#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ffh n GLN 3 N 0.00 0.00 -0.04 -1.08 7.27 -1.22 -0.87 117.38 121.44 1ffh n GLN 3 Ca 0.00 0.00 0.02 0.00 0.07 0.00 0.00 57.00 57.09 1ffh n GLN 3 Cb 0.00 0.00 0.35 0.00 2.41 0.00 0.00 30.24 33.00 1ffh n GLN 3 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1ffh h GLN 4 N 0.00 0.62 -0.12 3.69 1.08 -1.69 -1.45 115.11 117.25 1ffh h GLN 4 Ca 0.00 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.03 1ffh h GLN 4 Cb 0.00 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.31 1ffh h GLN 4 CO 0.00 0.48 -0.33 1.25 -0.95 0.00 0.00 178.83 179.28 1ffh h LEU 5 N 0.63 0.50 -0.12 1.46 5.85 -0.98 -2.64 115.31 120.01 1ffh h LEU 5 Ca 0.16 -0.59 0.04 0.00 0.84 0.00 0.00 57.88 58.33 1ffh h LEU 5 Cb 0.06 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 1ffh h LEU 5 CO -0.02 1.00 -0.18 0.28 -0.34 0.00 0.00 178.44 179.18 1ffh h SER 6 N 0.02 -0.57 -0.25 1.25 0.02 -0.79 -0.79 113.55 112.44 1ffh h SER 6 Ca -0.01 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1ffh h SER 6 Cb 0.95 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 1ffh h SER 6 CO 0.07 -0.23 0.10 0.00 -1.14 0.00 0.00 176.83 175.62 1ffh h ALA 7 N 0.78 0.28 -0.52 3.77 0.00 -1.32 0.37 119.26 122.62 1ffh h ALA 7 Ca 0.09 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ffh h ALA 7 Cb 0.37 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1ffh h ALA 7 CO -0.26 -0.31 0.27 0.00 0.00 0.00 0.00 179.25 178.95 1ffh h ARG 8 N 0.22 0.73 -0.44 0.00 2.47 -1.18 0.82 114.38 117.00 1ffh h ARG 8 Ca 0.11 -0.09 -0.05 0.00 -1.26 0.00 0.00 59.98 58.68 1ffh h ARG 8 Cb 0.06 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.23 1ffh h ARG 8 CO -0.10 0.58 0.08 -0.07 0.56 0.00 0.00 179.97 181.02 1ffh h LEU 9 N 0.69 0.69 -0.53 3.04 3.38 -0.92 -1.18 115.31 120.48 1ffh h LEU 9 Ca 0.18 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1ffh h LEU 9 Cb 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ffh h LEU 9 CO -0.03 0.77 0.13 1.56 0.09 0.00 0.00 178.44 180.97 1ffh h GLN 10 N 0.58 0.84 -0.73 1.13 4.20 -0.63 -1.92 115.11 118.57 1ffh h GLN 10 Ca 0.13 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1ffh h GLN 10 Cb 0.37 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1ffh h GLN 10 CO 0.01 0.80 0.24 0.93 -0.67 0.00 0.00 178.83 180.14 1ffh h GLU 11 N 0.74 1.13 0.20 1.46 5.08 -0.73 0.23 114.58 122.70 1ffh h GLU 11 Ca 0.17 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1ffh h GLU 11 Cb 0.33 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1ffh h GLU 11 CO 0.00 0.95 -0.10 0.00 -1.00 0.00 0.00 179.01 178.86 1ffh h ALA 12 N 1.17 -0.27 -0.61 3.43 0.00 -0.96 -1.02 119.26 121.00 1ffh h ALA 12 Ca 0.24 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1ffh h ALA 12 Cb 0.28 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1ffh h ALA 12 CO -0.01 -0.63 0.12 0.82 0.00 0.00 0.00 179.25 179.55 1ffh h ILE 13 N -0.31 1.25 -0.20 0.00 2.04 -1.21 -2.60 117.51 116.47 1ffh h ILE 13 Ca -0.03 -0.93 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1ffh h ILE 13 Cb 0.24 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1ffh h ILE 13 CO 0.05 0.35 0.03 1.23 0.00 0.00 0.00 178.15 179.81 1ffh h GLY 14 N 1.03 0.30 2.00 5.37 0.00 -0.27 -2.58 103.07 108.92 1ffh h GLY 14 Ca 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1ffh h GLY 14 CO 0.00 0.14 -0.03 3.21 0.00 0.00 0.00 176.54 179.86 1ffh h ARG 15 N 0.28 0.00 -0.01 4.80 3.08 -0.77 -1.67 114.38 120.09 1ffh h ARG 15 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1ffh h ARG 15 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1ffh h ARG 15 CO -0.00 0.03 -0.30 1.28 -1.07 0.00 0.00 179.97 179.91 1ffh n LEU 16 N -3.88 1.27 -4.71 3.04 4.77 -0.97 -4.92 117.00 111.61 1ffh n LEU 16 Ca -0.03 -0.38 -0.42 0.00 -0.03 0.00 0.00 56.01 55.15 1ffh n LEU 16 Cb 0.12 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1ffh n LEU 16 CO 0.29 0.24 1.09 -0.60 -1.33 0.00 0.00 177.39 177.08 1ffh s ARG 17 N -2.48 4.30 -0.95 3.23 6.06 -0.63 -3.47 118.95 125.02 1ffh s ARG 17 Ca 0.24 2.08 -0.02 0.00 -2.50 0.00 0.00 55.73 55.53 1ffh s ARG 17 Cb 0.19 -3.32 0.00 0.00 0.06 0.00 0.00 34.95 31.88 1ffh s ARG 17 CO 0.52 -0.48 0.21 0.41 -2.50 0.00 0.00 175.30 173.46 1ffh n GLY 18 N 3.56 -0.06 0.32 8.12 0.00 -1.26 -4.92 105.19 110.95 1ffh n GLY 18 Ca 0.12 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.87 1ffh n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffh n ARG 19 N -2.43 0.48 0.00 1.61 5.12 -1.23 -5.10 116.66 115.11 1ffh n ARG 19 Ca -0.10 -0.95 0.00 0.00 -1.93 0.00 0.00 57.85 54.87 1ffh n ARG 19 Cb 0.59 -1.15 0.00 0.00 -1.16 0.00 0.00 32.46 30.74 1ffh n ARG 19 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ffh n GLY 20 N 0.53 0.28 3.77 -0.13 0.00 -1.26 -4.76 105.19 103.63 1ffh n GLY 20 Ca 0.05 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1ffh n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ffh s ARG 21 N 0.00 3.61 0.18 1.61 0.52 -1.25 -4.51 118.95 119.11 1ffh s ARG 21 Ca 0.00 1.76 0.06 0.00 -0.52 0.00 0.00 55.73 57.03 1ffh s ARG 21 Cb 0.00 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.14 1ffh s ARG 21 CO 0.00 -0.67 0.10 0.96 0.02 0.00 0.00 175.30 175.71 1ffh s ILE 22 N -1.59 4.23 0.87 1.52 -4.36 -1.26 -5.09 121.20 115.52 1ffh s ILE 22 Ca 0.67 -1.25 -0.12 0.00 -0.26 0.00 0.00 60.65 59.69 1ffh s ILE 22 Cb -0.28 -3.17 0.16 0.00 1.25 0.00 0.00 42.46 40.42 1ffh s ILE 22 CO 0.33 -0.15 1.21 0.42 0.24 0.00 0.00 174.94 177.00 1ffh s THR 23 N -1.82 2.05 0.19 8.37 -4.23 -1.26 -4.80 115.64 114.14 1ffh s THR 23 Ca 0.30 -0.14 -0.07 0.00 -1.18 0.00 0.00 61.69 60.60 1ffh s THR 23 Cb -0.09 -2.92 0.03 0.00 1.34 0.00 0.00 72.50 70.86 1ffh s THR 23 CO 0.22 0.00 1.61 -0.08 -0.54 0.00 0.00 174.62 175.83 1ffh h GLU 24 N -1.25 0.93 0.00 3.99 4.81 -2.00 -2.67 114.58 118.39 1ffh h GLU 24 Ca -0.43 -0.36 -0.07 0.00 -0.13 0.00 0.00 59.36 58.37 1ffh h GLU 24 Cb 1.26 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1ffh h GLU 24 CO 0.44 1.02 -0.32 1.49 -0.73 0.00 0.00 179.01 180.91 1ffh h GLU 25 N 0.81 0.00 -0.21 1.92 4.57 -1.98 -1.89 114.58 117.80 1ffh h GLU 25 Ca 0.12 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.28 1ffh h GLU 25 Cb 0.71 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 1ffh h GLU 25 CO 0.05 0.32 0.06 -0.44 -1.18 0.00 0.00 179.01 177.83 1ffh h ASP 26 N 0.00 0.31 0.38 1.04 3.32 -1.85 0.10 116.42 119.72 1ffh h ASP 26 Ca -0.00 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1ffh h ASP 26 Cb 0.93 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1ffh h ASP 26 CO 0.04 0.43 -0.20 0.25 -1.72 0.00 0.00 179.24 178.05 1ffh h LEU 27 N 0.17 -0.47 -1.12 1.55 5.85 -1.24 -1.19 115.31 118.86 1ffh h LEU 27 Ca 0.07 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.92 1ffh h LEU 27 Cb 0.24 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.32 1ffh h LEU 27 CO -0.00 -0.33 0.61 0.11 -0.34 0.00 0.00 178.44 178.49 1ffh h LYS 28 N -0.53 0.90 -0.10 1.25 1.57 -1.25 0.15 116.57 118.55 1ffh h LYS 28 Ca -0.05 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1ffh h LYS 28 Cb 0.42 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1ffh h LYS 28 CO 0.08 0.60 0.06 0.00 -0.57 0.00 0.00 179.45 179.61 1ffh h ALA 29 N 1.55 0.13 -0.19 3.86 0.00 -0.37 0.22 119.26 124.46 1ffh h ALA 29 Ca 0.46 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.34 1ffh h ALA 29 Cb 0.47 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1ffh h ALA 29 CO -0.22 -0.34 0.07 1.15 0.00 0.00 0.00 179.25 179.91 1ffh h THR 30 N 0.08 0.96 -0.72 0.00 2.02 0.04 0.38 112.91 115.65 1ffh h THR 30 Ca 0.04 -0.05 0.07 0.00 0.77 0.00 0.00 66.41 67.23 1ffh h THR 30 Cb 0.07 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.22 1ffh h THR 30 CO -0.01 0.03 0.48 -0.07 0.37 0.00 0.00 175.52 176.32 1ffh h LEU 31 N 0.16 0.65 -0.62 2.58 3.38 -0.54 0.99 115.31 121.91 1ffh h LEU 31 Ca 0.08 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1ffh h LEU 31 Cb 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1ffh h LEU 31 CO -0.08 0.42 -0.55 0.03 0.09 0.00 0.00 178.44 178.34 1ffh h ARG 32 N 0.74 0.40 -0.35 1.13 3.08 0.18 -0.54 114.38 119.03 1ffh h ARG 32 Ca 0.31 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.98 1ffh h ARG 32 Cb 0.28 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1ffh h ARG 32 CO -0.11 0.85 -0.32 0.93 -1.07 0.00 0.00 179.97 180.25 1ffh h GLU 33 N 0.31 0.76 -0.27 0.04 5.08 0.91 -1.88 114.58 119.54 1ffh h GLU 33 Ca 0.00 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 57.94 1ffh h GLU 33 Cb 1.