#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxo h GLN 3 N 0.00 0.85 0.00 -2.82 -0.00 -2.01 0.23 115.11 111.35 3dxo h GLN 3 Ca 0.00 -0.05 -0.12 0.00 -0.00 0.00 0.00 58.65 58.48 3dxo h GLN 3 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.27 3dxo h GLN 3 CO 0.00 0.56 -0.56 0.45 0.00 0.00 0.00 178.83 179.28 3dxo h HIS 4 N 0.87 0.00 -0.06 3.99 3.86 -1.93 -2.43 115.15 119.45 3dxo h HIS 4 Ca 0.49 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.61 3dxo h HIS 4 Cb 0.60 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.08 3dxo h HIS 4 CO -0.00 0.56 -0.31 1.25 0.86 0.00 0.00 177.93 180.29 3dxo h LEU 5 N 0.00 0.37 -0.64 2.43 5.85 -1.58 -2.39 115.31 119.36 3dxo h LEU 5 Ca -0.01 -0.66 0.07 0.00 0.84 0.00 0.00 57.88 58.13 3dxo h LEU 5 Cb 1.12 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 3dxo h LEU 5 CO 0.07 0.97 0.33 0.74 -0.34 0.00 0.00 178.44 180.21 3dxo h THR 6 N -0.19 0.92 -0.39 1.05 2.02 -0.99 0.21 112.91 115.54 3dxo h THR 6 Ca -0.02 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 3dxo h THR 6 Cb 0.96 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3dxo h THR 6 CO 0.06 0.11 0.15 0.40 0.37 0.00 0.00 175.52 176.62 3dxo h ILE 7 N 0.61 1.19 -0.48 3.11 2.04 -1.45 0.20 117.51 122.73 3dxo h ILE 7 Ca 0.30 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 3dxo h ILE 7 Cb 0.23 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3dxo h ILE 7 CO -0.21 0.22 0.28 0.00 0.00 0.00 0.00 178.15 178.44 3dxo h ALA 8 N 1.00 0.61 -0.48 1.87 0.00 -0.82 -0.05 119.26 121.40 3dxo h ALA 8 Ca 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3dxo h ALA 8 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3dxo h ALA 8 CO -0.01 0.11 0.12 1.96 0.00 0.00 0.00 179.25 181.43 3dxo h GLN 9 N 0.64 0.77 -0.71 0.00 4.20 -0.25 -0.61 115.11 119.14 3dxo h GLN 9 Ca 0.17 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3dxo h GLN 9 Cb 0.01 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 3dxo h GLN 9 CO -0.03 0.75 0.29 1.15 -0.67 0.00 0.00 178.83 180.32 3dxo h THR 10 N 0.65 1.25 0.36 -0.54 2.02 -0.38 -0.63 112.91 115.64 3dxo h THR 10 Ca 0.15 -0.77 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 3dxo h THR 10 Cb 0.33 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 3dxo h THR 10 CO 0.00 0.31 -0.17 0.22 0.37 0.00 0.00 175.52 176.25 3dxo h TYR 11 N 1.02 -0.45 -0.13 3.16 5.03 -0.72 -2.99 116.97 121.89 3dxo h TYR 11 Ca 0.24 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.49 3dxo h TYR 11 Cb 0.21 0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.62 3dxo h TYR 11 CO 0.02 -0.22 -0.15 -0.07 -1.32 0.00 0.00 178.16 176.42 3dxo h LEU 12 N -0.59 0.19 -1.03 2.82 3.38 -1.02 -2.51 115.31 116.55 3dxo h LEU 12 Ca -0.05 