 0.51 1.04 -1.54 0.02 0.00 0.00 175.26 175.67 2f1j s SER 97 N -0.71 5.78 -1.29 -0.19 1.04 -0.70 -3.81 113.70 113.82 2f1j s SER 97 Ca 0.31 1.18 0.00 0.00 0.48 0.00 0.00 55.95 57.92 2f1j s SER 97 Cb -0.19 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.81 2f1j s SER 97 CO 0.19 -1.11 0.00 0.00 0.98 0.00 0.00 173.24 173.30 2f1j n GLN 98 N -2.84 -0.92 -3.50 4.02 6.02 -0.42 -4.76 117.38 114.99 2f1j n GLN 98 Ca 0.06 0.87 -0.12 0.00 -0.01 0.00 0.00 57.00 57.80 2f1j n GLN 98 Cb 0.56 -4.95 -0.03 0.00 1.02 0.00 0.00 30.24 26.84 2f1j n GLN 98 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2f1j s SER 99 N -2.76 -0.46 -0.19 1.08 0.01 -1.25 -4.52 113.70 105.61 2f1j s SER 99 Ca 0.00 -0.06 -0.06 0.00 1.31 0.00 0.00 55.95 57.13 2f1j s SER 99 Cb 0.00 0.55 -0.03 0.00 0.21 0.00 0.00 66.02 66.75 2f1j s SER 99 CO 0.00 -0.90 0.04 -0.69 0.41 0.00 0.00 173.24 172.10 2f1j s VAL 100 N -3.58 4.43 -0.17 3.43 1.01 -1.26 -2.97 120.40 121.28 2f1j s VAL 100 Ca 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 2f1j s VAL 100 Cb -0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 2f1j s VAL 100 CO -0.11 0.43 -0.08 -0.89 0.00 0.00 0.00 175.10 174.45 2f1j s THR 101 N 0.72 3.30 -0.14 3.92 2.01 -0.38 -1.21 115.64 123.85 2f1j s THR 101 Ca 0.02 -0.55 -0.03 0.00 0.31 0.00 0.00 61.69 61.44 2f1j s THR 101 Cb -0.14 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.90 2f1j s THR 101 CO 0.02 0.48 -0.04 -0.70 -0.69 0.00 0.00 174.62 173.68 2f1j s GLU 102 N 0.86 3.50 -0.26 4.92 2.12 0.12 -1.81 118.70 128.15 2f1j s GLU 102 Ca -0.02 -0.52 -0.02 0.00 0.36 0.00 0.00 54.97 54.77 2f1j s GLU 102 Cb -0.15 -2.85 0.03 0.00 0.26 0.00 0.00 34.13 31.41 2f1j s GLU 102 CO 0.01 0.33 -0.04 -0.06 -0.54 0.00 0.00 175.26 174.96 2f1j s PHE 103 N 0.12 3.09 0.16 5.30 0.40 -0.69 0.18 117.98 126.55 2f1j s PHE 103 Ca -0.01 -1.52 0.09 0.00 -0.60 0.00 0.00 56.93 54.88 2f1j s PHE 103 Cb -0.14 -2.08 -0.04 0.00 0.51 0.00 0.00 43.02 41.27 2f1j s PHE 103 CO 0.03 -0.72 -0.13 0.00 0.70 0.00 0.00 175.22 175.10 2f1j s ALA 104 N 1.34 2.84 0.00 5.36 0.00 0.07 -1.58 121.76 129.78 2f1j s ALA 104 Ca -0.00 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.51 2f1j s ALA 104 Cb -0.17 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2f1j s ALA 104 CO -0.03 0.50 0.00 0.41 0.00 0.00 0.00 175.76 176.64 2f1j n GLY 105 N 0.28 0.32 3.72 0.00 0.00 -0.88 0.08 105.19 108.70 2f1j n GLY 105 Ca -0.12 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 2f1j n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2f1j s VAL 106 N -2.00 2.78 0.22 1.61 -7.23 -1.17 -1.98 120.40 112.62 2f1j s VAL 106 Ca 0.00 0.25 -0.31 0.00 -1.81 0.00 0.00 61.98 60.11 2f1j s VAL 106 Cb 0.00 -2.71 -0.11 0.00 0.56 0.00 0.00 36.38 34.12 2f1j s VAL 106 CO 0.00 -0.33 1.61 0.12 -0.31 0.00 0.00 175.10 176.19 2f1j s PHE 107 N -2.91 2.94 0.00 2.82 5.99 -1.26 -1.75 117.98 123.81 2f1j s PHE 107 Ca 0.63 0.62 0.00 0.00 0.00 0.00 0.00 56.93 58.18 2f1j s PHE 107 Cb -0.18 -4.01 0.00 0.00 0.00 0.00 0.00 43.02 38.83 2f1j s PHE 107 CO 0.57 -3.64 0.00 0.41 -0.00 0.00 0.00 175.22 172.55 2f1j n GLY 108 N 3.27 0.75 0.26 13.12 0.00 -1.26 -4.94 105.19 116.40 2f1j n GLY 108 Ca 0.12 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.31 2f1j n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2f1j h SER 109 N 0.00 0.00 0.00 1.61 4.64 -1.68 -3.47 113.55 114.65 2f1j h SER 109 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2f1j h SER 109 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2f1j h SER 109 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2f1j n GLY 110 N 0.11 1.49 0.36 -0.77 0.00 -1.26 -4.78 105.19 100.34 2f1j n GLY 110 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 2f1j n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f1j h LYS 111 N 0.57 -0.65 -0.62 1.61 1.57 -1.90 -1.33 116.57 115.82 2f1j h LYS 111 Ca 0.00 0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2f1j h LYS 111 Cb 0.00 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 2f1j h LYS 111 CO 0.00 -0.43 0.38 1.15 -0.57 0.00 0.00 179.45 179.97 2f1j h THR 112 N -0.67 1.17 -0.15 -0.16 2.02 -1.97 -2.18 112.91 110.98 2f1j h THR 112 Ca -0.01 -0.37 0.02 0.00 0.77 0.00 0.00 66.41 66.82 2f1j h THR 112 Cb 0.63 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2f1j h THR 112 CO -0.09 0.18 0.03 1.56 0.37 0.00 0.00 175.52 177.56 2f1j h GLN 113 N 0.84 0.09 -0.79 6.66 1.08 -1.86 -0.78 115.11 120.34 2f1j h GLN 113 Ca 0.22 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.41 2f1j h GLN 113 Cb -0.04 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.33 2f1j h GLN 113 CO -0.04 0.06 0.48 0.82 -0.95 0.00 0.00 178.83 179.19 2f1j h ILE 114 N 0.09 1.22 -0.35 2.54 2.04 -0.79 0.08 117.51 122.34 2f1j h ILE 114 Ca 0.06 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 2f1j h ILE 114 Cb 0.06 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 2f1j h ILE 114 CO -0.09 0.23 0.21 0.24 0.00 0.00 0.00 178.15 178.74 2f1j h MET 115 N 1.09 0.47 -0.24 2.37 2.86 -0.78 -1.26 114.93 119.45 2f1j h MET 115 Ca 0.28 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.86 2f1j h MET 115 Cb -0.04 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2f1j h MET 115 CO -0.05 0.37 0.08 0.45 1.06 0.00 0.00 176.91 178.81 2f1j h HIS 116 N 0.45 0.39 -0.96 -0.22 3.86 -0.49 -2.69 115.15 115.48 2f1j h HIS 116 Ca 0.12 -0.04 0.09 0.00 -1.16 0.00 0.00 60.37 59.38 2f1j h HIS 116 Cb 0.02 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.30 2f1j h HIS 116 CO -0.04 0.44 0.60 0.37 0.86 0.00 0.00 177.93 180.17 2f1j h GLN 117 N 0.22 1.01 -0.71 2.45 5.75 -0.83 -1.36 115.11 121.64 2f1j h GLN 117 Ca 0.08 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.45 2f1j h GLN 117 Cb 0.23 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 2f1j h GLN 117 CO -0.00 0.67 0.18 0.77 -2.65 0.00 0.00 178.83 177.80 2f1j h SER 118 N 1.04 1.07 -0.34 -0.69 0.02 -1.08 0.76 113.55 114.33 2f1j h SER 118 Ca 0.44 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2f1j h SER 118 Cb 0.30 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 2f1j h SER 118 CO -0.21 1.01 0.14 0.00 -1.14 0.00 0.00 176.83 176.63 2f1j h VAL 120 N 0.56 1.24 -0.23 0.00 2.07 -0.81 -3.29 116.25 115.81 2f1j h VAL 120 Ca 0.14 -1.33 0.07 0.00 0.82 0.00 0.00 66.70 66.39 2f1j h VAL 120 Cb 0.15 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2f1j h VAL 120 CO -0.01 0.32 0.17 0.78 0.02 0.00 0.00 177.57 178.85 2f1j h ASN 121 N -0.72 0.00 -0.13 0.57 2.35 -0.70 -0.16 115.58 116.80 2f1j h ASN 121 Ca -0.01 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.77 2f1j h ASN 121 Cb 0.59 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 2f1j h ASN 121 CO 0.01 0.00 0.09 0.25 -1.65 0.00 0.00 177.43 176.13 2f1j h LEU 122 N 0.00 0.03 -0.77 1.61 6.46 -1.38 -0.40 115.31 120.86 2f1j h LEU 122 Ca 0.11 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 2f1j h LEU 122 Cb 0.45 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 2f1j h LEU 122 CO -0.00 0.02 0.00 0.00 -0.62 0.00 0.00 178.44 177.84 2f1j n GLN 123 N -4.51 1.50 -3.63 1.25 1.13 -0.07 -4.51 117.38 108.54 2f1j n GLN 123 Ca -0.00 -0.76 -0.39 0.00 -1.94 0.00 0.00 57.00 53.91 2f1j n GLN 123 Cb 0.19 -1.36 -0.09 