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1ffh h GLU 33 CO 0.10 0.98 -0.08 0.82 -1.00 0.00 0.00 179.01 179.82 1ffh h ILE 34 N 0.64 1.29 -0.19 3.13 2.04 -0.70 -1.33 117.51 122.39 1ffh h ILE 34 Ca 0.07 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 64.83 1ffh h ILE 34 Cb 0.86 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 1ffh h ILE 34 CO 0.08 0.35 0.05 -0.09 0.00 0.00 0.00 178.15 178.53 1ffh h ARG 35 N 0.28 0.12 -0.45 2.37 2.43 -1.01 -0.61 114.38 117.51 1ffh h ARG 35 Ca 0.07 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1ffh h ARG 35 Cb 0.57 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1ffh h ARG 35 CO 0.03 0.08 0.14 0.00 -1.51 0.00 0.00 179.97 178.72 1ffh h ARG 36 N 0.13 0.66 -0.49 0.20 3.08 -1.30 -0.83 114.38 115.83 1ffh h ARG 36 Ca 0.09 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1ffh h ARG 36 Cb 0.07 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1ffh h ARG 36 CO -0.11 0.57 0.10 0.00 -1.07 0.00 0.00 179.97 179.46 1ffh h ALA 37 N 1.51 0.65 -0.22 0.04 0.00 -0.58 -2.32 119.26 118.34 1ffh h ALA 37 Ca 0.15 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1ffh h ALA 37 Cb 0.19 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ffh h ALA 37 CO -0.01 0.36 -0.13 -0.07 0.00 0.00 0.00 179.25 179.40 1ffh h LEU 38 N 0.68 0.50 -0.90 0.00 3.38 -0.62 -2.43 115.31 115.92 1ffh h LEU 38 Ca 0.15 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.74 1ffh h LEU 38 Cb 0.37 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1ffh h LEU 38 CO 0.01 0.82 0.58 0.24 0.09 0.00 0.00 178.44 180.17 1ffh h MET 39 N 0.19 1.05 0.00 1.13 2.86 -1.12 -1.50 114.93 117.54 1ffh h MET 39 Ca 0.05 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 1ffh h MET 39 Cb 0.64 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1ffh h MET 39 CO 0.04 0.70 -0.32 -0.44 1.06 0.00 0.00 176.91 177.95 1ffh h ASP 40 N 1.09 0.00 -0.02 1.22 5.19 -1.37 -1.95 116.42 120.57 1ffh h ASP 40 Ca 0.38 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.79 1ffh h ASP 40 Cb 0.09 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.60 1ffh h ASP 40 CO -0.15 0.32 0.00 0.00 -3.12 0.00 0.00 179.24 176.29 1ffh n ALA 41 N -2.42 2.57 -2.17 3.45 0.00 -0.62 -4.87 120.51 116.44 1ffh n ALA 41 Ca -0.02 -0.13 -0.12 0.00 0.00 0.00 0.00 53.44 53.17 1ffh n ALA 41 Cb 0.38 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.62 1ffh n ALA 41 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ffh n ASP 42 N -0.60 -3.77 -4.73 0.00 2.03 -0.73 -0.74 116.55 108.01 1ffh n ASP 42 Ca 0.11 0.01 -0.41 0.00 0.52 0.00 0.00 54.79 55.01 1ffh n ASP 42 Cb 0.08 -2.95 -0.04 0.00 -0.72 0.00 0.00 41.12 37.48 1ffh n ASP 42 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ffh s VAL 43 N -2.57 4.37 0.28 5.18 1.01 -0.84 -4.16 120.40 123.67 1ffh s VAL 43 Ca 0.00 1.98 -0.28 0.00 0.00 0.00 0.00 61.98 63.68 1ffh s VAL 43 Cb 0.00 -4.26 -0.15 0.00 0.00 0.00 0.00 36.38 31.97 1ffh s VAL 43 CO 0.00 0.31 0.89 -3.20 0.00 0.00 0.00 175.10 173.10 1ffh n ASN 44 N 2.72 0.69 -0.14 3.32 2.85 -1.26 -4.58 115.26 118.86 1ffh n ASN 44 Ca 0.02 1.16 -0.05 0.00 -0.11 0.00 0.00 54.58 55.61 1ffh n ASN 44 Cb 0.49 -1.21 0.02 0.00 1.24 0.00 0.00 39.78 40.31 1ffh n ASN 44 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1ffh h LEU 45 N 1.73 -0.67 -0.77 1.20 5.85 -1.98 0.14 115.31 120.83 1ffh h LEU 45 Ca -0.37 0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.42 1ffh h LEU 45 Cb 1.36 0.37 -0.02 0.00 0.37 0.00 0.00 40.66 42.75 1ffh h LEU 45 CO 0.59 -0.22 -0.09 -0.33 -0.34 0.00 0.00 178.44 178.05 1ffh h GLU 46 N -0.10 0.85 -0.33 1.25 5.08 -1.99 -1.43 114.58 117.91 1ffh h GLU 46 Ca 0.21 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1ffh h GLU 46 Cb 0.43 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1ffh h GLU 46 CO -0.51 0.90 0.09 0.28 -1.00 0.00 0.00 179.01 178.77 1ffh h VAL 47 N 0.77 1.21 0.07 3.13 2.07 -1.72 -1.24 116.25 120.54 1ffh h VAL 47 Ca 0.13 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1ffh h VAL 47 Cb 0.58 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1ffh h VAL 47 CO 0.04 0.24 -0.10 0.74 0.02 0.00 0.00 177.57 178.50 1ffh h THR 48 N 0.37 0.77 -0.28 2.57 2.02 -0.60 -0.57 112.91 117.18 1ffh h THR 48 Ca 0.10 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.35 1ffh h THR 48 Cb 0.27 0.77 -0.07 0.00 -1.74 0.00 0.00 68.15 67.38 1ffh h THR 48 CO -0.00 0.00 -0.15 -0.09 0.37 0.00 0.00 175.52 175.65 1ffh h ARG 49 N -0.21 -0.10 -0.75 6.66 2.43 -1.11 -1.45 114.38 119.85 1ffh h ARG 49 Ca 0.01 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1ffh h ARG 49 Cb 0.21 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 1ffh h ARG 49 CO -0.05 -0.07 0.39 -0.44 -1.51 0.00 0.00 179.97 178.29 1ffh h ASP 50 N -0.11 0.94 0.28 -3.80 3.32 -1.00 -2.48 116.42 113.58 1ffh h ASP 50 Ca 0.15 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1ffh h ASP 50 Cb 0.34 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1ffh h ASP 50 CO -0.35 0.78 -0.14 0.15 -1.72 0.00 0.00 179.24 177.96 1ffh h PHE 51 N 1.05 -0.35 -1.01 4.55 3.04 -0.26 -0.42 116.94 123.55 1ffh h PHE 51 Ca 0.26 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.22 1ffh h PHE 51 Cb 0.06 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 38.64 1ffh h PHE 51 CO 0.01 -0.19 0.67 0.28 -2.02 0.00 0.00 178.31 177.06 1ffh h VAL 52 N -0.42 1.25 -0.45 1.41 2.07 -1.20 -1.38 116.25 117.53 1ffh h VAL 52 Ca -0.04 -0.47 -0.12 0.00 0.82 0.00 0.00 66.70 66.89 1ffh h VAL 52 Cb 0.32 -0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1ffh h VAL 52 CO 0.06 0.25 -0.21 -0.33 0.02 0.00 0.00 177.57 177.37 1ffh h GLU 53 N 1.36 0.91 -0.65 1.57 4.39 -1.31 -1.49 114.58 119.35 1ffh h GLU 53 Ca 0.37 -0.37 0.01 0.00 0.34 0.00 0.00 59.36 59.70 1ffh h GLU 53 Cb -0.15 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.43 1ffh h GLU 53 CO -0.08 1.02 0.43 -0.09 -1.16 0.00 0.00 179.01 179.13 1ffh h ARG 54 N 0.79 0.86 -0.29 2.33 9.65 -0.47 -0.85 114.38 126.39 1ffh h ARG 54 Ca 0.11 -0.06 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 1ffh h ARG 54 Cb 0.75 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 1ffh h ARG 54 CO 0.06 0.58 -0.32 0.28 2.80 0.00 0.00 179.97 183.37 1ffh h VAL 55 N 0.89 1.28 0.75 0.20 2.07 -1.08 -1.48 116.25 118.88 1ffh h VAL 55 Ca 0.24 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 1ffh h VAL 55 Cb -0.09 1.40 0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1ffh h VAL 55 CO -0.05 0.46 -0.36 -0.09 0.02 0.00 0.00 177.57 177.55 1ffh h ARG 56 N 0.53 -0.97 -0.39 1.57 2.43 -0.71 -0.65 114.38 116.19 1ffh h ARG 56 Ca 0.06 0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.37 1ffh h ARG 56 Cb 0.80 0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 30.51 1ffh h ARG 56 CO 0.07 -0.63 0.01 1.49 -1.51 0.00 0.00 179.97 179.40 1ffh h GLU 57 N -1.20 0.12 -0.05 0.20 4.81 -1.21 -0.65 114.58 116.60 1ffh h GLU 57 Ca -0.10 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1ffh h GLU 57 Cb 0.79 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.14 1ffh h GLU 57 CO 0.17 0.08 0.02 0.93 -0.73 0.00 0.00 179.01 179.48 1ffh h GLU 58 N 0.12 0.07 -0.55 1.92 4.39 -1.28 -0.57 114.58 118.68 1ffh h GLU 58 Ca 0.19 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.90 1ffh h GLU 58 Cb 0.27 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 1ffh h GLU 58 CO -0.31 0.18 0.35 0.00 -1.16 0.00 0.00 179.01 178.06 1ffh h ALA 59 N 0.89 0.71 -0.55 3.43 0.00 -0.85 0.59 119.26 123.48 1ffh h ALA 59 Ca 0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ffh h ALA 59 Cb 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ffh h ALA 59 CO -0.00 0.08 0.16 -0.07 0.00 0.00 0.00 179.25 179.42 1ffh h LEU 60 N 0.69 0.76 -1.80 0.00 3.38 -1.03 -0.43 115.31 116.88 1ffh h LEU 60 Ca 0.22 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ffh h LEU 60 Cb -0.01 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1ffh h LEU 60 CO -0.08 0.73 -0.15 1.23 0.09 0.00 0.00 178.44 180.26 1ffh h GLY 61 N 0.96 0.00 -1.86 0.83 0.00 0.40 -0.31 103.07 103.08 1ffh h GLY 61 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1ffh h GLY 61 CO -0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.81 1ffh n LYS 62 N -3.73 2.40 -3.75 4.80 4.76 0.05 -4.92 118.16 117.77 1ffh n LYS 62 Ca -0.02 -1.63 -0.26 0.00 -2.87 0.00 0.00 58.31 53.53 1ffh n LYS 62 Cb 0.26 -1.53 0.05 0.00 -1.84 0.00 0.00 35.03 31.97 1ffh n LYS 62 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1ffh n GLN 63 N 0.62 -6.53 -0.09 1.97 1.13 -0.13 -4.88 117.38 109.47 1ffh n GLN 63 Ca 0.15 0.70 0.20 0.00 -1.94 0.00 0.00 57.00 56.11 1ffh n GLN 63 Cb 0.50 -5.65 0.63 0.00 0.11 0.00 0.00 30.24 25.83 1ffh n GLN 63 CO 0.00 0.00 0.00 -0.24 -1.44 0.00 0.00 177.06 175.38 1ffh h VAL 64 N -2.32 0.72 0.00 5.09 3.04 -1.50 -0.66 116.25 120.62 1ffh h VAL 64 Ca -0.58 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 1ffh h VAL 64 Cb 1.37 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 1ffh h VAL 64 CO 0.61 0.03 0.00 0.18 -1.01 0.00 0.00 177.57 177.38 1ffh n LEU 65 N -4.40 0.00 -0.00 3.16 4.77 -1.26 -2.89 117.00 116.38 1ffh n LEU 65 Ca 0.13 0.50 0.08 0.00 -0.03 0.00 0.00 56.01 56.69 1ffh n LEU 65 Cb 0.64 -0.50 -0.12 0.00 -2.33 0.00 0.00 43.42 41.12 1ffh n LEU 65 CO 0.36 -0.03 -0.36 -0.62 -1.33 0.00 0.00 177.39 175.41 1ffh n GLU 66 N -1.50 0.99 -2.03 3.23 1.02 -0.30 -4.63 120.64 117.41 1ffh n GLU 66 Ca 0.07 -0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.73 1ffh n GLU 66 Cb 0.32 -1.36 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 1ffh n GLU 66 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ffh s SER 67 N -3.27 6.40 0.10 1.62 0.15 -0.96 -4.93 113.70 112.81 1ffh s SER 67 Ca 0.00 2.71 0.24 0.00 0.70 0.00 0.00 55.95 59.61 1ffh s SER 67 Cb 0.12 -2.64 0.30 0.00 -1.71 0.00 0.00 66.02 62.08 1ffh s SER 67 CO 0.71 -0.80 1.27 0.18 1.20 0.00 0.00 173.24 175.80 1ffh n LEU 68 N 0.30 0.67 -3.03 3.45 4.77 -1.26 -3.84 117.00 118.05 1ffh n LEU 68 Ca 0.03 0.17 -0.21 0.00 -0.03 0.00 0.00 56.01 55.97 1ffh n LEU 68 Cb 0.43 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 1ffh n LEU 68 CO 0.57 -0.03 -0.08 0.35 -1.33 0.00 0.00 177.39 176.88 1ffh n THR 69 N -2.05 1.09 0.02 -5.08 -2.24 -1.26 -4.13 114.28 100.63 1ffh n THR 69 Ca 0.03 -4.80 0.21 0.00 -2.27 0.00 0.00 64.05 57.22 1ffh n THR 69 Cb 0.43 -0.60 0.72 0.00 -2.10 0.00 0.00 70.33 68.79 1ffh n THR 69 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ffh h PRO 70 N 2.97 0.00 -0.67 -0.78 0.13 -1.79 -1.29 132.00 130.57 1ffh h PRO 70 Ca 0.10 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1ffh h PRO 70 Cb 0.83 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 1ffh h PRO 70 CO 0.62 0.00 0.44 0.00 -0.23 0.00 0.00 178.00 178.83 1ffh h ALA 71 N 1.66 1.54 -0.28 -0.56 0.00 -1.88 -0.33 119.26 119.41 1ffh h ALA 71 Ca 0.24 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 1ffh h ALA 71 Cb 1.06 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ffh h ALA 71 CO -0.00 0.41 -0.49 0.93 0.00 0.00 0.00 179.25 180.10 1ffh h GLU 72 N 0.89 0.77 -0.38 0.00 4.39 -1.60 -0.40 114.58 118.24 1ffh h GLU 72 Ca 0.25 -0.46 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 1ffh h GLU 72 Cb -0.07 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1ffh h GLU 72 CO -0.06 1.09 0.11 0.28 -1.16 0.00 0.00 179.01 179.27 1ffh h VAL 73 N 0.61 1.22 -0.67 3.13 2.07 -1.39 -1.55 116.25 119.66 1ffh h VAL 73 Ca 0.03 -0.72 -0.08 0.00 0.82 0.00 0.00 66.70 66.75 1ffh h VAL 73 Cb 1.07 