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.93 3dxo h LEU 12 Cb 0.43 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 3dxo h LEU 12 CO 0.08 0.37 0.64 0.00 0.09 0.00 0.00 178.44 179.62 3dxo h ALA 13 N 1.66 1.39 -0.41 1.53 0.00 -1.03 0.10 119.26 122.50 3dxo h ALA 13 Ca 0.04 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3dxo h ALA 13 Cb 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3dxo h ALA 13 CO 0.02 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.76 3dxo h ALA 14 N 1.45 0.55 0.00 0.00 0.00 -1.31 -1.73 119.26 118.22 3dxo h ALA 14 Ca 0.41 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3dxo h ALA 14 Cb 0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3dxo h ALA 14 CO -0.15 0.33 -0.28 -1.49 0.00 0.00 0.00 179.25 177.66 3dxo h TRP 15 N 0.55 0.00 -0.02 0.00 4.06 -1.17 -3.08 115.95 116.29 3dxo h TRP 15 Ca 0.11 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.06 3dxo h TRP 15 Cb 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.64 3dxo h TRP 15 CO 0.04 0.28 -0.22 0.09 -3.56 0.00 0.00 178.44 175.07 3dxo n ASN 16 N -3.61 1.88 -4.67 -3.49 3.02 -0.07 -4.90 115.26 103.41 3dxo n ASN 16 Ca -0.01 -1.46 -0.42 0.00 -0.03 0.00 0.00 54.58 52.66 3dxo n ASN 16 Cb 0.41 0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.75 3dxo n ASN 16 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3dxo s GLU 17 N -2.29 4.25 0.11 3.52 2.56 -0.66 -4.92 118.70 121.26 3dxo s GLU 17 Ca 0.26 1.93 -0.14 0.00 0.00 0.00 0.00 54.97 57.02 3dxo s GLU 17 Cb 0.19 -3.73 -0.07 0.00 2.00 0.00 0.00 34.13 32.52 3dxo s GLU 17 CO 0.45 -0.67 1.44 1.49 -0.56 0.00 0.00 175.26 177.41 3dxo h GLU 18 N 8.35 0.78 -5.98 4.30 4.22 -1.90 -3.44 114.58 120.90 3dxo h GLU 18 Ca -0.35 -0.41 -0.56 0.00 0.08 0.00 0.00 59.36 58.12 3dxo h GLU 18 Cb 1.16 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.36 3dxo h GLU 18 CO 0.93 1.03 0.06 0.34 -2.18 0.00 0.00 179.01 179.20 3dxo s ASP 19 N -6.63 6.94 0.21 1.04 2.15 -1.26 -4.97 116.67 114.15 3dxo s ASP 19 Ca -0.12 1.13 -0.08 0.00 0.43 0.00 0.00 52.55 53.91 3dxo s ASP 19 Cb 0.09 -2.39 0.14 0.00 -0.30 0.00 0.00 42.92 40.46 3dxo s ASP 19 CO 0.84 -0.11 1.76 -1.13 -0.17 0.00 0.00 175.17 176.36 3dxo h ASN 20 N 6.78 1.10 -0.09 -0.34 -0.00 -2.00 -2.44 115.58 118.59 3dxo h ASN 20 Ca -0.41 -0.20 -0.01 0.00 -0.00 0.00 0.00 56.30 55.69 3dxo h ASN 20 Cb 1.19 -0.29 -0.00 0.00 -0.00 0.00 0.00 38.32 39.22 3dxo h ASN 20 CO 0.76 1.00 0.03 -0.33 -0.00 0.00 0.00 177.43 178.89 3dxo h GLU 21 N 1.14 0.14 -0.69 6.67 4.39 -1.99 -1.94 114.58 122.29 3dxo h GLU 21 Ca 0.25 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.98 3dxo h GLU 21 Cb 0.27 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 3dxo h GLU 21 CO -0.01 0.28 0.46 0.00 -1.16 0.00 0.00 179.01 178.57 3dxo