0.00 0.11 0.00 0.00 30.24 29.09 2f1j n GLN 123 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2f1j s ASN 124 N -1.57 5.57 0.51 1.08 3.84 -0.16 -4.96 114.94 119.25 2f1j s ASN 124 Ca 0.31 -2.33 0.37 0.00 0.21 0.00 0.00 52.86 51.42 2f1j s ASN 124 Cb 0.16 -1.94 1.53 0.00 -0.55 0.00 0.00 41.25 40.44 2f1j s ASN 124 CO 0.25 -0.54 1.71 1.55 -2.79 0.00 0.00 177.10 177.27 2f1j h PRO 125 N 7.83 0.06 0.00 0.43 0.13 -1.81 0.73 132.00 139.38 2f1j h PRO 125 Ca -0.10 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2f1j h PRO 125 Cb 1.02 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2f1j h PRO 125 CO 0.77 0.04 0.00 0.39 -0.23 0.00 0.00 178.00 178.97 2f1j n GLU 126 N -4.26 0.07 -0.13 0.86 1.02 -1.26 -2.78 120.64 114.16 2f1j n GLU 126 Ca 0.33 0.14 0.11 0.00 -0.02 0.00 0.00 57.16 57.71 2f1j n GLU 126 Cb 1.44 -1.50 0.30 0.00 -0.02 0.00 0.00 31.44 31.66 2f1j n GLU 126 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2f1j n PHE 127 N -1.45 0.33 -3.68 -0.32 0.99 0.25 -4.70 117.46 108.89 2f1j n PHE 127 Ca 0.06 -0.17 -0.38 0.00 -0.00 0.00 0.00 57.45 56.96 2f1j n PHE 127 Cb 0.22 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 38.60 2f1j n PHE 127 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2f1j s LEU 128 N -1.52 5.38 -0.19 4.37 1.02 -1.12 -1.17 118.68 125.46 2f1j s LEU 128 Ca 0.34 -1.93 -0.24 0.00 0.02 0.00 0.00 54.13 52.33 2f1j s LEU 128 Cb 0.19 -1.91 -0.02 0.00 0.02 0.00 0.00 46.19 44.48 2f1j s LEU 128 CO 0.28 -0.59 0.77 -0.36 0.02 0.00 0.00 176.35 176.47 2f1j s PHE 129 N 1.25 3.39 0.05 0.29 0.08 0.16 -4.88 117.98 118.32 2f1j s PHE 129 Ca 0.07 1.15 -0.23 0.00 0.12 0.00 0.00 56.93 58.03 2f1j s PHE 129 Cb -0.24 -2.96 0.06 0.00 -0.57 0.00 0.00 43.02 39.31 2f1j s PHE 129 CO -0.02 -0.24 0.54 1.52 -0.10 0.00 0.00 175.22 176.92 2f1j s TYR 130 N 2.17 -0.46 -0.46 0.36 -0.85 -1.26 0.00 117.35 116.85 2f1j s TYR 130 Ca 0.35 0.52 -0.29 0.00 -0.52 0.00 0.00 57.07 57.13 2f1j s TYR 130 Cb -0.16 0.37 0.02 0.00 0.38 0.00 0.00 41.96 42.57 2f1j s TYR 130 CO 0.11 -0.66 1.20 0.34 -1.52 0.00 0.00 175.55 175.02 2f1j s ASP 131 N -1.97 6.58 0.61 -0.18 3.68 -1.26 -4.88 116.67 119.24 2f1j s ASP 131 Ca -0.05 0.58 0.26 0.00 2.13 0.00 0.00 52.55 55.47 2f1j s ASP 131 Cb -0.01 -2.55 1.43 0.00 -1.45 0.00 0.00 42.92 40.35 2f1j s ASP 131 CO -0.02 -1.28 1.79 -0.33 0.13 0.00 0.00 175.17 175.46 2f1j h GLU 132 N 9.53 0.00 0.06 4.34 3.07 -1.96 0.54 114.58 130.15 2f1j h GLU 132 Ca -0.24 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.36 2f1j h GLU 132 Cb 1.07 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.96 2f1j h GLU 132 CO 1.12 0.00 -1.27 1.49 -1.40 0.00 0.00 179.01 178.95 2f1j h GLU 133 N 0.00 0.13 0.00 2.33 4.57 -1.97 -3.37 114.58 116.28 2f1j h GLU 133 Ca 0.00 -0.23 -0.27 0.00 -1.18 0.00 0.00 59.36 57.68 2f1j h GLU 133 Cb 0.68 0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 29.30 2f1j h GLU 133 CO 0.00 1.03 -2.12 0.00 -1.18 0.00 0.00 179.01 176.74 2f1j n ALA 134 N -2.50 1.77 -3.98 2.92 0.00 -0.25 -4.87 120.51 113.61 2f1j n ALA 134 Ca -0.08 -1.03 -0.30 0.00 0.00 0.00 0.00 53.44 52.02 2f1j n ALA 134 Cb 1.00 -0.45 -0.16 0.00 0.00 0.00 0.00 19.45 19.84 2f1j n ALA 134 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2f1j s VAL 135 N -2.73 1.58 0.54 0.00 1.01 0.02 -4.77 120.40 116.06 2f1j s VAL 135 Ca -0.08 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.75 2f1j s VAL 135 Cb 0.08 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.71 2f1j s VAL 135 CO 0.84 0.14 1.00 -0.94 0.00 0.00 0.00 175.10 176.15 2f1j s SER 136 N 1.42 6.41 0.22 3.32 1.04 -1.26 -4.24 113.70 120.61 2f1j s SER 136 Ca -0.01 1.60 -0.10 0.00 0.48 0.00 0.00 55.95 57.92 2f1j s SER 136 Cb -0.16 -2.51 0.32 0.00 0.10 0.00 0.00 66.02 63.77 2f1j s SER 136 CO -0.08 -0.73 1.68 0.11 0.98 0.00 0.00 173.24 175.19 2f1j h LYS 137 N 0.68 0.17 -0.59 4.02 1.57 -1.98 -1.22 116.57 119.22 2f1j h LYS 137 Ca -0.46 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.44 2f1j h LYS 137 Cb 1.19 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 2f1j h LYS 137 CO 0.61 0.11 0.41 0.78 -0.57 0.00 0.00 179.45 180.79 2f1j h GLY 138 N 0.17 0.32 1.61 3.86 0.00 -1.95 -1.40 103.07 105.69 2f1j h GLY 138 Ca 0.34 -0.09 -0.08 0.00 0.00 0.00 0.00 47.33 47.50 2f1j h GLY 138 CO -0.50 0.04 -0.17 -2.09 0.00 0.00 0.00 176.54 173.82 2f1j h GLU 139 N 0.21 0.46 -0.34 4.80 4.81 -1.60 -2.76 114.58 120.16 2f1j h GLU 139 Ca 0.28 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2f1j h GLU 139 Cb 0.84 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2f1j h GLU 139 CO -0.05 0.62 0.00 1.33 -0.73 0.00 0.00 179.01 180.18 2f1j n VAL 140 N -4.18 2.39 -2.96 0.32 0.24 -0.74 -4.98 118.33 108.42 2f1j n VAL 140 Ca 0.00 -1.76 -0.40 0.00 -2.04 0.00 0.00 64.34 60.14 2f1j n VAL 140 Cb 0.35 -0.25 -0.05 0.00 -1.47 0.00 0.00 33.84 32.42 2f1j n VAL 140 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f1j s ALA 141 N -2.79 3.34 -1.21 2.33 0.00 -0.61 -4.03 121.76 118.79 2f1j s ALA 141 Ca 0.45 0.29 -0.05 0.00 0.00 0.00 0.00 51.96 52.65 2f1j s ALA 141 Cb 0.36 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 2f1j s ALA 141 CO 0.11 -0.00 0.81 0.94 0.00 0.00 0.00 175.76 177.61 2f1j n GLN 142 N 3.12 -3.93 -2.18 0.00 7.27 -1.26 -4.89 117.38 115.51 2f1j n GLN 142 Ca -0.01 0.68 -0.37 0.00 0.07 0.00 0.00 57.00 57.36 2f1j n GLN 142 Cb 0.50 -5.22 -0.00 0.00 2.41 0.00 0.00 30.24 27.93 2f1j n GLN 142 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2f1j s PRO 143 N -5.56 3.64 0.07 3.69 0.04 -1.26 -4.39 135.00 131.24 2f1j s PRO 143 Ca 0.18 1.85 0.05 0.00 0.04 0.00 0.00 61.00 63.12 2f1j s PRO 143 Cb -0.04 -2.37 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 2f1j s PRO 143 CO 0.79 -0.67 -0.14 0.15 0.04 0.00 0.00 177.00 177.17 2f1j s LYS 144 N -2.75 0.82 0.17 4.56 1.02 0.08 -4.92 119.74 118.70 2f1j s LYS 144 Ca 0.65 -0.96 0.08 0.00 0.02 0.00 0.00 55.97 55.76 2f1j s LYS 144 Cb -0.30 -0.80 -0.04 0.00 -0.52 0.00 0.00 37.83 36.16 2f1j s LYS 144 CO 0.37 0.18 -0.08 0.00 -0.92 0.00 0.00 175.35 174.89 2f1j s ALA 145 N -1.34 2.99 -0.08 5.17 0.00 -0.34 -0.89 121.76 127.26 2f1j s ALA 145 Ca -0.02 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.56 2f1j s ALA 145 Cb -0.10 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2f1j s ALA 145 CO 0.02 0.49 -0.19 0.08 0.00 0.00 0.00 175.76 176.17 2f1j s VAL 146 N -1.63 1.64 -0.28 0.00 1.01 0.13 -0.10 120.40 121.16 2f1j s VAL 146 Ca 0.25 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.47 2f1j s VAL 146 Cb -0.09 -1.44 0.08 0.00 0.00 0.00 0.00 36.38 34.92 2f1j s VAL 146 CO 0.16 0.47 -0.03 -0.47 0.00 0.00 0.00 175.10 175.22 2f1j s TYR 147 N 0.46 3.08 -0.65 5.22 5.04 0.20 -0.63 117.35 130.07 2f1j s TYR 147 Ca -0.16 -2.35 -0.20 0.00 -2.44 0.00 0.00 57.07 51.92 2f1j s TYR 147 Cb -0.17 -2.14 0.10 0.00 0.35 0.00 0.00 41.96 40.10 2f1j s TYR 147 CO 0.06 -0.87 0.84 0.42 -1.34 0.00 0.00 175.55 174.66 2f1j s ILE 148 N 1.15 4.64 -0.50 3.14 1.01 0.42 -0.32 121.20 130.75 2f1j s ILE 148 Ca -0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 60.65 59.55 2f1j s ILE 148 Cb -0.19 -4.59 0.03 0.00 0.01 0.00 0.00 42.46 37.72 2f1j s ILE 148 CO -0.08 -1.29 0.95 -0.62 0.00 0.00 0.00 174.94 173.91 2f1j s ASP 149 N 