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 1ffh h VAL 73 CO 0.11 0.25 0.12 0.40 0.02 0.00 0.00 177.57 178.46 1ffh h ILE 74 N 0.47 1.26 0.08 4.57 1.08 -1.01 -1.95 117.51 122.02 1ffh h ILE 74 Ca 0.12 -1.03 0.01 0.00 -0.39 0.00 0.00 64.86 63.58 1ffh h ILE 74 Cb 0.27 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 34.62 1ffh h ILE 74 CO -0.00 0.39 -0.17 0.25 -0.69 0.00 0.00 178.15 177.92 1ffh h LEU 75 N 1.03 -0.48 -0.90 1.44 5.85 -0.79 -0.04 115.31 121.43 1ffh h LEU 75 Ca 0.20 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.99 1ffh h LEU 75 Cb 0.43 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1ffh h LEU 75 CO 0.01 -0.25 0.58 0.00 -0.34 0.00 0.00 178.44 178.45 1ffh h ALA 76 N 0.53 1.14 -0.41 1.25 0.00 -1.19 -0.51 119.26 120.06 1ffh h ALA 76 Ca 0.03 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1ffh h ALA 76 Cb 0.35 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1ffh h ALA 76 CO -0.11 0.55 0.06 1.15 0.00 0.00 0.00 179.25 180.91 1ffh h THR 77 N 1.22 1.24 -0.40 0.00 2.02 -1.00 -1.37 112.91 114.63 1ffh h THR 77 Ca 0.33 -0.89 -0.12 0.00 0.77 0.00 0.00 66.41 66.50 1ffh h THR 77 Cb -0.12 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1ffh h THR 77 CO -0.07 0.30 -0.24 0.58 0.37 0.00 0.00 175.52 176.47 1ffh h VAL 78 N 0.53 1.27 -0.08 3.16 2.07 -0.81 -1.68 116.25 120.72 1ffh h VAL 78 Ca 0.12 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.28 1ffh h VAL 78 Cb 0.38 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1ffh h VAL 78 CO 0.01 0.46 0.04 0.22 0.02 0.00 0.00 177.57 178.32 1ffh h TYR 79 N 0.70 0.08 -0.52 1.57 3.20 -0.92 -0.22 116.97 120.86 1ffh h TYR 79 Ca 0.09 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.99 1ffh h TYR 79 Cb 0.77 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 1ffh h TYR 79 CO 0.04 0.05 0.32 1.49 -1.64 0.00 0.00 178.16 178.41 1ffh h GLU 80 N 0.09 0.61 -0.49 1.82 4.57 -1.12 -0.77 114.58 119.29 1ffh h GLU 80 Ca 0.03 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1ffh h GLU 80 Cb 0.00 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 1ffh h GLU 80 CO -0.02 0.41 -0.02 0.00 -1.18 0.00 0.00 179.01 178.20 1ffh h ALA 81 N 1.23 1.04 -0.15 2.92 0.00 -1.00 -1.38 119.26 121.91 1ffh h ALA 81 Ca 0.21 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1ffh h ALA 81 Cb 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ffh h ALA 81 CO -0.09 0.59 -0.03 -0.07 0.00 0.00 0.00 179.25 179.66 1ffh h LEU 82 N 0.77 0.29 -0.24 0.00 3.38 -0.75 -0.97 115.31 117.78 1ffh h LEU 82 Ca 0.14 -0.35 0.06 0.00 0.09 0.00 0.00 57.88 57.82 1ffh h LEU 82 Cb 0.50 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 1ffh h LEU 82 CO 0.02 0.57 -0.13 0.50 0.09 0.00 0.00 178.44 179.50 1ffh h LYS 83 N -0.01 -0.10 -0.23 1.13 3.64 -0.93 0.13 116.57 120.19 1ffh h LYS 83 Ca 0.04 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1ffh h LYS 83 Cb 0.44 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1ffh h LYS 83 CO 0.01 -0.07 0.09 0.93 -2.27 0.00 0.00 179.45 178.14 1ffh h GLU 84 N -0.10 0.36 -0.95 1.90 4.39 -1.22 0.25 114.58 119.20 1ffh h GLU 84 Ca 0.13 -0.07 0.07 0.00 0.34 0.00 0.00 59.36 59.84 1ffh h GLU 84 Cb 0.30 -0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 28.83 1ffh h GLU 84 CO -0.31 0.42 0.60 0.00 -1.16 0.00 0.00 179.01 178.56 1ffh h ALA 85 N 0.92 1.34 0.00 3.43 0.00 -0.83 -1.09 119.26 123.04 1ffh h ALA 85 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ffh h ALA 85 Cb 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ffh h ALA 85 CO -0.00 0.35 0.00 1.28 0.00 0.00 0.00 179.25 180.87 1ffh n LEU 86 N -4.57 0.00 0.00 0.00 4.77 0.00 -4.31 117.00 112.89 1ffh n LEU 86 Ca 0.15 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.62 1ffh n LEU 86 Cb 0.21 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1ffh n LEU 86 CO 0.31 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1ffh n GLY 87 N 0.24 0.86 5.82 -0.72 0.00 -0.42 -4.73 105.19 106.24 1ffh n GLY 87 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ffh n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffh n GLY 88 N 0.00 2.33 3.34 -0.02 0.00 0.87 -4.78 105.19 106.93 1ffh n GLY 88 Ca 0.00 0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1ffh n GLY 88 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ffh s GLU 89 N 0.00 1.38 0.36 1.61 2.12 -1.26 -4.35 118.70 118.55 1ffh s GLU 89 Ca 0.00 -1.22 -0.28 0.00 0.36 0.00 0.00 54.97 53.83 1ffh s GLU 89 Cb 0.00 -1.72 -0.11 0.00 0.26 0.00 0.00 34.13 32.56 1ffh s GLU 89 CO 0.00 0.42 1.44 0.00 -0.54 0.00 0.00 175.26 176.58 1ffh s ALA 90 N -1.03 3.56 0.04 6.30 0.00 -1.26 -4.83 121.76 124.54 1ffh s ALA 90 Ca 0.11 1.48 0.04 0.00 0.00 0.00 0.00 51.96 53.59 1ffh s ALA 90 Cb -0.10 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 1ffh s ALA 90 CO 0.04 -0.93 -0.12 1.03 0.00 0.00 0.00 175.76 175.78 1ffh s ARG 91 N -1.88 0.82 0.03 0.00 0.52 -1.26 -5.08 118.95 112.09 1ffh s ARG 91 Ca 0.52 -0.73 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 1ffh s ARG 91 Cb -0.45 -0.79 -0.02 0.00 0.52 0.00 0.00 34.95 34.22 1ffh s ARG 91 CO 0.59 0.19 -0.04 -0.51 0.02 0.00 0.00 175.30 175.54 1ffh s LEU 92 N -1.19 2.26 0.67 2.53 1.43 -1.26 -4.54 118.68 118.58 1ffh s LEU 92 Ca -0.01 -0.55 -0.17 0.00 -1.03 0.00 0.00 54.13 52.38 1ffh s LEU 92 Cb -0.08 0.02 -0.01 0.00 0.03 0.00 0.00 46.19 46.16 1ffh s LEU 92 CO 0.01 -0.29 1.08 -2.65 0.23 0.00 0.00 176.35 174.73 1ffh n PRO 93 N 1.46 0.77 -3.22 1.29 -0.02 -1.26 -4.94 135.00 129.08 1ffh n PRO 93 Ca -0.23 0.32 -0.40 0.00 -2.02 0.00 0.00 63.50 61.16 1ffh n PRO 93 Cb 0.55 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.64 1ffh n PRO 93 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ffh s VAL 94 N -1.62 5.04 0.17 -1.45 0.11 -1.26 -5.05 120.40 116.34 1ffh s VAL 94 Ca 0.77 0.77 -0.13 0.00 -2.93 0.00 0.00 61.98 60.46 1ffh s VAL 94 Cb -0.37 -3.88 -0.07 0.00 -1.53 0.00 0.00 36.38 30.53 1ffh s VAL 94 CO 0.46 -0.00 0.55 -0.76 -3.33 0.00 0.00 175.10 172.01 1ffh s LEU 95 N 2.37 4.29 0.00 2.54 1.43 -1.26 -5.07 118.68 122.98 1ffh s LEU 95 Ca 0.21 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.34 1ffh s LEU 95 Cb -0.15 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1ffh s LEU 95 CO 0.10 0.06 0.00 2.29 0.23 0.00 0.00 176.35 179.03 1ffh n LYS 96 N 0.56 0.41 0.02 1.70 2.85 -1.26 -5.06 118.16 117.37 1ffh n LYS 96 Ca -0.04 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.11 1ffh n LYS 96 Cb 0.52 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.83 1ffh n LYS 96 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1ffh h ASP 97 N 0.00 -1.21 -4.27 -5.58 3.58 -1.98 -3.42 116.42 103.53 1ffh h ASP 97 Ca 0.00 0.14 -0.60 0.00 0.42 0.00 0.00 57.03 56.99 1ffh h ASP 97 Cb 0.00 0.47 -0.26 0.00 1.72 0.00 0.00 39.33 41.26 1ffh h ASP 97 CO 0.00 -0.36 -0.85 -0.13 -2.88 0.00 0.00 179.24 175.02 1ffh s ARG 98 N -4.94 1.45 -0.01 0.28 1.81 -1.26 -4.81 118.95 111.47 1ffh s ARG 98 Ca -0.11 -0.99 0.00 0.00 -1.72 0.00 0.00 55.73 52.91 1ffh s ARG 98 Cb 0.05 -1.59 0.01 0.00 -0.45 0.00 0.00 34.95 32.97 1ffh s ARG 98 CO 0.44 0.41 0.01 -0.80 -0.68 0.00 0.00 175.30 174.67 1ffh s ASN 99 N -1.25 0.13 -0.17 0.23 -0.87 -1.00 -5.01 114.94 106.99 1ffh s ASN 99 Ca 0.08 0.00 -0.01 0.00 -1.57 0.00 0.00 52.86 51.37 1ffh s ASN 99 Cb -0.09 -0.06 0.05 0.00 -0.02 0.00 0.00 41.25 41.12 1ffh s ASN 99 CO 0.02 -0.06 -0.03 -0.22 -2.57 0.00 0.00 177.10 174.24 1ffh s LEU 100 N 0.54 1.61 0.10 0.60 0.20 -1.26 0.14 118.68 120.61 1ffh s LEU 100 Ca -0.05 -0.73 0.09 0.00 0.69 0.00 0.00 54.13 54.14 1ffh s LEU 100 Cb -0.07 -0.86 -0.04 0.00 -0.43 0.00 0.00 46.19 44.79 1ffh s LEU 100 CO -0.01 -0.21 -0.22 0.26 -0.29 0.00 0.00 176.35 175.87 1ffh s TRP 101 N 1.66 2.43 -0.06 5.38 0.51 0.55 -0.17 118.94 129.25 1ffh s TRP 101 Ca -0.00 -0.32 -0.03 0.00 -2.12 0.00 0.00 56.10 53.62 1ffh s TRP 101 Cb -0.16 -1.34 -0.04 0.00 -0.81 0.00 0.00 33.47 31.12 1ffh s TRP 101 CO -0.07 0.31 0.11 -0.06 -0.51 0.00 0.00 176.95 176.73 1ffh s PHE 102 N -1.03 3.43 -0.26 -1.98 0.40 -0.54 -0.64 117.98 117.35 1ffh s PHE 102 Ca 0.15 0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 56.79 1ffh s PHE 102 Cb -0.10 -1.83 0.02 0.00 0.51 0.00 0.00 43.02 41.61 1ffh s PHE 102 CO 0.07 0.62 -0.02 -0.51 0.70 0.00 0.00 175.22 176.08 1ffh s LEU 103 N -1.41 3.37 0.21 -0.37 2.01 0.39 -0.45 118.68 122.43 1ffh s LEU 103 Ca 0.20 -0.80 0.11 0.00 0.01 0.00 0.00 54.13 53.65 1ffh s LEU 103 Cb -0.12 -1.73 -0.05 0.00 0.01 0.00 0.00 46.19 44.30 1ffh s LEU 103 CO 0.10 -0.14 -0.22 0.68 1.01 0.00 0.00 176.35 177.78 1ffh s VAL 104 N 1.38 2.47 0.00 -1.59 -7.23 0.46 -2.35 120.40 113.54 1ffh s VAL 104 Ca 0.01 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1ffh s VAL 104 Cb -0.17 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.56 1ffh s VAL 104 CO -0.02 -0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1ffh n GLY 105 N 0.06 2.00 3.87 2.32 0.00 -1.26 -0.68 105.19 111.50 1ffh n GLY 105 Ca -0.11 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 1ffh n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ffh s LEU 106 N 0.00 3.40 0.00 0.99 1.43 -1.26 -4.37 118.68 118.87 1ffh s LEU 106 Ca 0.00 1.39 -0.30 0.00 -1.03 0.00 0.00 54.13 54.19 1ffh s LEU 106 Cb 0.00 -4.39 -0.06 0.00 0.03 0.00 0.00 46.19 41.77 1ffh s LEU 106 CO 0.00 -0.75 1.47 -1.58 0.23 0.00 0.00 176.35 175.72 1ffh s GLN 107 N -4.80 4.25 0.00 1.70 0.74 -0.03 -1.75 119.66 119.77 1ffh s GLN 107 Ca 0.55 2.05 0.00 0.00 0.05 0.00 0.00 55.36 58.01 1ffh s GLN 107 Cb -0.11 -3.62 0.00 0.00 1.10 0.00 0.00 33.01 30.38 1ffh s GLN 107 CO 0.47 -0.64 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 1ffh n GLY 108 N 3.76 0.98 0.15 2.59 0.00 -1.26 -4.63 105.19 106.78 1ffh n GLY 108 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1ffh n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ffh h SER 109 N 0.00 0.00 0.00 1.61 4.64 -1.68 -3.45 113.55 114.67 1ffh h SER 109 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ffh h SER 109 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ffh h SER 109 