h ARG 22 N -0.03 0.72 -0.52 2.33 3.08 -1.97 -1.92 114.38 116.08 3dxo h ARG 22 Ca 0.03 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 3dxo h ARG 22 Cb 0.19 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3dxo h ARG 22 CO -0.00 0.48 -0.00 -0.09 -1.07 0.00 0.00 179.97 179.28 3dxo h ARG 23 N 0.74 0.88 -0.48 0.04 2.43 -1.09 -0.34 114.38 116.56 3dxo h ARG 23 Ca 0.29 -0.25 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3dxo h ARG 23 Cb 0.22 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3dxo h ARG 23 CO -0.09 0.88 0.31 0.00 -1.51 0.00 0.00 179.97 179.55 3dxo h ARG 24 N 0.81 0.60 -0.29 0.20 3.08 -0.58 -0.17 114.38 118.05 3dxo h ARG 24 Ca 0.15 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 3dxo h ARG 24 Cb 0.49 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 3dxo h ARG 24 CO 0.02 0.40 -0.14 0.45 -1.07 0.00 0.00 179.97 179.63 3dxo h HIS 25 N 0.62 0.53 -0.17 3.04 3.86 -1.17 0.44 115.15 122.30 3dxo h HIS 25 Ca 0.18 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 3dxo h HIS 25 Cb -0.05 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 3dxo h HIS 25 CO -0.05 0.62 0.01 -0.07 0.86 0.00 0.00 177.93 179.30 3dxo h LEU 26 N 0.45 0.28 -0.56 2.43 3.38 -0.41 -1.74 115.31 119.15 3dxo h LEU 26 Ca 0.08 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 3dxo h LEU 26 Cb 0.52 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3dxo h LEU 26 CO 0.03 0.51 0.24 0.58 0.09 0.00 0.00 178.44 179.90 3dxo h VAL 27 N 0.05 1.21 -0.65 1.22 2.07 -0.84 -0.77 116.25 118.54 3dxo h VAL 27 Ca 0.05 -0.64 0.13 0.00 0.82 0.00 0.00 66.70 67.06 3dxo h VAL 27 Cb 0.36 0.60 -0.10 0.00 -1.52 0.00 0.00 31.29 30.63 3dxo h VAL 27 CO 0.01 0.25 0.11 1.23 0.02 0.00 0.00 177.57 179.18 3dxo h GLY 28 N 0.76 0.82 0.35 2.17 0.00 0.01 0.20 103.07 107.37 3dxo h GLY 28 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 3dxo h GLY 28 CO -0.02 -0.17 -0.04 1.46 0.00 0.00 0.00 176.54 177.77 3dxo h GLN 29 N 0.22 -0.10 0.09 4.80 1.08 -0.79 -3.37 115.11 117.04 3dxo h GLN 29 Ca 0.35 0.01 -0.28 0.00 -1.45 0.00 0.00 58.65 57.28 3dxo h GLN 29 Cb 0.57 0.02 0.02 0.00 -0.05 0.00 0.00 27.48 28.04 3dxo h GLN 29 CO -0.48 0.44 -1.17 0.00 -0.95 0.00 0.00 178.83 176.67 3dxo h ALA 30 N 0.02 0.11 -2.49 3.87 0.00 -1.06 -3.47 119.26 116.23 3dxo h ALA 30 Ca -0.01 -0.78 -0.53 0.00 0.00 0.00 0.00 54.91 53.59 3dxo h ALA 30 Cb 0.59 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3dxo h ALA 30 CO 0.02 0.77 -0.07 -1.58 0.00 0.00 0.00 179.25 178.39 3dxo s TRP 31 N -3.00 3.44 0.63 0.00 0.51 0.68 -0.22 118.94 120.97 3dxo s TRP 31 Ca -0.07 0.96 -0.11 0.00 -2.12 0.00 0.00 56.10 54.76 3dxo s TRP 31 Cb 0.07 -2.32 -0.03 0.00 -0.81 0.00 0.00 33.47 30.37 3dxo s TRP 31 CO 0.91 0.26 1.03 0.00 -0.51 0.00 0.00 