3.62 6.45 -0.04 3.58 2.15 0.21 -1.37 116.67 131.27 2f1j s ASP 149 Ca 0.18 -0.01 0.19 0.00 0.43 0.00 0.00 52.55 53.33 2f1j s ASP 149 Cb -0.19 -2.46 -0.22 0.00 -0.30 0.00 0.00 42.92 39.75 2f1j s ASP 149 CO 0.06 -1.14 0.50 1.07 -0.17 0.00 0.00 175.17 175.49 2f1j n THR 150 N 6.39 0.91 0.82 1.71 5.66 0.15 -1.19 114.28 128.73 2f1j n THR 150 Ca 0.05 -0.69 0.11 0.00 -3.05 0.00 0.00 64.05 60.47 2f1j n THR 150 Cb 0.48 -0.44 -0.01 0.00 -1.55 0.00 0.00 70.33 68.82 2f1j n THR 150 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2f1j n ASP 151 N -2.66 0.73 -0.32 1.09 8.00 -1.15 -4.77 116.55 117.45 2f1j n ASP 151 Ca -0.15 -0.58 -0.03 0.00 0.71 0.00 0.00 54.79 54.74 2f1j n ASP 151 Cb 0.86 0.87 -0.00 0.00 -0.02 0.00 0.00 41.12 42.82 2f1j n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f1j n GLY 152 N 1.45 0.28 1.08 0.44 0.00 -1.26 -4.96 105.19 102.21 2f1j n GLY 152 Ca 0.03 -0.78 0.08 0.00 0.00 0.00 0.00 46.02 45.35 2f1j n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f1j n THR 153 N -3.92 2.03 -2.11 2.61 -2.24 -1.26 -4.98 114.28 104.41 2f1j n THR 153 Ca -0.03 -1.54 -0.41 0.00 -2.27 0.00 0.00 64.05 59.79 2f1j n THR 153 Cb 0.49 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 2f1j n THR 153 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2f1j s PHE 154 N -2.31 3.12 -0.30 4.78 5.36 -1.26 -4.99 117.98 122.38 2f1j s PHE 154 Ca 0.41 1.20 -0.01 0.00 -0.96 0.00 0.00 56.93 57.57 2f1j s PHE 154 Cb 0.31 -3.70 0.10 0.00 -0.34 0.00 0.00 43.02 39.38 2f1j s PHE 154 CO 0.13 -2.17 0.09 1.03 -1.46 0.00 0.00 175.22 172.85 2f1j s ARG 155 N -0.64 0.64 0.51 10.12 1.81 -1.26 -4.99 118.95 125.14 2f1j s ARG 155 Ca 0.56 -0.94 0.25 0.00 -1.72 0.00 0.00 55.73 53.88 2f1j s ARG 155 Cb -0.39 -1.89 1.34 0.00 -0.45 0.00 0.00 34.95 33.56 2f1j s ARG 155 CO 0.44 -0.96 1.95 -1.00 -0.68 0.00 0.00 175.30 175.05 2f1j h PRO 156 N 8.15 0.10 -0.15 3.54 0.13 -2.00 -0.48 132.00 141.28 2f1j h PRO 156 Ca -0.15 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2f1j h PRO 156 Cb 1.02 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 2f1j h PRO 156 CO 0.45 0.06 0.09 0.93 -0.23 0.00 0.00 178.00 179.31 2f1j h GLU 157 N 0.10 0.21 -0.40 0.86 3.07 -1.99 -0.61 114.58 115.81 2f1j h GLU 157 Ca 0.33 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.16 2f1j h GLU 157 Cb 1.17 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 29.02 2f1j h GLU 157 CO -0.04 0.18 0.19 -0.09 -1.40 0.00 0.00 179.01 177.86 2f1j h ARG 158 N 0.17 0.56 -0.06 2.33 9.65 -1.52 0.78 114.38 126.29 2f1j h ARG 158 Ca 0.05 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2f1j h ARG 158 Cb 0.03 -0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 28.50 2f1j h ARG 158 CO -0.01 0.44 0.02 0.82 2.80 0.00 0.00 179.97 184.04 2f1j h ILE 159 N 0.56 1.16 -0.70 1.20 1.08 -1.01 -0.88 117.51 118.92 2f1j h ILE 159 Ca 0.14 -0.48 0.04 0.00 -0.39 0.00 0.00 64.86 64.17 2f1j h ILE 159 Cb 0.07 1.37 -0.05 0.00 -3.07 0.00 0.00 36.82 35.15 2f1j h ILE 159 CO -0.02 0.14 0.42 0.24 -0.69 0.00 0.00 178.15 178.24 2f1j h MET 160 N -0.08 0.78 0.27 2.37 2.86 -0.26 -0.19 114.93 120.68 2f1j h MET 160 Ca 0.02 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2f1j h MET 160 Cb 0.20 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2f1j h MET 160 CO -0.00 0.52 -0.13 0.37 1.06 0.00 0.00 176.91 178.73 2f1j h GLN 161 N 0.81 -0.35 -1.00 1.72 4.15 -0.74 -0.98 115.11 118.71 2f1j h GLN 161 Ca 0.29 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.81 2f1j h GLN 161 Cb 0.08 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 27.78 2f1j h GLN 161 CO -0.14 -0.05 0.64 0.52 -1.93 0.00 0.00 178.83 177.88 2f1j h MET 162 N -0.67 1.09 -0.23 1.69 2.86 -1.05 -1.86 114.93 116.76 2f1j h MET 162 Ca -0.04 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2f1j h MET 162 Cb 0.47 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2f1j h MET 162 CO 0.06 0.72 0.10 0.00 1.06 0.00 0.00 176.91 178.85 2f1j h ALA 163 N 1.48 0.29 -0.11 6.32 0.00 -0.95 -2.30 119.26 123.99 2f1j h ALA 163 Ca 0.44 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.30 2f1j h ALA 163 Cb 0.24 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2f1j h ALA 163 CO -0.19 -0.13 -0.26 1.49 0.00 0.00 0.00 179.25 180.16 2f1j h GLU 164 N 0.22 -0.33 0.00 0.00 4.57 -0.37 0.27 114.58 118.94 2f1j h GLU 164 Ca 0.08 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2f1j h GLU 164 Cb 0.15 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2f1j h GLU 164 CO -0.01 -0.22 0.00 0.45 -1.18 0.00 0.00 179.01 178.05 2f1j h HIS 165 N -0.34 0.00 -0.00 0.92 3.86 -1.36 0.78 115.15 119.01 2f1j h HIS 165 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2f1j h HIS 165 Cb 0.48 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.95 2f1j h HIS 165 CO -0.35 0.00 -0.48 0.00 0.86 0.00 0.00 177.93 177.96 2f1j n ALA 166 N -1.86 3.51 -1.02 2.45 0.00 -0.03 -4.93 120.51 118.62 2f1j n ALA 166 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 53.44 53.07 2f1j n ALA 166 Cb 0.14 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 18.47 2f1j n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f1j n GLY 167 N 1.48 0.46 3.59 0.00 0.00 0.27 -5.04 105.19 105.95 2f1j n GLY 167 Ca 0.06 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 45.05 2f1j n GLY 167 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2f1j s ILE 168 N -2.02 2.93 -0.23 -0.61 -4.36 -0.74 -5.02 121.20 111.16 2f1j s ILE 168 Ca 0.00 -2.07 -0.29 0.00 -0.26 0.00 0.00 60.65 58.03 2f1j s ILE 168 Cb 0.00 -2.68 -0.01 0.00 1.25 0.00 0.00 42.46 41.02 2f1j s ILE 168 CO 0.00 -0.33 1.41 -0.62 0.24 0.00 0.00 174.94 175.64 2f1j s ASP 169 N -3.64 6.65 0.26 4.36 2.15 -1.26 -3.84 116.67 121.35 2f1j s ASP 169 Ca 0.32 1.52 -0.04 0.00 0.43 0.00 0.00 52.55 54.78 2f1j s ASP 169 Cb -0.04 -2.54 0.36 0.00 -0.30 0.00 0.00 42.92 40.40 2f1j s ASP 169 CO 0.18 -1.04 1.88 1.23 -0.17 0.00 0.00 175.17 177.25 2f1j h GLY 170 N 10.79 1.45 1.76 2.66 0.00 -1.87 -1.72 103.07 116.13 2f1j h GLY 170 Ca -0.29 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.53 2f1j h GLY 170 CO 1.00 0.35 -0.10 -1.61 0.00 0.00 0.00 176.54 176.18 2f1j h GLN 171 N 1.15 0.30 -0.35 4.80 5.75 -1.94 -2.07 115.11 122.77 2f1j h GLN 171 Ca 0.41 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.78 2f1j h GLN 171 Cb 0.11 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 2f1j h GLN 171 CO -0.16 0.42 -0.04 1.15 -2.65 0.00 0.00 178.83 177.56 2f1j h THR 172 N 0.29 1.21 -0.13 2.39 2.02 -1.72 0.70 112.91 117.68 2f1j h THR 172 Ca 0.06 -0.89 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 2f1j h THR 172 Cb 0.37 0.99 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2f1j h THR 172 CO 0.02 0.30 -0.05 0.58 0.37 0.00 0.00 175.52 176.74 2f1j h VAL 173 N 0.53 1.31 -0.69 3.16 2.07 -1.17 -2.43 116.25 119.02 2f1j h VAL 173 Ca 0.11 -1.07 0.05 0.00 0.82 0.00 0.00 66.70 66.61 2f1j h VAL 173 Cb 0.40 1.75 -0.05 0.00 -1.52 0.00 0.00 31.29 31.86 2f1j h VAL 173 CO 0.02 0.31 0.41 -0.07 0.02 0.00 0.00 177.57 178.25 2f1j h LEU 174 N -0.07 0.64 -1.85 2.57 4.07 -1.10 -1.49 115.31 118.07 2f1j h LEU 174 Ca 0.03 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 2f1j h LEU 174 Cb 0.51 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 