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1ffh n GLY 110 N 1.22 0.79 0.09 -0.77 0.00 -1.26 -4.26 105.19 100.99 1ffh n GLY 110 Ca 0.05 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 1ffh n GLY 110 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ffh h LYS 111 N 0.00 0.06 -0.27 1.61 3.64 -1.91 -1.50 116.57 118.21 1ffh h LYS 111 Ca 0.00 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1ffh h LYS 111 Cb 0.38 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1ffh h LYS 111 CO 0.00 0.04 0.04 1.15 -2.27 0.00 0.00 179.45 178.41 1ffh h THR 112 N 0.06 1.23 -0.44 1.00 2.02 -1.94 -0.78 112.91 114.07 1ffh h THR 112 Ca 0.07 -0.79 -0.07 0.00 0.77 0.00 0.00 66.41 66.39 1ffh h THR 112 Cb 0.07 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1ffh h THR 112 CO -0.11 0.26 -0.01 0.71 0.37 0.00 0.00 175.52 176.73 1ffh h THR 113 N 0.27 1.24 -0.73 3.16 1.35 -1.97 -2.35 112.91 113.87 1ffh h THR 113 Ca 0.08 -0.98 -0.05 0.00 -0.55 0.00 0.00 66.41 64.92 1ffh h THR 113 Cb 0.34 0.92 -0.03 0.00 -1.73 0.00 0.00 68.15 67.64 1ffh h THR 113 CO 0.01 0.34 0.27 0.74 -0.25 0.00 0.00 175.52 176.63 1ffh h THR 114 N 0.68 1.25 -0.21 6.82 2.02 -1.02 -0.28 112.91 122.16 1ffh h THR 114 Ca 0.13 -0.81 0.03 0.00 0.77 0.00 0.00 66.41 66.53 1ffh h THR 114 Cb 0.44 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 1ffh h THR 114 CO 0.02 0.33 0.04 0.00 0.37 0.00 0.00 175.52 176.27 1ffh h ALA 115 N 1.22 0.21 -0.60 6.16 0.00 -0.61 0.14 119.26 125.79 1ffh h ALA 115 Ca 0.24 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 1ffh h ALA 115 Cb 0.23 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1ffh h ALA 115 CO -0.02 -0.39 0.12 0.00 0.00 0.00 0.00 179.25 178.96 1ffh h ALA 116 N 1.16 0.79 -0.81 0.00 0.00 -1.24 -1.74 119.26 117.42 1ffh h ALA 116 Ca 0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1ffh h ALA 116 Cb 0.10 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1ffh h ALA 116 CO -0.13 0.52 0.41 0.87 0.00 0.00 0.00 179.25 180.92 1ffh h LYS 117 N 0.88 1.16 -0.61 0.00 1.57 -0.62 -1.69 116.57 117.25 1ffh h LYS 117 Ca 0.18 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1ffh h LYS 117 Cb 0.39 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1ffh h LYS 117 CO 0.01 0.88 0.16 -0.07 -0.57 0.00 0.00 179.45 179.86 1ffh h LEU 118 N 1.15 0.91 -0.44 2.94 3.38 -0.44 -0.87 115.31 121.94 1ffh h LEU 118 Ca 0.28 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ffh h LEU 118 Cb 0.09 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1ffh h LEU 118 CO -0.04 0.90 0.25 0.00 0.09 0.00 0.00 178.44 179.64 1ffh h ALA 119 N 1.05 0.57 -0.62 1.53 0.00 -0.96 -1.37 119.26 119.45 1ffh h ALA 119 Ca 0.19 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ffh h ALA 119 Cb 0.33 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1ffh h ALA 119 CO -0.00 0.08 0.24 1.25 0.00 0.00 0.00 179.25 180.82 1ffh h LEU 120 N 0.58 0.86 -0.07 0.00 5.85 -1.15 -0.35 115.31 121.03 1ffh h LEU 120 Ca 0.16 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1ffh h LEU 120 Cb 0.03 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1ffh h LEU 120 CO -0.03 0.80 -0.06 0.22 -0.34 0.00 0.00 178.44 179.04 1ffh h TYR 121 N 0.87 -0.14 0.00 1.25 3.20 -0.74 -1.94 116.97 119.46 1ffh h TYR 121 Ca 0.21 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.98 1ffh h TYR 121 Cb 0.21 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 1ffh h TYR 121 CO 0.01 -0.09 -0.50 1.88 -1.64 0.00 0.00 178.16 177.82 1ffh h TYR 122 N -0.07 0.00 -0.64 -3.82 0.05 -1.13 -2.94 116.97 108.41 1ffh h TYR 122 Ca 0.05 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 1ffh h TYR 122 Cb 0.14 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.85 1ffh h TYR 122 CO -0.16 0.50 0.29 -0.22 -1.05 0.00 0.00 178.16 177.51 1ffh h LYS 123 N 0.00 0.93 0.00 4.88 3.64 -0.78 -0.87 116.57 124.38 1ffh h LYS 123 Ca -0.00 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1ffh h LYS 123 Cb 1.09 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1ffh h LYS 123 CO 0.06 0.76 -0.04 0.78 -2.27 0.00 0.00 179.45 178.74 1ffh h GLY 124 N 0.89 0.00 -1.47 5.01 0.00 -1.18 -0.76 103.07 105.55 1ffh h GLY 124 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1ffh h GLY 124 CO -0.02 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.80 1ffh n LYS 125 N -3.83 1.93 -0.27 4.80 5.02 -0.46 -4.91 118.16 120.45 1ffh n LYS 125 Ca -0.03 -1.44 0.00 0.00 -2.02 0.00 0.00 58.31 54.82 1ffh n LYS 125 Cb 0.14 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1ffh n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ffh n GLY 126 N 1.14 0.67 3.90 0.72 0.00 -0.29 -5.07 105.19 106.25 1ffh n GLY 126 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1ffh n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ffh s ARG 127 N -0.73 3.34 -0.66 1.61 1.81 -0.46 -5.00 118.95 118.85 1ffh s ARG 127 Ca 0.00 0.32 0.03 0.00 -1.72 0.00 0.00 55.73 54.35 1ffh s ARG 127 Cb 0.00 -2.24 0.16 0.00 -0.45 0.00 0.00 34.95 32.42 1ffh s ARG 127 CO 0.00 -0.49 0.45 1.03 -0.68 0.00 0.00 175.30 175.61 1ffh s ARG 128 N -4.97 2.44 0.64 3.54 0.52 -1.26 -4.18 118.95 115.67 1ffh s ARG 128 Ca 0.52 -3.01 -0.13 0.00 -0.52 0.00 0.00 55.73 52.59 1ffh s ARG 128 Cb -0.11 -3.51 -0.01 0.00 0.52 0.00 0.00 34.95 31.84 1ffh s ARG 128 CO 0.48 -1.21 1.06 -1.25 0.02 0.00 0.00 175.30 174.39 1ffh s PRO 129 N -0.90 3.14 -0.07 3.54 0.04 -1.26 -0.96 135.00 138.53 1ffh s PRO 129 Ca 0.22 1.07 -0.02 0.00 0.04 0.00 0.00 61.00 62.32 1ffh s PRO 129 Cb -0.14 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.42 1ffh s PRO 129 CO -0.09 -0.95 0.01 -1.17 0.04 0.00 0.00 177.00 174.85 1ffh s LEU 130 N -5.02 0.55 -0.03 -3.56 2.96 0.21 -4.40 118.68 109.39 1ffh s LEU 130 Ca 0.61 -0.10 -0.21 0.00 -0.22 0.00 0.00 54.13 54.20 1ffh s LEU 130 Cb -0.15 -0.41 -0.05 0.00 0.50 0.00 0.00 46.19 46.09 1ffh s LEU 130 CO 0.46 -0.21 0.62 -0.76 -1.32 0.00 0.00 176.35 175.14 1ffh s LEU 131 N 1.99 4.38 -0.22 -0.68 1.43 -0.19 -0.30 118.68 125.09 1ffh s LEU 131 Ca 0.05 1.15 0.02 0.00 -1.03 0.00 0.00 54.13 54.31 1ffh s LEU 131 Cb -0.12 -2.96 0.04 0.00 0.03 0.00 0.00 46.19 43.18 1ffh s LEU 131 CO -0.05 0.03 -0.14 -0.69 0.23 0.00 0.00 176.35 175.73 1ffh s VAL 132 N 0.18 2.00 -0.85 -1.59 1.01 0.23 -0.53 120.40 120.84 1ffh s VAL 132 Ca 0.33 -1.23 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 1ffh s VAL 132 Cb -0.18 -1.99 0.08 0.00 0.00 0.00 0.00 36.38 34.29 1ffh s VAL 132 CO 0.17 0.22 1.17 0.00 0.00 0.00 0.00 175.10 176.66 1ffh s ALA 133 N 1.24 3.07 -2.10 5.51 0.00 -0.05 -0.50 121.76 128.93 1ffh s ALA 133 Ca -0.02 -2.21 0.14 0.00 0.00 0.00 0.00 51.96 49.87 1ffh s ALA 133 Cb -0.17 -4.13 0.57 0.00 0.00 0.00 0.00 23.12 19.40 1ffh s ALA 133 CO -0.09 -3.11 1.41 0.00 0.00 0.00 0.00 175.76 173.98 1ffh n ALA 134 N 7.77 2.51 -2.30 0.00 0.00 -0.67 -2.22 120.51 125.61 1ffh n ALA 134 Ca 0.15 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 1ffh n ALA 134 Cb 0.48 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 1ffh n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ffh s ASP 135 N -1.31 6.19 0.00 0.00 -1.08 -1.26 -4.55 116.67 114.66 1ffh s ASP 135 Ca 0.24 0.74 0.29 0.00 -0.52 0.00 0.00 52.55 53.29 1ffh s ASP 135 Cb 0.12 -2.54 1.52 0.00 -1.46 0.00 0.00 42.92 40.57 1ffh s ASP 135 CO 0.18 -1.57 2.00 0.35 0.52 0.00 0.00 175.17 176.65 1ffh n THR 136 N 7.09 0.01 -0.03 1.71 -2.24 -1.26 -3.96 114.28 115.60 1ffh n THR 136 Ca 0.17 -0.08 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 1ffh n THR 136 Cb 0.48 -0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.50 1ffh n THR 136 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffh n GLN 137 N -0.60 2.81 -3.96 -0.78 3.00 -1.26 -1.37 117.38 115.22 1ffh n GLN 137 Ca 0.21 -0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.86 1ffh n GLN 137 Cb 0.18 -1.15 -0.14 0.00 0.00 0.00 0.00 30.24 29.13 1ffh n GLN 137 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1ffh s ARG 138 N -2.17 1.96 0.31 -1.09 0.52 -1.25 -4.98 118.95 112.25 1ffh s ARG 138 Ca -0.03 -1.61 0.02 0.00 -0.52 0.00 0.00 55.73 53.58 1ffh s ARG 138 Cb 0.02 -3.20 0.57 0.00 0.52 0.00 0.00 34.95 32.85 1ffh s ARG 138 CO 0.24 -0.81 1.93 -1.35 0.02 0.00 0.00 175.30 175.33 1ffh h PRO 139 N 7.81 0.95 -0.90 3.54 0.11 -1.94 -2.27 132.00 139.30 1ffh h PRO 139 Ca -0.13 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.97 1ffh h PRO 139 Cb 1.04 -0.21 -0.06 0.00 0.11 0.00 0.00 31.00 31.88 1ffh h PRO 139 CO 0.54 0.63 0.59 0.00 -0.21 0.00 0.00 178.00 179.55 1ffh h ALA 140 N 1.53 1.47 -0.30 -0.75 0.00 -1.97 0.15 119.26 119.38 1ffh h ALA 140 Ca 0.37 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.14 1ffh h ALA 140 Cb 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ffh h ALA 140 CO -0.13 0.42 -0.23 0.00 0.00 0.00 0.00 179.25 179.31 1ffh h ALA 141 N 1.49 1.03 -0.16 0.00 0.00 -1.81 -1.55 119.26 118.27 1ffh h ALA 141 Ca 0.37 -0.35 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 1ffh h ALA 141 Cb 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ffh h ALA 141 CO -0.13 0.58 -0.75 0.00 0.00 0.00 0.00 179.25 178.95 1ffh h ARG 142 N 0.52 0.79 -0.90 0.00 3.08 -1.12 -3.16 114.38 113.59 1ffh h ARG 142 Ca 0.08 -0.64 -0.01 0.00 0.07 0.00 0.00 59.98 59.48 1ffh h ARG 142 Cb 0.68 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.81 1ffh h ARG 142 CO 0.05 1.24 0.52 1.49 -1.07 0.00 0.00 179.97 182.20 1ffh h GLU 143 N 0.52 1.23 -0.40 0.04 4.57 -0.57 -1.11 114.58 118.87 1ffh h GLU 143 Ca -0.05 -0.13 0.04 0.00 -1.18 0.00 0.00 59.36 58.04 1ffh h GLU 143 Cb 1.38 -0.25 -0.04 0.00 -0.16 0.00 0.00 28.75 29.68 1ffh h GLU 143 CO 0.16 0.88 0.17 0.37 -1.18 0.00 0.00 179.01 179.40 1ffh h GLN 144 N 1.25 0.33 -0.20 1.92 4.15 -1.27 -0.34 115.11 120.96 1ffh h GLN 144 Ca 0.32 -0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.59 1ffh h GLN 144 Cb -0.01 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1ffh h GLN 144 CO -0.06 0.22 -0.44 1.25 -1.93 0.00 0.00 178.83 177.88 1ffh h LEU 145 N 0.34 0.51 -0.20 -2.39 5.85 -1.43 -1.37 115.31 116.62 1ffh h LEU 145 Ca 0.18 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.67 1ffh h LEU 145 Cb 0.13 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1ffh h LEU 145 CO -0.16 0.88 0.10 -0.09 -0.34 0.00 0.00 178.44 178.84 1ffh h ARG 146 N 0.39 0.21 -0.57 1.25 2.43 -0.56 0.11 114.38 117.64 1ffh h ARG 146 Ca 0.03 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1ffh h ARG 146 Cb 0.92 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 1ffh h ARG 146 CO 0.08 0.14 0.32 -0.07 -1.51 0.00 0.00 179.97 178.93 1ffh h LEU 147 N 0.21 0.70 -0.33 3.80 3.38 -0.92 -1.84 115.31 120.30 1ffh h LEU 147 Ca 0.08 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ffh h LEU 147 Cb 0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1ffh h LEU 147 CO -0.05 0.58 0.19 -0.07 0.09 0.00 0.00 178.44 179.17 1ffh h LEU 148 N 0.76 0.41 -1.39 1.67 3.38 -0.78 -2.18 115.31 117.18 1ffh h LEU 148 Ca 0.20 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1ffh h LEU 148 Cb 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1ffh h LEU 148 CO -0.03 0.37 0.26 1.23 0.09 0.00 0.00 178.44 180.35 1ffh h GLY 149 N 0.42 0.72 1.00 0.83 0.00 -0.58 -1.27 103.07 104.19 1ffh h GLY 149 Ca 0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1ffh h GLY 149 CO -0.02 0.30 0.41 -2.09 0.00 0.00 0.00 176.54 175.14 1ffh h GLU 150 N 0.68 0.92 -0.21 4.80 4.81 -1.02 0.64 114.58 125.20 1ffh h GLU 150 Ca 0.18 -0.08 -0.19 0.00 -0.13 0.00 0.00 59.36 59.13 1ffh h GLU 150 Cb 0.03 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1ffh h GLU 150 CO -0.03 0.66 -0.63 0.87 -0.73 0.00 0.00 179.01 179.14 1ffh h LYS 151 N 0.92 0.75 -0.20 1.92 1.57 -0.64 -3.19 116.57 117.71 1ffh h LYS 151 Ca 0.24 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1ffh h LYS 151 Cb -0.03 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ffh h LYS 151 CO -0.05 1.15 0.00 1.33 -0.57 0.00 0.00 179.45 181.32 1ffh n VAL 152 N -3.96 0.25 -3.28 0.50 0.24 -0.59 -4.94 118.33 106.54 1ffh n VAL 152 Ca -0.05 -0.39 -0.17 0.00 -2.04 0.00 0.00 64.34 61.69 1ffh n VAL 152 Cb 0.67 0.41 0.06 0.00 -1.47 0.00 0.00 33.84 33.51 1ffh n VAL 152 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ffh n GLY 153 N 1.15 -0.15 3.08 7.63 0.00 -0.33 -4.86 105.19 111.71 1ffh n GLY 153 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1ffh n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffh s VAL 154 N -3.24 1.23 0.49 1.61 1.01 0.07 -5.04 120.40 116.53 1ffh s VAL 154 Ca 0.40 -0.58 -0.23 0.00 0.00 0.00 0.00 61.98 61.57 1ffh s VAL 154 Cb -0.17 -1.08 -0.06 0.00 0.00 0.00 0.00 36.38 35.06 1ffh s VAL 154 CO 0.54 0.37 1.27 -2.16 0.00 0.00 0.00 175.10 175.11 1ffh s PRO 155 N 0.28 3.53 -0.10 2.72 0.04 -1.26 -4.18 135.00 136.03 1ffh s PRO 155 Ca -0.08 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.00 1ffh s PRO 155 Cb -0.13 -2.40 0.02 0.00 0.04 0.00 0.00 34.50 32.04 1ffh s PRO 155 CO 0.03 -0.81 -0.14 0.08 0.04 0.00 0.00 177.00 176.19 1ffh s VAL 156 N -1.40 1.40 -0.25 -0.36 1.01 -1.26 -1.03 120.40 118.51 1ffh s VAL 156 Ca 0.66 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.97 1ffh s VAL 156 Cb -0.35 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1ffh s VAL 156 CO 0.42 0.42 0.12 -0.22 0.00 0.00 0.00 175.10 175.84 1ffh s LEU 157 N 1.04 3.72 -0.20 3.92 0.20 0.31 -4.99 118.68 122.69 1ffh s LEU 157 Ca -0.06 -0.09 -0.08 0.00 0.69 0.00 0.00 54.13 54.59 1ffh s LEU 157 Cb -0.15 -2.01 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 1ffh s LEU 157 CO -0.02 -0.01 0.09 -1.61 -0.29 0.00 0.00 176.35 174.51 1ffh s GLU 158 N 1.49 4.00 0.87 1.98 2.02 -1.26 -0.87 118.70 126.92 1ffh s GLU 158 Ca 0.06 -0.32 -0.12 0.00 0.02 0.00 0.00 54.97 54.61 1ffh s GLU 158 Cb -0.15 -3.30 0.11 0.00 0.10 0.00 0.00 34.13 30.90 1ffh s GLU 158 CO 0.06 0.22 1.10 0.14 0.02 0.00 0.00 175.26 176.79 1ffh s VAL 159 N 0.55 2.70 0.31 2.63 -7.23 -0.94 -4.97 120.40 113.44 1ffh s VAL 159 Ca 0.05 0.23 0.06 0.00 -1.81 0.00 0.00 61.98 60.50 1ffh s VAL 159 Cb -0.13 -2.83 -0.02 0.00 0.56 0.00 0.00 36.38 33.96 1ffh s VAL 159 CO 0.01 -0.30 0.42 -0.04 -0.31 0.00 0.00 175.10 174.89 1ffh s MET 160 N -5.05 3.17 0.18 4.82 1.00 -1.26 -4.97 119.30 117.19 1ffh s MET 160 Ca 0.63 -0.97 -0.33 0.00 0.00 0.00 0.00 55.69 55.02 1ffh s MET 160 Cb -0.16 -2.81 -0.13 0.00 0.00 0.00 0.00 34.83 31.73 1ffh s MET 160 CO 0.56 0.17 1.69 -0.25 0.00 0.00 0.00 175.02 177.19 1ffh n ASP 161 N -1.55 3.71 -0.19 3.03 8.00 -1.26 -1.94 116.55 126.34 1ffh n ASP 161 Ca -0.03 1.06 -0.03 0.00 0.71 0.00 0.00 54.79 56.51 1ffh n ASP 161 Cb 0.58 -1.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.15 1ffh n ASP 161 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ffh n GLY 162 N 3.83 0.37 3.75 0.44 0.00 -0.47 -4.95 105.19 108.15 1ffh n GLY 162 Ca 0.17 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1ffh n GLY 162 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ffh s GLU 163 N -1.75 4.14 0.63 1.61 2.12 -0.82 -4.98 118.70 119.66 1ffh s GLU 163 Ca 0.00 2.54 -0.14 0.00 0.36 0.00 0.00 54.97 57.73 1ffh s GLU 163 Cb 0.00 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.34 1ffh s GLU 163 CO 0.00 -0.60 1.06 -1.54 -0.54 0.00 0.00 175.26 173.64 1ffh s SER 164 N 0.47 5.58 0.38 -1.70 1.04 -1.26 -4.88 113.70 113.32 1ffh s SER 164 Ca 0.63 1.79 0.05 0.00 0.48 0.00 0.00 55.95 58.90 1ffh s SER 164 Cb -0.47 -2.53 0.75 0.00 0.10 0.00 0.00 66.02 63.87 1ffh s SER 164 CO 0.48 -1.31 2.01 -0.65 0.98 0.00 0.00 173.24 174.75 1ffh h PRO 165 N 0.08 0.70 -0.41 4.02 0.11 -1.96 -0.78 132.00 133.75 1ffh h PRO 165 Ca -0.46 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1ffh h PRO 165 Cb 1.22 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1ffh h PRO 165 CO 0.57 0.46 0.05 0.93 -0.21 0.00 0.00 178.00 179.79 1ffh h GLU 166 N 0.72 0.70 -0.52 1.05 3.07 -1.96 -0.41 114.58 117.22 1ffh h GLU 166 Ca 0.23 -0.20 -0.10 0.00 -0.50 0.00 0.00 59.36 58.78 1ffh h GLU 166 Cb 0.03 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 1ffh h GLU 166 CO -0.06 0.75 -0.09 1.03 -1.40 0.00 0.00 179.01 179.25 1ffh h SER 167 N 0.54 0.97 -0.19 1.42 0.87 -1.79 -1.41 113.55 113.97 1ffh h SER 167 Ca 0.12 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 1ffh h SER 167 Cb 0.41 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1ffh h SER 167 CO 0.01 1.09 0.12 0.40 -0.53 0.00 0.00 176.83 177.92 1ffh h ILE 168 N 0.84 1.04 -0.60 2.23 2.04 -1.02 -0.98 117.51 121.06 1ffh h ILE 168 Ca 0.14 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.94 1ffh h ILE 168 Cb 0.64 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 1ffh h ILE 168 CO 0.04 0.04 0.37 -0.09 0.00 0.00 0.00 178.15 178.52 1ffh h ARG 169 N 0.24 0.72 -0.30 2.37 2.43 -0.90 0.19 114.38 119.13 1ffh h ARG 169 Ca 0.07 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1ffh h ARG 169 Cb -0.02 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1ffh h ARG 169 CO -0.02 0.48 0.17 -0.09 -1.51 0.00 0.00 179.97 178.99 1ffh h ARG 170 N 0.74 0.41 -0.39 0.20 2.43 -0.92 -0.84 114.38 116.02 1ffh h ARG 170 Ca 0.24 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.22 1ffh h ARG 170 Cb 0.01 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1ffh h ARG 170 CO -0.10 0.34 -0.34 0.00 -1.51 0.00 0.00 179.97 178.36 1ffh h ARG 171 N 0.37 0.90 -0.08 0.20 3.08 -0.92 -2.11 114.38 115.83 1ffh h ARG 171 Ca 0.11 -0.45 -0.00 0.00 0.07 0.00 0.00 59.98 59.70 1ffh h ARG 171 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1ffh h ARG 171 CO -0.02 1.10 0.04 0.28 -1.07 0.00 0.00 179.97 180.30 1ffh h VAL 172 N 0.75 1.13 -0.62 2.04 2.07 -0.84 -1.34 116.25 119.44 1ffh h VAL 172 Ca 0.07 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.24 1ffh h VAL 172 Cb 0.92 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.89 1ffh h VAL 172 CO 0.09 0.11 0.37 -0.08 0.02 0.00 0.00 177.57 178.08 1ffh h GLU 173 N -0.01 0.69 0.02 1.57 4.81 -1.14 -0.77 114.58 119.76 1ffh h GLU 173 Ca 0.03 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ffh h GLU 173 Cb 0.15 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1ffh h GLU 173 CO -0.00 0.46 -0.01 1.49 -0.73 0.00 0.00 179.01 180.22 1ffh h GLU 174 N 0.71 -0.03 -0.40 1.92 4.81 -1.19 -1.40 114.58 119.00 1ffh h GLU 174 Ca 0.26 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 1ffh h GLU 174 Cb 0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1ffh h GLU 174 CO -0.12 0.05 0.21 -0.22 -0.73 0.00 0.00 179.01 178.20 1ffh h LYS 175 N -0.10 0.56 -0.94 1.92 3.64 -1.00 -1.34 116.57 119.31 1ffh h LYS 175 Ca -0.00 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1ffh h LYS 175 Cb 0.09 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 1ffh h LYS 175 CO 0.00 0.46 0.60 0.00 -2.27 0.00 0.00 179.45 178.25 1ffh h ALA 176 N 1.07 1.28 -0.03 5.00 0.00 -1.04 0.93 119.26 126.46 1ffh h ALA 176 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ffh h ALA 176 Cb 0.07 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1ffh h ALA 176 CO -0.02 0.41 0.01 -0.09 0.00 0.00 0.00 179.25 179.56 1ffh h ARG 177 N 1.12 0.06 -0.17 0.00 2.43 -0.93 0.10 114.38 116.99 1ffh h ARG 177 Ca 0.40 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.48 1ffh h ARG 177 Cb 0.11 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1ffh h ARG 177 CO -0.15 0.30 -0.20 -0.07 -1.51 0.00 0.00 179.97 178.34 1ffh h LEU 178 N -0.20 0.28 -2.69 3.80 3.38 -0.75 -3.06 115.31 116.06 1ffh h LEU 178 Ca 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ffh h LEU 178 Cb 0.27 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1ffh h LEU 178 CO 0.00 0.49 0.00 -0.62 0.09 0.00 0.00 178.44 178.40 1ffh n GLU 179 N -4.20 2.66 -3.94 1.13 1.02 0.28 -4.99 120.64 112.59 1ffh n GLU 179 Ca -0.01 -2.29 -0.27 0.00 -0.02 0.00 0.00 57.16 54.58 1ffh n GLU 179 Cb 0.33 -1.42 -0.00 0.00 -0.02 0.00 0.00 31.44 30.33 1ffh n GLU 179 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ffh n ALA 180 N 1.10 -1.77 -2.42 0.62 0.00 0.19 -4.94 120.51 113.29 1ffh n ALA 180 Ca 0.18 -0.13 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 1ffh n ALA 180 Cb 0.52 -2.38 