2f1j h LEU 174 CO 0.02 0.42 -0.14 0.44 -1.08 0.00 0.00 178.44 178.10 2f1j h ASP 175 N 0.77 0.00 -0.36 -0.43 5.19 -0.78 -2.69 116.42 118.12 2f1j h ASP 175 Ca 0.30 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.64 2f1j h ASP 175 Cb 0.12 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.60 2f1j h ASP 175 CO -0.15 0.14 0.03 0.59 -3.12 0.00 0.00 179.24 176.72 2f1j n ASN 176 N -3.86 3.89 -3.93 6.45 4.13 -0.64 -4.90 115.26 116.40 2f1j n ASN 176 Ca -0.02 -3.18 -0.30 0.00 1.68 0.00 0.00 54.58 52.77 2f1j n ASN 176 Cb 0.23 -0.60 -0.16 0.00 -1.54 0.00 0.00 39.78 37.72 2f1j n ASN 176 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2f1j s THR 177 N -2.93 1.38 -0.15 3.41 2.01 -0.77 -1.20 115.64 117.40 2f1j s THR 177 Ca 0.45 -0.96 -0.23 0.00 0.31 0.00 0.00 61.69 61.26 2f1j s THR 177 Cb 0.37 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.27 2f1j s THR 177 CO 0.08 0.03 0.74 -0.36 -0.69 0.00 0.00 174.62 174.42 2f1j s PHE 178 N 1.49 3.44 -0.11 4.92 0.40 0.85 -4.92 117.98 124.06 2f1j s PHE 178 Ca -0.03 1.15 -0.00 0.00 -0.60 0.00 0.00 56.93 57.45 2f1j s PHE 178 Cb -0.17 -2.90 -0.02 0.00 0.51 0.00 0.00 43.02 40.44 2f1j s PHE 178 CO -0.07 -0.14 -0.10 0.08 0.70 0.00 0.00 175.22 175.69 2f1j s VAL 179 N 1.74 3.40 -0.16 -0.44 1.01 -1.26 0.62 120.40 125.31 2f1j s VAL 179 Ca 0.35 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2f1j s VAL 179 Cb -0.17 -2.42 0.04 0.00 0.00 0.00 0.00 36.38 33.83 2f1j s VAL 179 CO 0.13 0.54 -0.08 0.00 0.00 0.00 0.00 175.10 175.69 2f1j s ALA 180 N -0.09 1.66 -0.40 5.51 0.00 0.57 -4.95 121.76 124.06 2f1j s ALA 180 Ca -0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 51.96 50.81 2f1j s ALA 180 Cb -0.14 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.88 2f1j s ALA 180 CO 0.03 -0.67 0.89 0.50 0.00 0.00 0.00 175.76 176.52 2f1j s ARG 181 N 1.56 3.72 -0.19 0.00 6.06 -1.26 -0.62 118.95 128.21 2f1j s ARG 181 Ca 0.02 0.38 -0.06 0.00 -2.50 0.00 0.00 55.73 53.56 2f1j s ARG 181 Cb -0.15 -3.84 -0.03 0.00 0.06 0.00 0.00 34.95 30.98 2f1j s ARG 181 CO -0.08 -1.01 0.04 0.00 -2.50 0.00 0.00 175.30 171.74 2f1j s ALA 182 N 3.47 3.25 -1.77 6.12 0.00 -0.33 -4.98 121.76 127.52 2f1j s ALA 182 Ca 0.36 -0.85 0.22 0.00 0.00 0.00 0.00 51.96 51.70 2f1j s ALA 182 Cb -0.12 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 21.11 2f1j s ALA 182 CO 0.21 0.04 1.06 0.66 0.00 0.00 0.00 175.76 177.73 2f1j n TYR 183 N 3.84 0.00 -3.92 0.00 4.01 -1.26 -4.39 117.16 115.44 2f1j n TYR 183 Ca -0.17 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.48 2f1j n TYR 183 Cb 0.52 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 2f1j n TYR 183 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2f1j s ASN 184 N -2.61 0.08 0.36 7.72 6.03 -1.26 -5.01 114.94 120.24 2f1j s ASN 184 Ca 0.16 -1.02 0.10 0.00 -1.03 0.00 0.00 52.86 51.07 2f1j s ASN 184 Cb 0.18 0.72 0.70 0.00 -3.03 0.00 0.00 41.25 39.81 2f1j s ASN 184 CO 0.64 -1.40 1.84 0.77 -2.03 0.00 0.00 177.10 176.93 2f1j h SER 185 N 2.08 0.15 0.13 3.54 4.64 -1.94 -1.55 113.55 120.60 2f1j h SER 185 Ca -0.27 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2f1j h SER 185 Cb 1.25 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2f1j h SER 185 CO 0.34 0.43 -0.06 0.44 -0.87 0.00 0.00 176.83 177.11 2f1j h ASP 186 N 0.14 -0.15 -0.46 4.97 3.32 -1.99 0.20 116.42 122.45 2f1j h ASP 186 Ca 0.02 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2f1j h ASP 186 Cb 0.57 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2f1j h ASP 186 CO 0.04 -0.01 0.20 0.24 -1.72 0.00 0.00 179.24 177.99 2f1j h MET 187 N -0.28 0.68 -0.35 3.56 2.86 -1.95 0.95 114.93 120.39 2f1j h MET 187 Ca -0.02 -0.11 0.06 0.00 -2.06 0.00 0.00 59.70 57.56 2f1j h MET 187 Cb 0.22 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.72 2f1j h MET 187 CO 0.03 0.60 0.05 0.37 1.06 0.00 0.00 176.91 179.02 2f1j h GLN 188 N 0.60 0.15 -0.20 1.72 4.15 -1.07 0.18 115.11 120.63 2f1j h GLN 188 Ca 0.15 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 2f1j h GLN 188 Cb 0.17 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 2f1j h GLN 188 CO -0.02 0.10 -0.12 0.52 -1.93 0.00 0.00 178.83 177.39 2f1j h MET 189 N 0.16 0.44 0.03 1.69 2.86 -0.33 -2.56 114.93 117.21 2f1j h MET 189 Ca 0.17 -0.20 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2f1j h MET 189 Cb 0.21 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 2f1j h MET 189 CO -0.24 0.74 -0.10 1.25 1.06 0.00 0.00 176.91 179.62 2f1j h LEU 190 N 0.13 -0.27 -0.75 1.22 5.85 -0.54 -1.49 115.31 119.47 2f1j h LEU 190 Ca 0.04 0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.94 2f1j h LEU 190 Cb 0.62 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.67 2f1j h LEU 190 CO 0.03 -0.14 0.31 -0.26 -0.34 0.00 0.00 178.44 178.04 2f1j h PHE 191 N -0.18 0.54 -0.70 1.25 0.05 -0.68 0.21 116.94 117.42 2f1j h PHE 191 Ca 0.03 0.04 0.06 0.00 3.82 0.00 0.00 57.97 61.91 2f1j h PHE 191 Cb 0.21 -0.12 -0.06 0.00 2.00 0.00 0.00 35.95 37.98 2f1j h PHE 191 CO -0.14 0.09 0.41 0.00 -0.18 0.00 0.00 178.31 178.48 2f1j h ALA 192 N 1.53 0.95 -0.12 2.45 0.00 -0.95 -1.76 119.26 121.36 2f1j h ALA 192 Ca 0.41 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.20 2f1j h ALA 192 Cb 0.59 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2f1j h ALA 192 CO -0.38 0.10 -0.47 0.93 0.00 0.00 0.00 179.25 179.42 2f1j h GLU 193 N 0.75 0.31 0.00 0.00 5.08 0.05 -2.84 114.58 117.93 2f1j h GLU 193 Ca 0.31 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2f1j h GLU 193 Cb 0.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2f1j h GLU 193 CO -0.17 0.72 0.00 1.63 -1.00 0.00 0.00 179.01 180.19 2f1j n LYS 194 N -3.98 0.03 -0.07 2.33 5.02 0.51 -2.98 118.16 119.02 2f1j n LYS 194 Ca -0.02 0.25 0.04 0.00 -2.02 0.00 0.00 58.31 56.56 2f1j n LYS 194 Cb 0.53 -1.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.42 2f1j n LYS 194 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2f1j h ILE 195 N 0.00 1.11 -0.42 -0.18 2.04 -1.23 0.16 117.51 118.99 2f1j h ILE 195 Ca 0.00 -0.23 0.04 0.00 1.00 0.00 0.00 64.86 65.67 2f1j h ILE 195 Cb 0.22 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2f1j h ILE 195 CO 0.00 0.12 0.28 -0.33 0.00 0.00 0.00 178.15 178.22 2f1j h GLU 196 N 0.68 0.38 -0.61 2.37 5.08 -1.77 -1.69 114.58 119.02 2f1j h GLU 196 Ca 0.20 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 2f1j h GLU 196 Cb -0.02 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2f1j h GLU 196 CO -0.05 0.25 0.10 -0.44 -1.00 0.00 0.00 179.01 177.88 2f1j h ASP 197 N 0.40 0.95 -0.52 1.42 3.32 -1.18 -0.01 116.42 120.79 2f1j h ASP 197 Ca 0.18 -0.22 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 2f1j h ASP 197 Cb 0.20 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2f1j h ASP 197 CO -0.04 0.95 -0.02 -0.07 -1.72 0.00 0.00 179.24 178.34 2f1j h LEU 198 N 0.94 0.94 -0.27 1.55 3.38 -1.23 -0.49 115.31 120.13 2f1j h LEU 198 Ca 0.19 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2f1j h LEU 198 Cb 0.41 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2f1j h LEU 198 CO 0.01 1.01 0.02 0.40 0.09 0.00 0.00 178.44 179.97 2f1j h ILE 199 N 0.88 1.25 -0.35 1.22 2.04 -1.09 -0.86 117.51 120.60 2f1j h ILE 199 Ca 0.16 -0.86 0.05 0.00 1.00 0.00 0.00 64.86 65.20 2f1j h ILE 199 Cb 0.54 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2f1j h ILE 199 CO 0.03 0.28 0.24 -0.61 0.00 0.00 0.00 178.15 178.08 2f1j h GLN 200 N 0.26 0.28 0.00 2.37 4.15 -0.75 0.12 115.11 121.54 2f1j h GLN 200 Ca 0.08 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2f1j h GLN 200 Cb 0.39 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.01 2f1j h GLN 200 CO 0.01 0.18 0.00 0.39 -1.93 0.00 0.00 178.83 177.48 2f1j n GLU 201 N -4.48 0.90 -0.14 1.69 1.02 -0.21 -4.84 120.64 114.57 2f1j n GLU 201 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2f1j n GLU 201 Cb 0.22 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 2f1j n GLU 201 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2f1j n GLY 202 N 0.56 0.57 3.65 0.62 0.00 0.43 -5.05 105.19 105.96 2f1j n GLY 202 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2f1j n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2f1j s ASN 203 N -3.00 6.99 -1.32 1.61 0.01 -0.38 -4.96 114.94 113.89 2f1j s ASN 203 Ca 0.00 1.20 -0.16 0.00 -0.71 0.00 0.00 52.86 53.18 2f1j s ASN 203 Cb 0.00 -2.51 0.02 0.00 0.41 0.00 0.00 41.25 39.17 2f1j s ASN 203 CO 0.00 -0.68 2.05 -3.20 -1.51 0.00 0.00 177.10 173.76 2f1j n ASN 204 N 6.37 3.94 -4.66 -1.22 5.15 -1.26 -3.87 115.26 119.72 2f1j n ASN 204 Ca 0.10 -2.83 -0.42 0.00 -0.60 0.00 0.00 54.58 50.82 2f1j n ASN 204 Cb 0.47 -1.62 -0.03 0.00 -0.53 0.00 0.00 39.78 38.07 2f1j n ASN 204 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2f1j s ILE 205 N 4.06 3.54 0.00 -1.44 -1.09 -1.26 -0.75 121.20 124.27 2f1j s ILE 205 Ca 0.51 0.65 0.00 0.00 -2.23 0.00 0.00 60.65 59.58 2f1j s ILE 205 Cb 0.11 -3.43 0.00 0.00 -1.58 0.00 0.00 42.46 37.56 2f1j s ILE 205 CO -0.01 -0.07 0.11 0.29 -1.23 0.00 0.00 174.94 174.03 2f1j n LYS 206 N 7.22 3.82 -3.72 2.79 4.76 -0.07 -4.77 118.16 128.19 2f1j n LYS 206 Ca 0.18 -0.11 -0.15 0.00 -2.87 0.00 0.00 58.31 55.36 2f1j n LYS 206 Cb 0.43 -0.53 -0.15 0.00 -1.84 0.00 0.00 35.03 32.94 2f1j n LYS 206 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2f1j s LEU 207 N -1.15 0.38 -0.08 -0.35 2.96 -1.18 -1.21 118.68 118.05 2f1j s LEU 207 Ca 0.00 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.29 2f1j s LEU 207 Cb 0.00 0.38 0.00 0.00 0.50 0.00 0.00 46.19 47.07 2f1j s LEU 207 CO 0.00 -0.19 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.96 2f1j s VAL 208 N 1.61 1.69 -0.05 1.68 1.01 0.41 -0.69 120.40 126.06 2f1j s VAL 208 Ca -0.05 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.17 2f1j s VAL 208 Cb -0.12 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 2f1j s VAL 208 CO -0.06 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.60 2f1j s VAL 209 N 0.36 1.85 -0.32 2.92 1.01 0.20 0.14 120.40 126.55 2f1j s VAL 209 Ca -0.15 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 60.90 2f1j s VAL 209 Cb -0.16 -1.57 0.10 0.00 0.00 0.00 0.00 36.38 34.74 2f1j s VAL 209 CO 0.06 0.52 0.06 -0.63 0.00 0.00 0.00 175.10 175.11 2f1j s ILE 210 N -0.10 1.78 -0.30 2.22 -1.09 0.50 -0.44 121.20 123.78 2f1j s ILE 210 Ca -0.04 -1.98 0.01 0.00 -2.23 0.00 0.00 60.65 56.42 2f1j s ILE 210 Cb -0.13 -2.31 0.09 0.00 -1.58 0.00 0.00 42.46 38.53 2f1j s ILE 210 CO 0.03 -0.60 0.04 -0.62 -1.23 0.00 0.00 174.94 172.57 2f1j s ASP 211 N 1.16 4.24 0.53 3.58 2.15 -0.47 -2.01 116.67 125.84 2f1j s ASP 211 Ca 0.10 -1.70 0.08 0.00 0.43 0.00 0.00 52.55 51.46 2f1j s ASP 211 Cb -0.18 -1.21 0.05 0.00 -0.30 0.00 0.00 42.92 41.28 2f1j s ASP 211 CO -0.14 -0.36 0.62 -0.94 -0.17 0.00 0.00 175.17 174.19 2f1j s SER 212 N 1.31 5.04 -0.06 -0.34 1.04 -1.26 0.35 113.70 119.78 2f1j s SER 212 Ca 0.06 -0.89 -0.10 0.00 0.48 0.00 0.00 55.95 55.50 2f1j s SER 212 Cb -0.18 0.12 -0.30 0.00 0.10 0.00 0.00 66.02 65.76 2f1j s SER 212 CO -0.14 -1.14 0.62 0.25 0.98 0.00 0.00 173.24 173.82 2f1j h LEU 213 N 0.47 0.58 0.00 2.42 5.85 -0.86 -3.42 115.31 120.35 2f1j h LEU 213 Ca -0.34 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 57.45 2f1j h LEU 213 Cb 1.29 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2f1j h LEU 213 CO 0.47 1.79 -0.78 0.35 -0.34 0.00 0.00 178.44 179.93 2f1j n THR 214 N -3.57 0.00 0.07 1.05 -2.24 -1.26 -4.72 114.28 103.62 2f1j n THR 214 Ca -0.26 -0.20 -0.15 0.00 -2.27 0.00 0.00 64.05 61.17 2f1j n THR 214 Cb 1.07 0.88 -0.08 0.00 -2.10 0.00 0.00 70.33 70.10 2f1j n THR 214 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2f1j h SER 215 N 0.00 -1.47 -0.40 3.42 0.02 -1.91 -0.98 113.55 112.23 2f1j h SER 215 Ca 0.00 0.17 0.08 0.00 -0.84 0.00 0.00 61.79 61.19 2f1j h SER 215 Cb 0.36 0.56 -0.07 0.00 0.14 0.00 0.00 62.40 63.39 2f1j h SER 215 CO 0.00 -0.51 -0.04 0.71 -1.14 0.00 0.00 176.83 175.85 2f1j h THR 216 N -0.66 0.65 -0.94 -2.27 1.35 -1.88 -1.57 112.91 107.59 2f1j h THR 216 Ca 0.02 -0.02 0.05 0.00 -0.55 0.00 0.00 66.41 65.91 2f1j h THR 216 Cb 0.71 0.59 -0.06 0.00 -1.73 0.00 0.00 68.15 67.65 2f1j h THR 216 CO -0.32 0.01 0.61 -0.26 -0.25 0.00 0.00 175.52 175.31 2f1j h PHE 217 N 0.06 1.13 -0.27 4.73 -1.00 -1.77 0.78 116.94 120.59 2f1j h PHE 217 Ca 0.20 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.90 2f1j h PHE 217 Cb 0.29 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 2f1j h PHE 217 CO -0.31 0.62 -0.29 0.00 -1.61 0.00 0.00 178.31 176.72 2f1j h ARG 218 N 1.14 0.55 -0.05 1.51 3.08 -0.49 0.15 114.38 120.28 2f1j h ARG 218 Ca 0.39 -0.23 -0.23 0.00 0.07 0.00 0.00 59.98 59.98 2f1j h ARG 218 Cb 0.08 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.12 2f1j h ARG 218 CO -0.15 0.79 -0.89 -0.97 -1.07 0.00 0.00 179.97 177.68 2f1j h ASN 219 N 0.48 0.69 0.71 7.04 -0.00 -0.65 -2.72 115.58 121.12 2f1j h ASN 219 Ca 0.06 -0.51 -0.26 0.00 -0.00 0.00 0.00 56.30 55.60 2f1j h ASN 219 Cb 0.74 -0.21 -0.00 0.00 -0.00 0.00 0.00 38.32 38.85 2f1j h ASN 219 CO 0.06 1.29 -1.20 -0.33 -0.00 0.00 0.00 177.43 177.25 2f1j h GLU 220 N 0.34 0.21 -1.06 6.67 5.08 -0.74 -3.34 114.58 121.73 2f1j h GLU 220 Ca -0.07 -0.35 -0.59 0.00 -1.00 0.00 0.00 59.36 57.34 2f1j h GLU 220 Cb 1.51 0.13 -0.40 0.00 0.50 0.00 0.00 28.75 30.50 2f1j h GLU 220 CO 0.16 1.16 -0.41 0.66 -1.00 0.00 0.00 179.01 179.59 2f1j n TYR 221 N -3.48 3.00 -0.17 4.33 4.01 0.51 -4.79 117.16 120.57 2f1j n TYR 221 Ca -0.07 -2.57 -0.02 0.00 -0.16 0.00 0.00 57.90 55.08 2f1j n TYR 221 Cb 1.01 -0.51 0.06 0.00 -0.31 0.00 0.00 39.34 39.59 2f1j n TYR 221 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2f1j h THR 222 N 2.08 0.59 -1.49 -0.72 1.35 -1.61 -3.39 112.91 109.72 2f1j h THR 222 Ca 0.40 -0.04 -0.64 0.00 -0.55 0.00 0.00 66.41 65.58 2f1j h THR 222 Cb 1.17 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 68.05 2f1j h THR 222 CO 0.96 0.02 1.38 0.61 -0.25 0.00 0.00 175.52 178.24 2f1j n GLY 223 N -1.33 0.79 0.29 5.82 0.00 -1.26 -4.77 105.19 104.75 2f1j n GLY 223 Ca 0.06 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.96 2f1j n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f1j n ARG 224 N 8.08 0.87 -0.01 1.61 1.74 -1.26 -1.98 116.66 125.70 2f1j n ARG 224 Ca 0.35 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.53 2f1j n ARG 224 Cb 0.30 -1.26 -0.15 0.00 -1.02 0.00 0.00 32.46 30.34 2f1j n ARG 224 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f1j