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 1ffh n ALA 180 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ffh s ARG 181 N -6.51 4.59 0.00 0.00 1.81 -0.18 -4.80 118.95 113.86 1ffh s ARG 181 Ca 0.23 1.28 0.02 0.00 -1.72 0.00 0.00 55.73 55.54 1ffh s ARG 181 Cb -0.12 -3.39 0.04 0.00 -0.45 0.00 0.00 34.95 31.03 1ffh s ARG 181 CO 0.87 0.18 0.93 -0.40 -0.68 0.00 0.00 175.30 176.20 1ffh n ASP 182 N 3.06 1.92 -3.39 0.23 5.68 -0.13 -4.84 116.55 119.09 1ffh n ASP 182 Ca 0.01 -1.79 -0.13 0.00 -0.50 0.00 0.00 54.79 52.38 1ffh n ASP 182 Cb 0.50 -0.03 -0.09 0.00 -1.14 0.00 0.00 41.12 40.36 1ffh n ASP 182 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1ffh s LEU 183 N -0.81 -0.44 -0.28 -2.12 2.96 -1.18 -2.38 118.68 114.43 1ffh s LEU 183 Ca 0.03 -0.19 -0.10 0.00 -0.22 0.00 0.00 54.13 53.65 1ffh s LEU 183 Cb 0.02 0.80 -0.04 0.00 0.50 0.00 0.00 46.19 47.47 1ffh s LEU 183 CO 0.02 -0.33 0.16 -0.63 -1.32 0.00 0.00 176.35 174.26 1ffh s ILE 184 N 2.45 5.02 -0.37 6.68 1.01 0.12 -0.62 121.20 135.49 1ffh s ILE 184 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 60.65 60.68 1ffh s ILE 184 Cb -0.15 -3.42 0.05 0.00 0.01 0.00 0.00 42.46 38.96 1ffh s ILE 184 CO -0.21 0.23 0.17 -0.76 0.00 0.00 0.00 174.94 174.37 1ffh s LEU 185 N 1.71 4.66 -0.44 2.97 1.43 0.59 -0.33 118.68 129.26 1ffh s LEU 185 Ca 0.07 -1.27 -0.19 0.00 -1.03 0.00 0.00 54.13 51.71 1ffh s LEU 185 Cb -0.16 -1.92 0.03 0.00 0.03 0.00 0.00 46.19 44.17 1ffh s LEU 185 CO 0.09 -0.41 0.54 -0.69 0.23 0.00 0.00 176.35 176.11 1ffh s VAL 186 N 1.42 4.97 -0.75 -1.59 1.01 0.19 -0.60 120.40 125.03 1ffh s VAL 186 Ca 0.01 -0.23 -0.23 0.00 0.00 0.00 0.00 61.98 61.53 1ffh s VAL 186 Cb -0.21 -4.14 0.07 0.00 0.00 0.00 0.00 36.38 32.11 1ffh s VAL 186 CO 0.03 -0.55 1.09 -0.62 0.00 0.00 0.00 175.10 175.05 1ffh s ASP 187 N 2.02 6.28 1.00 3.32 2.15 0.34 -0.46 116.67 131.32 1ffh s ASP 187 Ca 0.16 -1.12 -0.14 0.00 0.43 0.00 0.00 52.55 51.88 1ffh s ASP 187 Cb -0.16 -2.45 0.19 0.00 -0.30 0.00 0.00 42.92 40.19 1ffh s ASP 187 CO 0.15 -1.45 1.13 0.42 -0.17 0.00 0.00 175.17 175.25 1ffh s THR 188 N 4.20 1.94 0.22 1.71 -4.23 -0.99 -1.67 115.64 116.81 1ffh s THR 188 Ca 0.28 0.00 -0.31 0.00 -1.18 0.00 0.00 61.69 60.48 1ffh s THR 188 Cb -0.12 -2.63 -0.11 0.00 1.34 0.00 0.00 72.50 70.98 1ffh s THR 188 CO 0.06 0.00 1.62 0.00 -0.54 0.00 0.00 174.62 175.76 1ffh s ALA 189 N -3.16 3.82 -0.17 3.99 0.00 -1.26 -4.74 121.76 120.24 1ffh s ALA 189 Ca 0.66 1.50 -0.03 0.00 0.00 0.00 0.00 51.96 54.09 1ffh s ALA 189 Cb -0.15 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.30 1ffh s ALA 189 CO 0.55 -0.88 -0.05 0.20 0.00 0.00 0.00 175.76 175.58 1ffh s GLY 190 N 0.95 1.66 0.20 0.00 0.00 -1.26 -4.72 107.32 104.14 1ffh s GLY 190 Ca 0.69 -0.92 0.08 0.00 0.00 0.00 0.00 44.72 44.58 1ffh s GLY 190 CO 0.36 0.03 -0.14 0.50 0.00 0.00 0.00 173.10 173.85 1ffh s ARG 191 N 0.64 1.32 0.45 2.90 1.81 -1.26 -4.40 118.95 120.40 1ffh s ARG 191 Ca -0.03 -1.57 0.13 0.00 -1.72 0.00 0.00 55.73 52.54 1ffh s ARG 191 Cb -0.15 -1.12 1.02 0.00 -0.45 0.00 0.00 34.95 34.26 1ffh s ARG 191 CO 0.02 0.19 2.03 -0.07 -0.68 0.00 0.00 175.30 176.79 1ffh h LEU 192 N 2.61 0.08 -8.16 2.53 3.38 -1.95 -0.03 115.31 113.77 1ffh h LEU 192 Ca -0.38 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.45 1ffh h LEU 192 Cb 1.22 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 41.81 1ffh h LEU 192 CO 0.61 0.18 -0.50 0.00 0.09 0.00 0.00 178.44 178.82 1ffh s GLN 193 N -4.84 0.91 -0.18 1.13 -2.07 -1.26 -4.80 119.66 108.55 1ffh s GLN 193 Ca -0.05 -1.22 -0.27 0.00 -1.82 0.00 0.00 55.36 52.00 1ffh s GLN 193 Cb 0.16 0.30 -0.01 0.00 -1.09 0.00 0.00 33.01 32.37 1ffh s GLN 193 CO 0.70 -0.28 0.92 0.42 -1.32 0.00 0.00 175.29 175.74 1ffh s ILE 194 N -3.96 4.80 0.07 3.63 1.01 -1.26 -5.04 121.20 120.45 1ffh s ILE 194 Ca 0.15 1.82 0.06 0.00 0.00 0.00 0.00 60.65 62.68 1ffh s ILE 194 Cb 0.06 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1ffh s ILE 194 CO -0.04 -0.04 -0.17 1.51 0.00 0.00 0.00 174.94 176.20 1ffh s ASP 195 N 1.17 2.05 0.27 3.58 -4.77 -1.26 -5.06 116.67 112.65 1ffh s ASP 195 Ca 0.42 -0.59 -0.01 0.00 -3.30 0.00 0.00 52.55 49.07 1ffh s ASP 195 Cb -0.16 -0.11 0.47 0.00 -1.09 0.00 0.00 42.92 42.03 1ffh s ASP 195 CO 0.12 0.02 1.86 -0.08 0.70 0.00 0.00 175.17 177.78 1ffh h GLU 196 N 4.43 1.06 -0.98 2.11 4.57 -1.99 -2.31 114.58 121.47 1ffh h GLU 196 Ca -0.42 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 57.75 1ffh h GLU 196 Cb 1.18 -0.24 -0.06 0.00 -0.16 0.00 0.00 28.75 29.47 1ffh h GLU 196 CO 0.41 0.70 0.63 -1.35 -1.18 0.00 0.00 179.01 178.23 1ffh h PRO 197 N 1.09 1.15 0.18 0.92 0.11 -1.99 0.52 132.00 133.98 1ffh h PRO 197 Ca 0.46 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.50 1ffh h PRO 197 Cb 0.32 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1ffh h PRO 197 CO -0.22 0.76 -0.09 1.25 -0.21 0.00 0.00 178.00 179.50 1ffh h LEU 198 N 1.19 -0.20 -1.36 2.35 5.85 -1.84 -2.18 115.31 119.12 1ffh h LEU 198 Ca 0.41 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 59.08 1ffh h LEU 198 Cb 0.09 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1ffh h LEU 198 CO -0.15 -0.09 0.37 0.24 -0.34 0.00 0.00 178.44 178.47 1ffh h MET 199 N -0.30 0.80 -0.44 1.25 2.86 -1.16 -1.03 114.93 116.91 1ffh h MET 199 Ca -0.02 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.47 1ffh h MET 199 Cb 0.24 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1ffh h MET 199 CO 0.04 0.56 -0.03 0.78 1.06 0.00 0.00 176.91 179.31 1ffh h GLY 200 N 0.85 0.87 1.19 8.32 0.00 -0.72 -0.29 103.07 113.29 1ffh h GLY 200 Ca 0.22 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.78 1ffh h GLY 200 CO -0.04 0.61 -0.09 -2.09 0.00 0.00 0.00 176.54 174.93 1ffh h GLU 201 N 0.64 0.95 -0.39 4.80 4.81 -0.91 -0.88 114.58 123.60 1ffh h GLU 201 Ca 0.12 -0.33 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 1ffh h GLU 201 Cb 0.54 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1ffh h GLU 201 CO 0.03 0.99 0.06 -0.07 -0.73 0.00 0.00 179.01 179.29 1ffh h LEU 202 N 0.85 0.63 -0.96 1.64 3.38 -1.05 0.84 115.31 120.64 1ffh h LEU 202 Ca 0.14 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1ffh h LEU 202 Cb 0.62 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1ffh h LEU 202 CO 0.04 0.74 0.33 0.00 0.09 0.00 0.00 178.44 179.64 1ffh h ALA 203 N 0.92 1.18 -0.08 1.53 0.00 -0.87 0.14 119.26 122.08 1ffh h ALA 203 Ca 0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1ffh h ALA 203 Cb 0.38 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ffh h ALA 203 CO 0.01 0.61 -0.07 -0.09 0.00 0.00 0.00 179.25 179.71 1ffh h ARG 204 N 1.07 0.19 -0.62 0.00 9.65 -0.90 -2.04 114.38 121.74 1ffh h ARG 204 Ca 0.26 -0.09 0.08 0.00 -1.10 0.00 0.00 59.98 59.12 1ffh h ARG 204 Cb 0.14 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.69 1ffh h ARG 204 CO -0.03 0.60 0.41 1.25 2.80 0.00 0.00 179.97 185.00 1ffh h LEU 205 N -0.21 0.45 -0.31 3.80 5.85 -0.59 -1.09 115.31 123.21 1ffh h LEU 205 Ca 0.02 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 1ffh h LEU 205 Cb 0.55 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1ffh h LEU 205 CO 0.02 0.28 -0.17 0.50 -0.34 0.00 0.00 178.44 178.73 1ffh h LYS 206 N 0.51 0.67 -0.77 1.25 3.64 -0.77 -1.21 116.57 119.88 1ffh h LYS 206 Ca 0.28 -0.30 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1ffh h LYS 206 Cb 0.42 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.19 1ffh h LYS 206 CO -0.08 0.89 0.51 0.93 -2.27 0.00 0.00 179.45 179.42 1ffh h GLU 207 N 0.43 1.02 -0.03 1.90 5.08 -0.50 0.11 114.58 122.59 1ffh h GLU 207 Ca 0.07 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1ffh h GLU 207 Cb 0.70 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1ffh h GLU 207 CO 0.05 0.68 -0.17 0.28 -1.00 0.00 0.00 179.01 178.85 1ffh h VAL 208 N 1.05 1.49 0.00 3.13 2.07 -1.25 -3.34 116.25 119.39 1ffh h VAL 208 Ca 0.28 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 66.06 1ffh h VAL 208 Cb -0.11 2.50 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1ffh h VAL 208 CO -0.06 0.46 -0.44 -0.07 0.02 0.00 0.00 177.57 177.48 1ffh h LEU 209 N -0.42 0.00 -2.58 2.57 3.38 -1.23 -3.49 115.31 113.54 1ffh h LEU 209 Ca -0.01 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.56 1ffh h LEU 209 Cb 0.84 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.68 1ffh h LEU 209 CO 0.04 0.27 -0.89 0.61 0.09 0.00 0.00 178.44 178.55 1ffh n GLY 210 N 1.19 -0.78 3.76 0.83 0.00 0.38 -4.93 105.19 105.64 1ffh n GLY 210 Ca 0.02 0.37 -0.38 0.00 0.00 0.00 0.00 46.02 46.02 1ffh n GLY 210 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ffh s PRO 211 N -5.70 3.33 0.17 1.61 0.04 -1.26 -4.92 135.00 128.27 1ffh s PRO 211 Ca 0.31 2.16 0.06 0.00 0.04 0.00 0.00 61.00 63.57 1ffh s PRO 211 Cb -0.09 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.09 1ffh s PRO 211 CO 0.82 -1.01 1.38 -0.44 0.04 0.00 0.00 177.00 177.79 1ffh h ASP 212 N 1.68 0.09 -4.72 6.66 3.32 -0.92 -3.45 116.42 119.07 1ffh h ASP 212 Ca -0.51 -0.08 -0.23 0.00 0.02 0.00 0.00 57.03 56.23 1ffh h ASP 212 Cb 1.29 -0.03 -0.22 0.00 0.22 0.00 0.00 39.33 40.59 1ffh h ASP 212 CO 0.58 0.93 -0.72 -1.61 -1.72 0.00 0.00 179.24 176.70 1ffh s GLU 213 N -3.06 0.39 -0.30 3.56 0.41 -1.24 -5.03 118.70 113.43 1ffh s GLU 213 Ca -0.01 -0.60 -0.01 0.00 -0.41 0.00 0.00 54.97 53.94 1ffh s GLU 213 Cb 0.11 -0.11 0.10 0.00 -1.78 0.00 0.00 34.13 32.44 1ffh s GLU 213 CO 0.81 0.01 0.09 0.08 -0.49 0.00 0.00 175.26 175.76 1ffh s VAL 214 N -1.23 0.94 -0.28 2.63 1.01 -1.26 -1.47 120.40 120.75 1ffh s VAL 214 Ca -0.11 -1.40 -0.20 0.00 0.00 0.00 0.00 61.98 60.27 1ffh s VAL 214 Cb -0.09 -1.69 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1ffh s VAL 214 CO -0.00 -0.63 0.64 -0.76 0.00 0.00 0.00 175.10 174.34 1ffh s LEU 215 N 1.59 4.10 -0.36 3.92 1.02 0.40 -0.67 118.68 128.67 1ffh s LEU 215 Ca 0.09 0.59 -0.18 0.00 0.02 0.00 0.00 54.13 54.64 1ffh s LEU 215 Cb -0.17 -2.85 0.00 0.00 0.02 0.00 0.00 46.19 43.19 1ffh s LEU 215 CO -0.23 -0.43 0.51 -0.22 0.02 0.00 0.00 176.35 176.00 1ffh s LEU 216 N 2.57 