n GLY 225 N 0.19 -0.89 0.58 -0.13 0.00 -1.26 -4.12 105.19 99.56 2f1j n GLY 225 Ca 0.00 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.61 2f1j n GLY 225 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2f1j n LYS 226 N -2.08 1.93 0.08 1.61 2.85 -0.84 -4.64 118.16 117.07 2f1j n LYS 226 Ca -0.03 -2.86 0.05 0.00 -1.05 0.00 0.00 58.31 54.43 2f1j n LYS 226 Cb 0.48 -1.68 0.27 0.00 -0.65 0.00 0.00 35.03 33.46 2f1j n LYS 226 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 2f1j n LEU 227 N -1.05 0.26 0.07 -5.58 -0.00 -1.19 -2.38 117.00 107.12 2f1j n LEU 227 Ca 0.21 0.59 -0.03 0.00 -0.00 0.00 0.00 56.01 56.78 2f1j n LEU 227 Cb 0.79 -0.61 -0.01 0.00 -0.00 0.00 0.00 43.42 43.58 2f1j n LEU 227 CO 0.08 -0.68 0.36 0.00 -0.00 0.00 0.00 177.39 177.15 2f1j h ALA 228 N 1.84 -0.76 -0.89 1.96 0.00 -1.91 -1.16 119.26 118.34 2f1j h ALA 228 Ca 0.00 -0.04 0.23 0.00 0.00 0.00 0.00 54.91 55.10 2f1j h ALA 228 Cb 0.10 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 17.81 2f1j h ALA 228 CO 0.00 -0.75 0.08 1.49 0.00 0.00 0.00 179.25 180.07 2f1j h GLU 229 N -0.25 0.09 0.72 0.00 4.81 -1.87 -0.86 114.58 117.22 2f1j h GLU 229 Ca -0.02 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 2f1j h GLU 229 Cb 0.15 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 2f1j h GLU 229 CO 0.03 0.06 -0.43 -0.09 -0.73 0.00 0.00 179.01 177.85 2f1j h ARG 230 N 0.09 -1.04 -0.20 1.92 2.43 -1.56 -0.28 114.38 115.74 2f1j h ARG 230 Ca 0.53 0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.83 2f1j h ARG 230 Cb 1.05 0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.83 2f1j h ARG 230 CO -0.77 -0.69 0.24 0.37 -1.51 0.00 0.00 179.97 177.60 2f1j h GLN 231 N -1.08 0.00 0.13 0.20 5.75 -0.02 -0.71 115.11 119.38 2f1j h GLN 231 Ca -0.09 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2f1j h GLN 231 Cb 0.86 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.41 2f1j h GLN 231 CO 0.10 0.00 -0.06 1.96 -2.65 0.00 0.00 178.83 178.18 2f1j h GLN 232 N 0.00 -0.17 -0.71 1.69 4.20 -0.58 -2.76 115.11 116.79 2f1j h GLN 232 Ca 0.10 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.96 2f1j h GLN 232 Cb 0.57 0.04 -0.13 0.00 0.30 0.00 0.00 27.48 28.26 2f1j h GLN 232 CO -0.00 -0.11 -0.20 -0.22 -0.67 0.00 0.00 178.83 177.63 2f1j h LYS 233 N -0.52 -0.02 -0.85 1.46 3.64 -0.76 0.39 116.57 119.92 2f1j h LYS 233 Ca -0.02 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2f1j h LYS 233 Cb 0.13 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 2f1j h LYS 233 CO 0.03 -0.01 0.55 1.25 -2.27 0.00 0.00 179.45 179.00 2f1j h LEU 234 N -0.02 0.88 -0.44 5.20 5.85 -1.27 -0.86 115.31 124.65 2f1j h LEU 234 Ca 0.33 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 59.00 2f1j h LEU 234 Cb 0.53 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2f1j h LEU 234 CO -0.74 0.60 0.11 1.23 -0.34 0.00 0.00 178.44 179.30 2f1j h GLY 235 N 1.02 0.76 1.01 3.75 0.00 0.03 0.02 103.07 109.67 2f1j h GLY 235 Ca 0.34 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2f1j h GLY 235 CO -0.11 0.44 0.34 -0.09 0.00 0.00 0.00 176.54 177.12 2f1j h ARG 236 N 0.58 1.02 0.08 4.80 2.43 -0.50 0.66 114.38 123.45 2f1j h ARG 236 Ca 0.14 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2f1j h ARG 236 Cb 0.31 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 2f1j h ARG 236 CO 0.00 0.80 -0.12 1.25 -1.51 0.00 0.00 179.97 180.39 2f1j h HIS 237 N 0.99 -0.31 -0.95 2.20 2.76 -0.83 0.12 115.15 119.13 2f1j h HIS 237 Ca 0.24 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.43 2f1j h HIS 237 Cb 0.12 0.13 -0.05 0.00 1.55 0.00 0.00 27.41 29.16 2f1j h HIS 237 CO 0.01 -0.19 0.62 0.52 -1.30 0.00 0.00 177.93 177.60 2f1j h MET 238 N -0.25 1.22 -0.60 5.26 2.86 -0.72 -0.84 114.93 121.86 2f1j h MET 238 Ca 0.02 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2f1j h MET 238 Cb 0.26 -0.28 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 2f1j h MET 238 CO -0.06 0.81 0.40 0.00 1.06 0.00 0.00 176.91 179.11 2f1j h ALA 239 N 1.36 0.76 -0.90 6.32 0.00 -0.30 -0.41 119.26 126.09 2f1j h ALA 239 Ca 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2f1j h ALA 239 Cb -0.11 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 2f1j h ALA 239 CO -0.09 0.19 0.50 1.15 0.00 0.00 0.00 179.25 181.00 2f1j h THR 240 N 0.81 1.26 -0.55 0.00 2.02 -0.08 -1.59 112.91 114.78 2f1j h THR 240 Ca 0.22 -0.64 -0.08 0.00 0.77 0.00 0.00 66.41 66.68 2f1j h THR 240 Cb -0.09 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.34 2f1j h THR 240 CO -0.05 0.29 0.02 -0.07 0.37 0.00 0.00 175.52 176.08 2f1j h LEU 241 N 1.26 0.93 -0.57 2.58 3.38 -0.53 -2.26 115.31 120.11 2f1j h LEU 241 Ca 0.32 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2f1j h LEU 241 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2f1j h LEU 241 CO -0.05 0.99 0.13 0.78 0.09 0.00 0.00 178.44 180.38 2f1j h ASN 242 N 0.83 0.87 -0.56 -0.43 4.21 -0.78 -1.80 115.58 117.93 2f1j h ASN 242 Ca 0.16 -0.24 -0.04 0.00 1.21 0.00 0.00 56.30 57.38 2f1j h ASN 242 Cb 0.50 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.45 2f1j h ASN 242 CO 0.02 0.89 0.18 0.50 -1.29 0.00 0.00 177.43 177.73 2f1j h LYS 243 N 0.82 0.86 -0.29 0.81 3.64 -1.22 -2.12 116.57 119.07 2f1j h LYS 243 Ca 0.18 -0.18 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 2f1j h LYS 243 Cb 0.36 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.01 2f1j h LYS 243 CO 0.00 0.78 -0.01 1.25 -2.27 0.00 0.00 179.45 179.21 2f1j h LEU 244 N 0.77 -0.13 -0.50 5.20 5.85 -1.25 0.54 115.31 125.80 2f1j h LEU 244 Ca 0.18 0.07 0.06 0.00 0.84 0.00 0.00 57.88 59.03 2f1j h LEU 244 Cb 0.28 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 2f1j h LEU 244 CO -0.01 -0.03 0.19 0.00 -0.34 0.00 0.00 178.44 178.25 2f1j h ALA 245 N 1.25 0.61 0.30 1.25 0.00 -1.04 -1.64 119.26 119.99 2f1j h ALA 245 Ca 0.14 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2f1j h ALA 245 Cb 0.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2f1j h ALA 245 CO -0.24 -0.20 -0.14 -0.44 0.00 0.00 0.00 179.25 178.23 2f1j h ASP 246 N 0.37 -0.34 -0.94 0.00 3.32 -0.80 -2.04 116.42 115.99 2f1j h ASP 246 Ca 0.24 0.01 0.16 0.00 0.02 0.00 0.00 57.03 57.46 2f1j h ASP 246 Cb 0.24 0.09 -0.10 0.00 0.22 0.00 0.00 39.33 39.78 2f1j h ASP 246 CO -0.23 -0.10 0.55 -0.07 -1.72 0.00 0.00 179.24 177.66 2f1j h LEU 247 N -0.67 0.72 -3.56 1.55 4.07 -0.96 -2.22 115.31 114.23 2f1j h LEU 247 Ca -0.04 0.09 -0.20 0.00 0.08 0.00 0.00 57.88 57.81 2f1j h LEU 247 Cb 0.30 -0.04 -0.12 0.00 1.08 0.00 0.00 40.66 41.88 2f1j h LEU 247 CO 0.07 0.30 0.16 0.49 -1.08 0.00 0.00 178.44 178.38 2f1j n PHE 248 N -4.78 1.81 -3.90 1.13 0.99 -0.62 -4.98 117.46 107.12 2f1j n PHE 248 Ca 0.20 -1.33 -0.24 0.00 -0.00 0.00 0.00 57.45 56.08 2f1j n PHE 248 Cb 0.47 -0.58 0.01 0.00 -1.00 0.00 0.00 39.48 38.38 2f1j n PHE 248 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2f1j n ASN 249 N -0.65 -1.97 -4.27 4.37 2.85 -0.84 -4.88 115.26 109.88 2f1j n ASN 249 Ca 0.37 -0.66 -0.15 0.00 -0.11 0.00 0.00 54.58 54.03 2f1j n ASN 249 Cb 1.22 -0.79 -0.10 0.00 1.24 0.00 0.00 39.78 41.35 2f1j n ASN 249 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2f1j s VAL 251 N -3.29 4.92 -0.13 0.00 1.01 -0.35 -1.30 120.40 121.25 2f1j s VAL 251 Ca 0.18 1.87 0.02 0.00 0.00 0.00 0.00 61.98 64.05 2f1j s VAL 251 Cb 0.02 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.17 2f1j s VAL 251 CO 0.02 0.17 -0.19 -0.69 0.00 0.00 0.00 175.10 174.41 2f1j s VAL 252 N 1.06 2.37 -0.02 2.92 1.01 -1.16 -0.44 120.40 126.14 2f1j s VAL 252 Ca 0.47 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.62 2f1j s VAL 252 Cb -0.20 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 2f1j s VAL 252 CO 0.24 0.54 -0.19 -0.76 0.00 0.00 0.00 175.10 174.92 2f1j s LEU 253 N 0.66 2.03 0.02 3.92 1.43 0.12 -1.25 118.68 125.60 2f1j s LEU 253 Ca -0.10 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2f1j s LEU 253 Cb -0.16 -1.01 -0.02 0.00 0.03 0.00 0.00 46.19 45.03 2f1j s LEU 253 CO 0.02 0.23 -0.04 0.68 0.23 0.00 0.00 176.35 177.47 2f1j s VAL 254 N -0.41 0.21 0.16 -1.59 -7.23 -0.75 -0.37 120.40 110.42 2f1j s VAL 254 Ca 0.06 -0.76 0.09 0.00 -1.81 0.00 0.00 61.98 59.56 2f1j s VAL 254 Cb -0.08 -0.30 -0.04 0.00 0.56 0.00 0.00 36.38 36.52 2f1j s VAL 254 CO -0.00 -0.35 -0.12 0.42 -0.31 0.00 0.00 175.10 174.73 2f1j s THR 255 N -1.12 3.10 -0.04 5.32 -4.23 -0.85 -1.70 115.64 116.12 2f1j s THR 255 Ca -0.11 -1.58 -0.02 0.00 -1.18 0.00 0.00 61.69 58.80 2f1j s THR 255 Cb -0.08 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.29 2f1j s THR 255 CO -0.00 -0.03 0.06 0.21 -0.54 0.00 0.00 174.62 174.31 2f1j s ASN 256 N -2.58 1.12 0.02 3.99 2.47 -0.61 -0.52 114.94 118.82 2f1j s ASN 256 Ca 0.23 0.08 -0.30 0.00 0.42 0.00 0.00 52.86 53.28 2f1j s ASN 256 Cb -0.09 -0.14 -0.04 0.00 -1.45 0.00 0.00 41.25 39.52 2f1j s ASN 256 CO 0.14 -0.25 1.03 -1.58 -3.72 0.00 0.00 177.10 172.72 2f1j s GLN 257 N 2.13 4.53 -0.01 0.43 2.00 -1.26 -2.07 119.66 125.41 2f1j s GLN 257 Ca 0.05 1.51 -0.00 0.00 -2.00 0.00 0.00 55.36 54.91 2f1j s GLN 257 Cb -0.12 -3.43 0.02 0.00 0.80 0.00 0.00 33.01 30.28 2f1j s GLN 257 CO -0.03 -0.09 0.02 0.14 -0.50 0.00 0.00 175.29 174.83 2f1j s VAL 258 N 0.99 -0.04 -1.05 1.34 -7.23 -0.84 -4.87 120.40 108.70 2f1j s VAL 258 Ca 0.53 0.15 0.24 0.00 -1.81 0.00 0.00 61.98 61.09 2f1j s VAL 258 Cb -0.23 -0.06 -0.07 0.00 0.56 0.00 0.00 36.38 36.58 2f1j s VAL 258 CO 0.28 0.06 1.22 -0.24 -0.31 0.00 0.00 175.10 176.12 2f1j n SER 259 N 3.83 0.73 -3.99 4.85 2.88 -1.26 -3.03 113.62 117.62 2f1j n SER 259 Ca -0.23 -0.58 -0.30 0.00 -1.33 0.00 0.00 58.87 56.44 2f1j n SER 259 Cb 0.53 0.53 -0.16 0.00 -0.75 0.00 0.00 64.21 64.36 2f1j n SER 259 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2f1j s GLY 279 N -2.97 1.12 0.33 0.46 0.00 -1.26 -4.90 107.32 100.10 2f1j s GLY 279 Ca 0.11 -0.94 0.04 0.00 0.00 0.00 0.00 44.72 43.93 2f1j s GLY 279 CO 0.75 0.63 0.06 0.30 0.00 0.00 0.00 173.10 174.84 2f1j s HIS 280 N 1.50 1.98 -1.07 1.90 4.02 -1.26 -5.02 115.29 117.34 2f1j s HIS 280 Ca 0.03 -0.95 0.00 0.00 1.02 0.00 0.00 55.06 55.16 2f1j s HIS 280 Cb -0.14 -1.30 0.00 0.00 -1.02 0.00 0.00 32.58 30.12 2f1j s HIS 280 CO -0.10 0.02 0.36 0.00 1.02 0.00 0.00 174.74 176.05 2f1j n ALA 281 N -0.70 2.03 -2.18 -1.40 0.00 -1.26 -4.84 120.51 112.16 2f1j n ALA 281 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.00 2f1j n ALA 281 Cb 0.67 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 2f1j n ALA 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f1j s ALA 282 N -1.07 3.58 0.26 0.00 0.00 -1.26 -4.88 121.76 118.40 2f1j s ALA 282 Ca 0.00 1.07 0.16 0.00 0.00 0.00 0.00 51.96 53.19 2f1j s ALA 282 Cb 0.00 -3.55 0.69 0.00 0.00 0.00 0.00 23.12 20.26 2f1j s ALA 282 CO 0.00 -0.68 1.76 0.00 0.00 0.00 0.00 175.76 176.84 2f1j h THR 283 N 4.40 1.07 -3.86 0.00 1.03 -1.49 -3.42 112.91 110.65 2f1j h THR 283 Ca -0.41 -1.51 -0.63 0.00 -0.01 0.00 0.00 66.41 63.85 2f1j h THR 283 Cb 1.20 1.87 -0.32 0.00 -1.07 0.00 0.00 68.15 69.83 2f1j h THR 283 CO 0.87 0.40 -0.86 -0.36 -0.01 0.00 0.00 175.52 175.55 2f1j s PHE 284 N -3.80 2.13 -0.07 0.00 0.40 -0.69 -4.01 117.98 111.95 2f1j s PHE 284 Ca -0.01 -0.67 0.01 0.00 -0.60 0.00 0.00 56.93 55.66 2f1j s PHE 284 Cb 0.12 -1.42 0.02 0.00 0.51 0.00 0.00 43.02 42.25 2f1j s PHE 284 CO 0.70 -0.23 -0.07 1.03 0.70 0.00 0.00 175.22 177.35 2f1j s ARG 285 N 0.02 1.26 0.12 0.44 0.52 -0.07 -0.70 118.95 120.53 2f1j s ARG 285 Ca -0.06 -0.23 0.09 0.00 -0.52 0.00 0.00 55.73 55.02 2f1j s ARG 285 Cb -0.14 -1.20 -0.04 0.00 0.52 0.00 0.00 34.95 34.10 2f1j s ARG 285 CO 0.04 -0.10 -0.20 -0.06 0.02 0.00 0.00 175.30 175.00 2f1j s PHE 286 N 1.07 2.49 -0.21 -0.53 0.40 0.13 -1.83 117.98 119.51 2f1j s PHE 286 Ca -0.08 -0.29 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2f1j s PHE 286 Cb -0.14 -1.33 0.05 0.00 0.51 0.00 0.00 43.02 42.10 2f1j s PHE 286 CO -0.01 0.37 -0.09 0.12 0.70 0.00 0.00 175.22 176.31 2f1j s PHE 287 N -1.11 2.44 -0.12 0.36 5.36 -0.18 -0.75 117.98 123.98 2f1j s PHE 287 Ca 0.17 -1.65 -0.04 0.00 -0.96 0.00 0.00 56.93 54.45 2f1j s PHE 287 Cb -0.10 -1.63 -0.03 0.00 -0.34 0.00 0.00 43.02 40.91 2f1j s PHE 287 CO 0.09 -0.75 0.03 0.08 -1.46 0.00 0.00 175.22 173.20 2f1j s VAL 288 N 1.39 4.52 0.09 3.12 1.01 0.11 -0.35 120.40 130.29 2f1j s VAL 288 Ca -0.03 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.83 2f1j s VAL 288 Cb -0.17 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 2f1j s VAL 288 CO -0.08 0.57 -0.10 0.00 0.00 0.00 0.00 175.10 175.49 2f1j s ARG 289 N -0.54 0.83 0.26 2.72 1.70 -0.27 -3.95 118.95 119.71 2f1j s ARG 289 Ca 0.10 -1.15 -0.30 0.00 -0.47 0.00 0.00 55.73 53.91 2f1j s ARG 289 Cb -0.12 -0.51 -0.09 0.00 -0.57 0.00 0.00 34.95 33.65 2f1j s ARG 289 CO 0.02 0.08 1.00 0.15 -1.08 0.00 0.00 175.30 175.47 2f1j s LYS 290 N -2.78 4.76 0.00 3.89 1.02 -1.26 -0.49 119.74 124.88 2f1j s LYS 290 Ca 0.05 1.60 0.00 0.00 0.02 0.00 0.00 55.97 57.64 2f1j s LYS 290 Cb -0.03 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 2f1j s LYS 290 CO -0.00 0.39 0.00 0.41 -0.92 0.00 0.00 175.35 175.23 2f1j n GLY 291 N 1.33 2.35 3.61 -3.33 0.00 0.18 -4.81 105.19 104.51 2f1j n GLY 291 Ca -0.01 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 2f1j n GLY 291 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2f1j s LYS 292 N 3.93 3.87 6.26 1.61 2.36 -1.26 -4.75 119.74 131.77 2f1j s LYS 292 Ca 0.00 0.56 0.00 0.00 -2.55 0.00 0.00 55.97 53.98 2f1j s LYS 292 Cb 0.00 -3.78 0.00 0.00 -1.05 0.00 0.00 37.83 33.00 2f1j s LYS 292 CO 0.00 -0.85 0.00 0.41 1.55 0.00 0.00 175.35 176.46 2f1j n GLY 293 N 4.32 1.71 0.28 5.54 0.00 -1.26 -2.30 105.19 113.48 2f1j n GLY 293 Ca 0.06 0.31 -0.04 0.00 0.00 0.00 0.00 46.02 46.34 2f1j n GLY 293 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2f1j h ASP 294 N 0.00 0.72 -3.07 1.61 3.32 -1.88 -3.46 116.42 113.66 2f1j h ASP 294 Ca 0.00 -0.18 -0.58 0.00 0.02 0.00 0.00 57.03 56.29 2f1j h ASP 294 Cb 0.00 -0.19 0.13 0.00 0.22 0.00 0.00 39.33 39.48 2f1j h ASP 294 CO 0.00 0.80 0.22 0.29 -1.72 0.00 0.00 179.24 178.84 2f1j n LYS 295 N -4.21 1.48 -3.87 3.56 4.76 -0.97 -2.55 118.16 116.35 2f1j n LYS 295 Ca 0.02 0.53 -0.11 0.00 -2.87 0.00 0.00 58.31 55.87 2f1j n LYS 295 Cb 0.31 -2.08 -0.12 0.00 -1.84 0.00 0.00 35.03 31.30 2f1j n LYS 295 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2f1j s ARG 296 N -1.98 0.27 -0.21 1.97 1.81 -0.40 0.52 118.95 120.93 2f1j s ARG 296 Ca 0.62 -0.17 0.01 0.00 -1.72 0.00 0.00 