4.41 -0.08 1.79 2.96 -0.31 -0.40 118.68 129.63 1ffh s LEU 216 Ca 0.26 -0.12 -0.21 0.00 -0.22 0.00 0.00 54.13 53.83 1ffh s LEU 216 Cb -0.15 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 1ffh s LEU 216 CO 0.10 -0.51 0.61 -0.69 -1.32 0.00 0.00 176.35 174.54 1ffh s VAL 217 N 2.40 5.08 -0.00 1.68 1.01 0.15 -1.13 120.40 129.58 1ffh s VAL 217 Ca 0.18 1.25 0.03 0.00 0.00 0.00 0.00 61.98 63.45 1ffh s VAL 217 Cb -0.15 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.27 1ffh s VAL 217 CO 0.14 0.30 -0.11 -0.76 0.00 0.00 0.00 175.10 174.67 1ffh s LEU 218 N 0.63 2.04 -0.50 3.92 1.43 0.31 -4.46 118.68 122.04 1ffh s LEU 218 Ca 0.33 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.92 1ffh s LEU 218 Cb -0.17 -0.53 0.03 0.00 0.03 0.00 0.00 46.19 45.55 1ffh s LEU 218 CO 0.15 0.11 1.14 -0.62 0.23 0.00 0.00 176.35 177.37 1ffh s ASP 219 N -0.34 6.59 0.54 2.29 2.15 -1.26 -0.54 116.67 126.10 1ffh s ASP 219 Ca 0.03 0.37 0.27 0.00 0.43 0.00 0.00 52.55 53.66 1ffh s ASP 219 Cb -0.04 -2.55 1.43 0.00 -0.30 0.00 0.00 42.92 41.46 1ffh s ASP 219 CO -0.00 -1.29 1.97 0.00 -0.17 0.00 0.00 175.17 175.68 1ffh h ALA 220 N 9.29 2.51 0.00 3.66 0.00 -1.46 -1.84 119.26 131.43 1ffh h ALA 220 Ca -0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ffh h ALA 220 Cb 1.06 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ffh h ALA 220 CO 1.14 -0.73 0.00 -1.33 0.00 0.00 0.00 179.25 178.33 1ffh n MET 221 N -4.28 0.38 0.00 0.00 2.81 -1.26 -2.16 117.12 112.61 1ffh n MET 221 Ca 0.11 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.11 1ffh n MET 221 Cb 0.67 -1.42 0.02 0.00 -0.71 0.00 0.00 33.22 31.78 1ffh n MET 221 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1ffh n THR 222 N -0.92 0.00 -3.88 2.03 -2.24 -0.69 -5.05 114.28 103.53 1ffh n THR 222 Ca 0.08 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1ffh n THR 222 Cb 0.04 1.29 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1ffh n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffh n GLY 223 N 1.41 3.09 0.36 3.38 0.00 -0.92 -2.69 105.19 109.83 1ffh n GLY 223 Ca 0.10 -0.31 0.18 0.00 0.00 0.00 0.00 46.02 45.99 1ffh n GLY 223 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ffh h GLN 224 N 0.00 0.01 -1.00 1.61 4.20 -1.87 -0.06 115.11 118.00 1ffh h GLN 224 Ca 0.00 -0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 1ffh h GLN 224 Cb 0.00 -0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.69 1ffh h GLN 224 CO 0.00 0.00 0.63 1.49 -0.67 0.00 0.00 178.83 180.28 1ffh h GLU 225 N 0.01 0.95 -0.66 1.46 4.57 -1.90 -0.44 114.58 118.56 1ffh h GLU 225 Ca 0.22 -0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.42 1ffh h GLU 225 Cb 0.86 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 29.19 1ffh h GLU 225 CO -0.00 0.63 0.44 0.00 -1.18 0.00 0.00 179.01 178.89 1ffh h ALA 226 N 1.54 1.85 0.00 2.92 0.00 -1.12 0.32 119.26 124.77 1ffh h ALA 226 Ca 0.50 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1ffh h ALA 226 Cb 0.51 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ffh h ALA 226 CO -0.27 0.03 -0.30 -0.07 0.00 0.00 0.00 179.25 178.63 1ffh h LEU 227 N 0.59 0.00 -0.21 0.00 3.38 -1.20 -0.65 115.31 117.21 1ffh h LEU 227 Ca 0.29 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.15 1ffh h LEU 227 Cb 0.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ffh h LEU 227 CO -0.09 0.18 -0.33 -1.28 0.09 0.00 0.00 178.44 177.00 1ffh h SER 228 N 0.00 0.66 -0.61 -0.43 0.87 -0.38 -1.18 113.55 112.49 1ffh h SER 228 Ca -0.01 -0.52 -0.04 0.00 -1.23 0.00 0.00 61.79 59.99 1ffh h SER 228 Cb 1.14 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.89 1ffh h SER 228 CO 0.02 1.06 0.24 0.58 -0.53 0.00 0.00 176.83 178.19 1ffh h VAL 229 N 0.29 1.23 -0.91 2.23 2.07 -1.13 -1.97 116.25 118.06 1ffh h VAL 229 Ca 0.02 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1ffh h VAL 229 Cb 0.92 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 1ffh h VAL 229 CO 0.08 0.28 0.58 0.00 0.02 0.00 0.00 177.57 178.53 1ffh h ALA 230 N 1.09 1.30 -0.24 1.67 0.00 -0.94 -0.88 119.26 121.27 1ffh h ALA 230 Ca 0.20 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ffh h ALA 230 Cb 0.21 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ffh h ALA 230 CO -0.02 0.62 0.01 -0.09 0.00 0.00 0.00 179.25 179.78 1ffh h ARG 231 N 1.24 0.41 0.15 0.00 9.65 -0.79 -1.75 114.38 123.29 1ffh h ARG 231 Ca 0.33 -0.12 -0.00 0.00 -1.10 0.00 0.00 59.98 59.08 1ffh h ARG 231 Cb -0.10 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.44 1ffh h ARG 231 CO -0.07 0.57 -0.10 0.00 2.80 0.00 0.00 179.97 183.18 1ffh h ALA 232 N 0.82 -0.24 -0.73 2.80 0.00 -0.95 -0.65 119.26 120.31 1ffh h ALA 232 Ca 0.07 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1ffh h ALA 232 Cb 0.38 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1ffh h ALA 232 CO 0.01 -0.64 0.48 0.74 0.00 0.00 0.00 179.25 179.84 1ffh h PHE 233 N -0.25 0.87 -0.27 0.00 0.04 -1.18 -1.05 116.94 115.09 1ffh h PHE 233 Ca -0.01 0.02 -0.16 0.00 2.80 0.00 0.00 57.97 60.62 1ffh h PHE 233 Cb 0.22 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1ffh h PHE 233 CO -0.09 0.51 -0.48 0.22 -0.60 0.00 0.00 178.31 177.87 1ffh h ASP 234 N 0.91 0.80 -0.25 2.17 3.58 -0.92 0.93 116.42 123.64 1ffh h ASP 234 Ca 0.29 -0.40 -0.13 0.00 0.42 0.00 0.00 57.03 57.21 1ffh h ASP 234 Cb 0.02 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.84 1ffh h ASP 234 CO -0.08 1.15 -0.33 -0.08 -2.88 0.00 0.00 179.24 177.02 1ffh h GLU 235 N 0.58 0.66 0.12 0.28 4.81 -0.59 -2.26 114.58 118.18 1ffh h GLU 235 Ca 0.03 -0.38 -0.29 0.00 -0.13 0.00 0.00 59.36 58.58 1ffh h GLU 235 Cb 1.05 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 1ffh h GLU 235 CO 0.10 1.00 -1.40 0.87 -0.73 0.00 0.00 179.01 178.85 1ffh h LYS 236 N 0.37 0.26 0.00 1.92 1.79 -1.24 -3.43 116.57 116.25 1ffh h LYS 236 Ca 0.03 -0.45 -0.04 0.00 -2.18 0.00 0.00 60.65 58.01 1ffh h LYS 236 Cb 0.92 0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.73 1ffh h LYS 236 CO 0.08 1.16 -1.13 0.28 -1.08 0.00 0.00 179.45 178.76 1ffh n VAL 237 N -3.49 0.13 -0.04 0.50 0.31 0.15 -4.65 118.33 111.24 1ffh n VAL 237 Ca -0.13 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1ffh n VAL 237 Cb 1.04 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.61 1ffh n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ffh n GLY 238 N 2.95 0.69 3.70 2.92 0.00 -0.19 -4.95 105.19 110.31 1ffh n GLY 238 Ca -0.04 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 1ffh n GLY 238 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ffh s VAL 239 N 0.00 3.84 -0.04 1.61 -7.23 -1.26 -4.79 120.40 112.52 1ffh s VAL 239 Ca 0.00 -1.58 0.06 0.00 -1.81 0.00 0.00 61.98 58.65 1ffh s VAL 239 Cb 0.00 -3.01 -0.09 0.00 0.56 0.00 0.00 36.38 33.83 1ffh s VAL 239 CO 0.00 -0.27 0.08 0.35 -0.31 0.00 0.00 175.10 174.95 1ffh n THR 240 N -0.68 0.26 -3.80 5.32 -2.24 0.16 -4.91 114.28 108.38 1ffh n THR 240 Ca -0.08 -0.23 -0.07 0.00 -2.27 0.00 0.00 64.05 61.40 1ffh n THR 240 Cb 0.57 -0.33 -0.02 0.00 -2.10 0.00 0.00 70.33 68.46 1ffh n THR 240 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ffh s GLY 241 N -3.38 -0.16 0.23 3.38 0.00 -1.15 -4.40 107.32 101.84 1ffh s GLY 241 Ca -0.03 -0.19 0.10 0.00 0.00 0.00 0.00 44.72 44.60 1ffh s GLY 241 CO 0.28 -0.05 -0.18 1.08 0.00 0.00 0.00 173.10 174.23 1ffh s LEU 242 N -2.90 2.54 -0.09 0.66 1.43 0.11 -1.16 118.68 119.27 1ffh s LEU 242 Ca 0.10 -0.99 -0.01 0.00 -1.03 0.00 0.00 54.13 52.20 1ffh s LEU 242 Cb -0.05 -0.90 0.03 0.00 0.03 0.00 0.00 46.19 45.30 1ffh s LEU 242 CO 0.04 -0.05 -0.00 -0.69 0.23 0.00 0.00 176.35 175.88 1ffh s VAL 243 N -2.55 0.47 -0.28 -1.59 1.01 -0.29 -0.97 120.40 116.21 1ffh s VAL 243 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 1ffh s VAL 243 Cb -0.04 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 1ffh s VAL 243 CO 0.10 0.23 0.16 -0.76 0.00 0.00 0.00 175.10 174.83 1ffh s LEU 244 N 1.93 3.92 0.39 3.92 1.43 -0.85 -0.53 118.68 128.90 1ffh s LEU 244 Ca 0.04 -0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.12 1ffh s LEU 244 Cb -0.13 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.02 1ffh s LEU 244 CO -0.06 -0.06 0.52 0.42 0.23 0.00 0.00 176.35 177.39 1ffh s THR 245 N 1.72 3.34 -1.48 5.49 -4.23 0.30 0.53 115.64 121.31 1ffh s THR 245 Ca 0.07 -1.03 -0.11 0.00 -1.18 0.00 0.00 61.69 59.43 1ffh s THR 245 Cb -0.16 -3.14 0.06 0.00 1.34 0.00 0.00 72.50 70.61 1ffh s THR 245 CO 0.09 -0.06 0.99 0.29 -0.54 0.00 0.00 174.62 175.39 1ffh n LYS 246 N -1.75 -5.89 0.14 3.99 5.02 -1.16 -1.30 118.16 117.21 1ffh n LYS 246 Ca 0.05 0.64 0.01 0.00 -2.02 0.00 0.00 58.31 56.99 1ffh n LYS 246 Cb 0.59 -5.53 0.31 0.00 -0.02 0.00 0.00 35.03 30.38 1ffh n LYS 246 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ffh h LEU 247 N -2.17 0.11 -1.39 -0.35 3.38 -1.80 -2.82 115.31 110.28 1ffh h LEU 247 Ca -0.58 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.29 1ffh h LEU 247 Cb 1.37 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 1ffh h LEU 247 CO 0.64 0.47 -0.26 0.44 0.09 0.00 0.00 178.44 179.82 1ffh h ASP 248 N 0.10 0.00 1.49 -0.43 3.32 -1.90 -2.65 116.42 116.34 1ffh h ASP 248 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ffh h ASP 248 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 1ffh h ASP 248 CO 0.05 0.26 -0.36 1.23 -1.72 0.00 0.00 179.24 178.71 1ffh h GLY 249 N 1.37 0.00 -7.27 2.75 0.00 -1.89 -3.44 103.07 94.59 1ffh h GLY 249 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 1ffh h GLY 249 CO 0.03 0.00 1.00 -0.35 0.00 0.00 0.00 176.54 177.23 1ffh s ASP 250 N -5.45 6.22 0.00 0.19 2.15 -1.00 -4.84 116.67 113.94 1ffh s ASP 250 Ca 0.05 -0.37 0.30 0.00 0.43 0.00 0.00 52.55 52.96 1ffh s ASP 250 Cb 0.08 -2.55 1.51 0.00 -0.30 0.00 0.00 42.92 41.66 1ffh s ASP 250 CO 0.70 -1.73 2.03 0.00 -0.17 0.00 0.00 175.17 176.00 1ffh n ALA 251 N 9.05 2.59 -0.94 3.66 0.00 -1.26 -4.16 120.51 129.45 1ffh n ALA 251 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1ffh n ALA 251 Cb 0.49 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1ffh n ALA 