55.73 54.48 2f1j s ARG 296 Cb -0.57 0.11 0.04 0.00 -0.45 0.00 0.00 34.95 34.09 2f1j s ARG 296 CO 0.58 -0.05 -0.12 0.08 -0.68 0.00 0.00 175.30 175.10 2f1j s VAL 297 N -0.68 1.86 -0.35 3.52 1.01 0.36 -2.25 120.40 123.86 2f1j s VAL 297 Ca -0.08 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.58 2f1j s VAL 297 Cb -0.05 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 2f1j s VAL 297 CO 0.00 0.17 0.32 0.00 0.00 0.00 0.00 175.10 175.59 2f1j s ALA 298 N 1.30 3.50 -0.39 5.51 0.00 -0.41 -1.11 121.76 130.15 2f1j s ALA 298 Ca -0.02 -1.30 -0.13 0.00 0.00 0.00 0.00 51.96 50.51 2f1j s ALA 298 Cb -0.17 -2.78 0.02 0.00 0.00 0.00 0.00 23.12 20.19 2f1j s ALA 298 CO -0.08 -1.07 0.26 0.21 0.00 0.00 0.00 175.76 175.07 2f1j s LYS 299 N 1.91 2.97 -0.53 0.00 2.47 0.52 -0.73 119.74 126.35 2f1j s LYS 299 Ca 0.10 -1.01 -0.29 0.00 -1.56 0.00 0.00 55.97 53.21 2f1j s LYS 299 Cb -0.17 -3.86 0.03 0.00 -1.46 0.00 0.00 37.83 32.37 2f1j s LYS 299 CO 0.11 -0.70 1.22 -1.17 0.16 0.00 0.00 175.35 174.97 2f1j s LEU 300 N 1.63 3.52 0.00 5.43 1.98 0.32 -1.01 118.68 130.56 2f1j s LEU 300 Ca 0.04 0.32 0.12 0.00 -2.89 0.00 0.00 54.13 51.72 2f1j s LEU 300 Cb -0.19 -3.33 -0.04 0.00 0.66 0.00 0.00 46.19 43.29 2f1j s LEU 300 CO 0.09 -1.42 0.65 0.00 -1.89 0.00 0.00 176.35 173.78 2f1j n TYR 301 N 8.39 0.00 -3.70 5.38 4.11 -0.76 -2.24 117.16 128.34 2f1j n TYR 301 Ca 0.11 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.90 2f1j n TYR 301 Cb 0.49 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.72 2f1j n TYR 301 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2f1j s ASP 302 N -1.72 -0.47 -0.00 9.48 3.68 -1.16 -4.91 116.67 121.57 2f1j s ASP 302 Ca 0.08 0.83 -0.29 0.00 2.13 0.00 0.00 52.55 55.31 2f1j s ASP 302 Cb 0.10 0.73 0.10 0.00 -1.45 0.00 0.00 42.92 42.39 2f1j s ASP 302 CO 0.36 -0.18 0.95 -0.94 0.13 0.00 0.00 175.17 175.48 2f1j s SER 303 N 1.24 -0.30 0.24 -0.34 1.04 -1.26 -0.89 113.70 113.43 2f1j s SER 303 Ca -0.08 -0.06 0.13 0.00 0.48 0.00 0.00 55.95 56.41 2f1j s SER 303 Cb -0.08 0.36 -0.00 0.00 0.10 0.00 0.00 66.02 66.40 2f1j s SER 303 CO -0.11 -0.61 1.40 1.55 0.98 0.00 0.00 173.24 176.46 2f1j h PRO 304 N 2.00 0.00 0.00 4.02 0.13 -1.99 -3.40 132.00 132.76 2f1j h PRO 304 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2f1j h PRO 304 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2f1j h PRO 304 CO 0.29 0.64 0.00 -2.39 -0.23 0.00 0.00 178.00 176.32 2f1j n HIS 305 N -3.27 0.00 -4.34 1.56 1.44 -1.26 -5.09 115.22 104.26 2f1j n HIS 305 Ca 0.01 -0.07 -0.30 0.00 -2.01 0.00 0.00 57.72 55.36 2f1j n HIS 305 Cb 0.79 -0.01 -0.11 0.00 0.12 0.00 0.00 29.99 30.78 2f1j n HIS 305 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2f1j s LEU 306 N -0.14 2.82 0.57 2.39 1.43 -1.26 -5.12 118.68 119.36 2f1j s LEU 306 Ca 0.00 -0.46 -0.16 0.00 -1.03 0.00 0.00 54.13 52.47 2f1j s LEU 306 Cb 0.00 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.52 2f1j s LEU 306 CO 0.00 0.20 1.04 -2.16 0.23 0.00 0.00 176.35 175.66 2f1j s PRO 307 N -2.02 3.49 0.25 1.29 0.04 -1.26 -4.62 135.00 132.17 2f1j s PRO 307 Ca 0.19 1.19 -0.30 0.00 0.04 0.00 0.00 61.00 62.11 2f1j s PRO 307 Cb -0.11 -2.06 -0.11 0.00 0.04 0.00 0.00 34.50 32.27 2f1j s PRO 307 CO 0.10 -0.67 1.53 -0.51 0.04 0.00 0.00 177.00 177.50 2f1j s ASP 308 N -2.72 6.52 0.02 6.66 1.11 -1.26 -4.95 116.67 122.06 2f1j s ASP 308 Ca 0.63 2.78 -0.28 0.00 0.18 0.00 0.00 52.55 55.87 2f1j s ASP 308 Cb -0.15 -2.62 0.07 0.00 1.07 0.00 0.00 42.92 41.29 2f1j s ASP 308 CO 0.34 -0.81 0.65 0.00 1.18 0.00 0.00 175.17 176.52 2f1j s ALA 309 N 0.21 -1.69 -0.04 5.23 0.00 -0.95 -4.99 121.76 119.53 2f1j s ALA 309 Ca 0.63 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2f1j s ALA 309 Cb -0.45 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2f1j s ALA 309 CO 0.43 -0.51 -0.01 -1.21 0.00 0.00 0.00 175.76 174.46 2f1j s GLU 310 N -2.10 2.83 -0.12 0.00 2.02 -1.26 -0.52 118.70 119.55 2f1j s GLU 310 Ca -0.07 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 54.39 2f1j s GLU 310 Cb -0.00 -2.69 0.02 0.00 0.10 0.00 0.00 34.13 31.55 2f1j s GLU 310 CO 0.02 0.65 -0.16 0.00 0.02 0.00 0.00 175.26 175.79 2f1j s ALA 311 N -0.98 1.79 -0.17 5.21 0.00 0.09 -4.98 121.76 122.73 2f1j s ALA 311 Ca 0.16 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 51.20 2f1j s ALA 311 Cb -0.11 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.07 2f1j s ALA 311 CO 0.06 -0.13 0.21 0.42 0.00 0.00 0.00 175.76 176.33 2f1j s ILE 312 N 1.05 5.36 0.32 0.00 1.01 -1.26 -1.29 121.20 126.39 2f1j s ILE 312 Ca -0.05 0.36 -0.01 0.00 0.00 0.00 0.00 60.65 60.95 2f1j s ILE 312 Cb -0.15 -3.54 0.01 0.00 0.01 0.00 0.00 42.46 38.79 2f1j s ILE 312 CO -0.03 0.44 0.43 2.22 0.00 0.00 0.00 174.94 178.00 2f1j n PHE 313 N 3.39 -1.32 -4.14 3.97 1.16 -0.96 -4.61 117.46 114.94 2f1j n PHE 313 Ca -0.14 -2.18 -0.09 0.00 -1.87 0.00 0.00 57.45 53.17 2f1j n PHE 313 Cb 0.52 0.49 -0.10 0.00 -1.61 0.00 0.00 39.48 38.78 2f1j n PHE 313 CO 0.00 0.00 0.00 -0.98 -1.87 0.00 0.00 176.76 173.91 2f1j s ARG 314 N -2.76 0.85 -0.26 3.97 1.70 -0.71 -1.27 118.95 120.47 2f1j s ARG 314 Ca 0.27 -1.38 0.03 0.00 -0.47 0.00 0.00 55.73 54.18 2f1j s ARG 314 Cb -0.01 0.17 0.06 0.00 -0.57 0.00 0.00 34.95 34.60 2f1j s ARG 314 CO 0.19 -0.19 -0.10 0.42 -1.08 0.00 0.00 175.30 174.54 2f1j s ILE 315 N -3.96 2.11 0.00 4.99 1.01 -1.06 -1.87 121.20 122.43 2f1j s ILE 315 Ca 0.19 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 59.22 2f1j s ILE 315 Cb 0.07 -2.24 0.00 0.00 0.01 0.00 0.00 42.46 40.30 2f1j s ILE 315 CO -0.02 -0.05 0.00 0.35 0.00 0.00 0.00 174.94 175.23 2f1j n THR 316 N 4.45 0.00 0.32 2.92 -2.24 -0.73 -4.84 114.28 114.16 2f1j n THR 316 Ca -0.14 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.79 2f1j n THR 316 Cb 0.42 0.00 0.63 0.00 -2.10 0.00 0.00 70.33 69.28 2f1j n THR 316 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2f1j h GLU 317 N 0.00 0.00 0.00 -0.78 -0.00 -2.01 -1.67 114.58 110.13 2f1j h GLU 317 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2f1j h GLU 317 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2f1j h GLU 317 CO 0.00 0.00 -0.37 1.63 -0.00 0.00 0.00 179.01 180.27 2f1j n LYS 318 N -2.54 0.10 0.00 1.06 5.02 -1.26 -4.47 118.16 116.07 2f1j n LYS 318 Ca 0.01 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 2f1j n LYS 318 Cb 0.20 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2f1j n LYS 318 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f1j n GLY 319 N 1.44 0.65 3.72 0.72 0.00 -0.63 -4.61 105.19 106.48 2f1j n GLY 319 Ca 0.05 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 2f1j n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f1j s ILE 320 N 0.00 4.80 0.14 -0.61 -1.09 -1.26 -1.78 121.20 121.41 2f1j s ILE 320 Ca 0.00 1.82 -0.10 0.00 -2.23 0.00 0.00 60.65 60.14 2f1j s ILE 320 Cb 0.00 -4.21 0.00 0.00 -1.58 0.00 0.00 42.46 36.67 2f1j s ILE 320 CO 0.00 0.26 0.29 0.00 -1.23 0.00 0.00 174.94 174.26 2f1j s GLN 321 N 0.51 1.09 0.00 2.79 -2.07 -0.78 -4.53 119.66 116.66 2f1j s GLN 321 Ca 0.45 -1.05 0.00 0.00 -1.82 0.00 0.00 55.36 52.93 2f1j s GLN 321 Cb -0.21 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.10 2f1j s GLN 321 CO 0.25 -0.40 0.00 -0.25 -1.32 0.00 0.00 175.29 173.57