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ffh n ARG 252 N -1.14 0.00 0.00 0.00 1.74 -1.26 -1.73 116.66 114.26 1ffh n ARG 252 Ca 0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1ffh n ARG 252 Cb 0.23 -0.04 0.00 0.00 -1.02 0.00 0.00 32.46 31.63 1ffh n ARG 252 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ffh n GLY 253 N 2.44 0.92 0.32 -0.13 0.00 -1.25 -4.49 105.19 103.01 1ffh n GLY 253 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1ffh n GLY 253 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ffh h GLY 254 N 0.00 1.51 0.62 -0.02 0.00 -1.15 -1.19 103.07 102.84 1ffh h GLY 254 Ca 0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1ffh h GLY 254 CO 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 176.54 176.37 1ffh h ALA 255 N 1.64 -0.05 -0.89 3.60 0.00 -1.79 -1.76 119.26 120.02 1ffh h ALA 255 Ca 0.52 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1ffh h ALA 255 Cb 0.88 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1ffh h ALA 255 CO -0.44 -0.33 0.58 0.00 0.00 0.00 0.00 179.25 179.06 1ffh h ALA 256 N 0.51 1.13 0.00 0.00 0.00 -1.83 -1.07 119.26 118.01 1ffh h ALA 256 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1ffh h ALA 256 Cb 0.40 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ffh h ALA 256 CO 0.01 0.55 -0.16 -0.07 0.00 0.00 0.00 179.25 179.58 1ffh h LEU 257 N 1.22 0.00 0.00 0.00 3.38 -1.22 -3.29 115.31 115.39 1ffh h LEU 257 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1ffh h LEU 257 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1ffh h LEU 257 CO -0.07 0.16 -1.39 -1.20 0.09 0.00 0.00 178.44 176.03 1ffh n SER 258 N -3.23 0.67 -0.01 -0.43 7.64 -0.66 -4.59 113.62 113.01 1ffh n SER 258 Ca 0.01 -0.52 -0.12 0.00 1.01 0.00 0.00 58.87 59.25 1ffh n SER 258 Cb 0.46 1.43 -0.06 0.00 -1.01 0.00 0.00 64.21 65.03 1ffh n SER 258 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ffh h ALA 259 N 2.36 -0.54 -0.12 -0.43 0.00 -1.28 -0.03 119.26 119.23 1ffh h ALA 259 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ffh h ALA 259 Cb 0.68 0.76 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1ffh h ALA 259 CO 0.00 -0.90 -0.07 -0.09 0.00 0.00 0.00 179.25 178.19 1ffh h ARG 260 N -0.47 -0.06 0.52 0.00 2.43 -1.75 0.87 114.38 115.92 1ffh h ARG 260 Ca 0.08 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1ffh h ARG 260 Cb 0.61 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1ffh h ARG 260 CO -0.40 -0.04 -0.25 1.25 -1.51 0.00 0.00 179.97 179.02 1ffh h HIS 261 N -0.06 -0.65 -0.12 2.20 2.76 -1.79 -0.37 115.15 117.11 1ffh h HIS 261 Ca 0.07 -0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.12 1ffh h HIS 261 Cb 0.17 0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.34 1ffh h HIS 261 CO -0.19 -0.39 -0.34 0.28 -1.30 0.00 0.00 177.93 175.99 1ffh h VAL 262 N -0.73 1.38 0.00 5.26 2.07 -0.95 -3.38 116.25 119.90 1ffh h VAL 262 Ca -0.07 -1.65 -0.26 0.00 0.82 0.00 0.00 66.70 65.54 1ffh h VAL 262 Cb 0.55 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.39 1ffh h VAL 262 CO 0.12 0.49 -2.26 0.35 0.02 0.00 0.00 177.57 176.28 1ffh n THR 263 N -4.37 0.97 -1.05 2.57 -2.24 0.29 -4.99 114.28 105.46 1ffh n THR 263 Ca -0.07 -0.75 -0.02 0.00 -2.27 0.00 0.00 64.05 60.94 1ffh n THR 263 Cb 0.50 -0.33 -0.01 0.00 -2.10 0.00 0.00 70.33 68.40 1ffh n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffh n GLY 264 N 1.60 0.48 3.67 3.38 0.00 -0.15 -5.01 105.19 109.16 1ffh n GLY 264 Ca -0.24 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 1ffh n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffh s LYS 265 N -1.09 3.42 0.44 1.61 -0.14 -1.26 -5.01 119.74 117.71 1ffh s LYS 265 Ca 0.00 -0.37 -0.22 0.00 -1.36 0.00 0.00 55.97 54.02 1ffh s LYS 265 Cb 0.00 -2.98 -0.09 0.00 -1.68 0.00 0.00 37.83 33.08 1ffh s LYS 265 CO 0.00 0.53 1.02 -1.25 -0.76 0.00 0.00 175.35 174.89 1ffh s PRO 266 N -0.38 4.05 -0.45 -1.68 0.04 -1.26 -4.31 135.00 131.01 1ffh s PRO 266 Ca 0.08 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.31 1ffh s PRO 266 Cb -0.12 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 32.15 1ffh s PRO 266 CO 0.02 -0.22 0.48 0.42 0.04 0.00 0.00 177.00 177.74 1ffh s ILE 267 N -1.88 5.05 -0.08 0.56 1.01 -1.26 -0.71 121.20 123.88 1ffh s ILE 267 Ca 0.62 -0.46 -0.25 0.00 0.00 0.00 0.00 60.65 60.56 1ffh s ILE 267 Cb -0.17 -4.12 -0.26 0.00 0.01 0.00 0.00 42.46 37.92 1ffh s ILE 267 CO 0.21 -0.54 0.91 1.88 0.00 0.00 0.00 174.94 177.40 1ffh h TYR 268 N 8.80 0.25 -3.52 3.97 0.05 -1.29 -3.41 116.97 121.82 1ffh h TYR 268 Ca -0.27 -0.16 -0.36 0.00 0.05 0.00 0.00 58.73 57.99 1ffh h TYR 268 Cb 1.11 -0.02 -0.17 0.00 1.01 0.00 0.00 36.73 38.66 1ffh h TYR 268 CO 0.66 1.06 -0.73 -0.06 -1.05 0.00 0.00 178.16 178.03 1ffh s PHE 269 N -2.64 1.27 -0.01 4.88 0.40 -1.23 -0.93 117.98 119.72 1ffh s PHE 269 Ca -0.16 -0.66 0.08 0.00 -0.60 0.00 0.00 56.93 55.59 1ffh s PHE 269 Cb -0.00 -0.66 -0.02 0.00 0.51 0.00 0.00 43.02 42.85 1ffh s PHE 269 CO 0.75 0.09 -0.24 0.00 0.70 0.00 0.00 175.22 176.52 1ffh s ALA 270 N -2.69 2.03 -0.34 5.36 0.00 -0.63 -2.00 121.76 123.49 1ffh s ALA 270 Ca 0.11 -1.07 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 1ffh s ALA 270 Cb -0.01 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 1ffh s ALA 270 CO 0.01 0.50 0.52 0.20 0.00 0.00 0.00 175.76 176.99 1ffh s GLY 271 N -0.64 1.82 -0.04 0.00 0.00 0.19 -2.17 107.32 106.47 1ffh s GLY 271 Ca 0.10 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.88 1ffh s GLY 271 CO -0.01 1.27 -0.08 -2.27 0.00 0.00 0.00 173.10 172.02 1ffh s LEU 279 N 2.39 1.60 0.23 0.66 0.20 -1.26 -2.99 118.68 119.52 1ffh s LEU 279 Ca 0.19 -0.18 -0.17 0.00 0.69 0.00 0.00 54.13 54.67 1ffh s LEU 279 Cb -0.15 -0.54 0.01 0.00 -0.43 0.00 0.00 46.19 45.07 1ffh s LEU 279 CO 0.13 0.02 0.55 -1.83 -0.29 0.00 0.00 176.35 174.93 1ffh s GLU 280 N 0.53 1.54 0.76 1.98 -1.05 -0.92 -5.06 118.70 116.47 1ffh s GLU 280 Ca -0.08 -1.04 -0.15 0.00 -0.15 0.00 0.00 54.97 53.54 1ffh s GLU 280 Cb -0.12 0.52 0.01 0.00 -0.44 0.00 0.00 34.13 34.11 1ffh s GLU 280 CO 0.01 -0.66 0.88 -2.30 0.95 0.00 0.00 175.26 174.13 1ffh n PRO 281 N -0.38 0.34 -3.14 -4.83 -0.02 -1.26 -1.61 135.00 124.09 1ffh n PRO 281 Ca -0.05 0.17 -0.39 0.00 -2.02 0.00 0.00 63.50 61.20 1ffh n PRO 281 Cb 0.61 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.89 1ffh n PRO 281 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1ffh s PHE 282 N -1.94 3.48 -0.42 6.00 5.36 -0.11 -4.50 117.98 125.84 1ffh s PHE 282 Ca 0.70 1.03 0.01 0.00 -0.96 0.00 0.00 56.93 57.71 1ffh s PHE 282 Cb -0.33 -2.74 0.11 0.00 -0.34 0.00 0.00 43.02 39.73 1ffh s PHE 282 CO 0.53 -0.00 0.17 0.71 -1.46 0.00 0.00 175.22 175.17 1ffh s TYR 283 N 1.23 3.59 0.15 10.12 2.02 -1.26 -4.35 117.35 128.85 1ffh s TYR 283 Ca 0.31 -2.82 -0.19 0.00 -0.37 0.00 0.00 57.07 54.00 1ffh s TYR 283 Cb -0.16 -3.03 0.04 0.00 -0.40 0.00 0.00 41.96 38.40 1ffh s TYR 283 CO 0.13 -0.91 1.67 -1.35 -1.57 0.00 0.00 175.55 173.51 1ffh h PRO 284 N 7.52 -0.07 -0.78 -1.71 0.11 -1.86 -1.70 132.00 133.51 1ffh h PRO 284 Ca -0.07 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.07 1ffh h PRO 284 Cb 1.00 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 1ffh h PRO 284 CO 0.62 -0.05 0.50 1.49 -0.21 0.00 0.00 178.00 180.36 1ffh h GLU 285 N -0.07 0.97 -0.48 1.05 4.81 -1.85 -0.82 114.58 118.19 1ffh h GLU 285 Ca 0.15 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1ffh h GLU 285 Cb 0.29 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1ffh h GLU 285 CO -0.33 0.64 0.05 -0.09 -0.73 0.00 0.00 179.01 178.54 1ffh h ARG 286 N 1.00 0.81 -0.22 1.92 2.43 -1.86 -2.72 114.38 115.74 1ffh h ARG 286 Ca 0.30 -0.23 -0.12 0.00 -0.81 0.00 0.00 59.98 59.12 1ffh h ARG 286 Cb -0.03 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1ffh h ARG 286 CO -0.09 0.83 -0.39 1.25 -1.51 0.00 0.00 179.97 180.06 1ffh h LEU 287 N 0.67 0.53 -1.11 3.80 5.85 -1.01 -2.33 115.31 121.71 1ffh h LEU 287 Ca 0.14 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1ffh h LEU 287 Cb 0.44 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1ffh h LEU 287 CO 0.02 0.86 0.29 0.00 -0.34 0.00 0.00 178.44 179.27 1ffh h ALA 288 N 1.16 1.31 -0.22 1.25 0.00 -1.03 -0.91 119.26 120.82 1ffh h ALA 288 Ca 0.04 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1ffh h ALA 288 Cb 0.86 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ffh h ALA 288 CO 0.07 0.53 -0.13 0.78 0.00 0.00 0.00 179.25 180.50 1ffh h GLY 289 N 1.00 0.52 1.26 0.00 0.00 -1.29 -2.92 103.07 101.62 1ffh h GLY 289 Ca 0.22 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1ffh h GLY 289 CO -0.03 0.44 0.43 3.21 0.00 0.00 0.00 176.54 180.59 1ffh h ARG 290 N 0.18 0.98 -0.62 4.80 3.08 -1.05 -0.05 114.38 121.70 1ffh h ARG 290 Ca 0.05 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1ffh h ARG 290 Cb 0.65 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1ffh h ARG 290 CO 0.04 0.70 0.32 0.82 -1.07 0.00 0.00 179.97 180.77 1ffh h ILE 291 N 1.00 1.20 -0.35 2.04 2.04 -1.12 -2.22 117.51 120.10 1ffh h ILE 291 Ca 0.26 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1ffh h ILE 291 Cb -0.03 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 1ffh h ILE 291 CO -0.05 0.22 0.00 0.18 0.00 0.00 0.00 178.15 178.50 1ffh n LEU 292 N -4.37 2.00 -0.13 1.44 4.77 -0.79 -4.33 117.00 115.59 1ffh n LEU 292 Ca 0.06 -1.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 1ffh n LEU 292 Cb 0.11 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1ffh n LEU 292 CO 0.38 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 1ffh n GLY 293 N 1.00 0.58 2.51 -0.72 0.00 -0.84 -4.95 105.19 102.77 1ffh n GLY 293 Ca 0.12 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 45.16 1ffh n GLY 293 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1ffh n MET 294 N -0.86 0.45 0.00 1.61 0.00 -0.10 -5.00 117.12 113.22 1ffh n MET 294 Ca 0.00 -2.67 0.00 0.00 0.00 0.00 0.00 57.70 55.03 1ffh n MET 294 Cb 0.48 -1.51 0.00 0.00 0.00 0.00 0.00 33.22 32.19 1ffh n MET 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38