176.95 178.64 3dxo s ALA 32 N -1.80 3.08 0.08 0.98 0.00 0.18 -4.71 121.76 119.56 3dxo s ALA 32 Ca 0.47 -0.16 -0.19 0.00 0.00 0.00 0.00 51.96 52.09 3dxo s ALA 32 Cb -0.11 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 3dxo s ALA 32 CO 0.20 -0.76 1.49 0.93 0.00 0.00 0.00 175.76 177.63 3dxo h GLU 33 N -0.36 0.44 -4.83 0.00 5.08 -1.95 -3.30 114.58 109.66 3dxo h GLU 33 Ca -0.44 -0.15 -0.71 0.00 -1.00 0.00 0.00 59.36 57.05 3dxo h GLU 33 Cb 1.20 -0.03 -0.19 0.00 0.50 0.00 0.00 28.75 30.23 3dxo h GLU 33 CO 0.62 0.64 0.79 -0.80 -1.00 0.00 0.00 179.01 179.27 3dxo s ASN 34 N -5.99 6.70 0.09 1.42 -0.87 -1.26 -4.26 114.94 110.78 3dxo s ASN 34 Ca -0.14 -2.25 0.02 0.00 -1.57 0.00 0.00 52.86 48.93 3dxo s ASN 34 Cb 0.07 -2.37 -0.04 0.00 -0.02 0.00 0.00 41.25 38.89 3dxo s ASN 34 CO 0.75 -0.96 -0.08 0.28 -2.57 0.00 0.00 177.10 174.53 3dxo s THR 35 N 2.19 0.76 -0.09 1.60 -1.32 -1.24 -4.69 115.64 112.85 3dxo s THR 35 Ca 0.32 -1.74 -0.08 0.00 -1.21 0.00 0.00 61.69 58.97 3dxo s THR 35 Cb -0.05 -1.45 0.02 0.00 -1.51 0.00 0.00 72.50 69.51 3dxo s THR 35 CO -0.08 -0.71 0.24 -0.60 -2.21 0.00 0.00 174.62 171.26 3dxo s ARG 36 N -3.23 0.28 -0.00 7.08 6.06 -0.95 -1.81 118.95 126.38 3dxo s ARG 36 Ca 0.07 0.35 0.04 0.00 -2.50 0.00 0.00 55.73 53.69 3dxo s ARG 36 Cb 0.01 0.12 -0.01 0.00 0.06 0.00 0.00 34.95 35.13 3dxo s ARG 36 CO -0.02 -0.04 -0.11 -0.47 -2.50 0.00 0.00 175.30 172.15 3dxo s TYR 37 N 0.19 1.02 -0.20 5.12 6.14 -0.44 -0.97 117.35 128.21 3dxo s TYR 37 Ca -0.00 -0.21 -0.12 0.00 0.64 0.00 0.00 57.07 57.37 3dxo s TYR 37 Cb -0.02 -0.65 0.06 0.00 0.42 0.00 0.00 41.96 41.77 3dxo s TYR 37 CO -0.00 -0.01 0.50 0.54 0.64 0.00 0.00 175.55 177.22 3dxo s VAL 38 N -0.34 -0.01 0.13 3.14 0.11 -0.78 -1.56 120.40 121.08 3dxo s VAL 38 Ca 0.04 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 3dxo s VAL 38 Cb -0.05 -0.73 -0.01 0.00 -1.53 0.00 0.00 36.38 34.07 3dxo s VAL 38 CO -0.00 0.02 0.07 -0.90 -3.33 0.00 0.00 175.10 170.96 3dxo n ASP 39 N 4.04 0.48 0.16 3.54 5.68 -1.26 -1.04 116.55 128.15 3dxo n ASP 39 Ca -0.21 -1.76 0.13 0.00 -0.50 0.00 0.00 54.79 52.46 3dxo n ASP 39 Cb 0.56 0.45 0.54 0.00 -1.14 0.00 0.00 41.12 41.54 3dxo n ASP 39 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 3dxo h PRO 40 N 0.00 0.00 -0.01 0.11 0.11 -1.95 -3.44 132.00 126.82 3dxo h PRO 40 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 3dxo h PRO 40 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.53 3dxo h PRO 40 CO 0.15 0.00 -0.06 1.28 -0.21 0.00 0.00 178.00 179.16 3dxo n LEU 41 N -2.40 1.48 -3.58 2.35 4.77 -1.26 -5.17 117.00 113.19 3dxo n LEU 41 Ca 0.02 -0.92 -0.06 0.00 -0.03 0.00 0.00 56.01 55.02 3dxo n LEU 41 Cb 0.23 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 3dxo n LEU 41 CO 0.21 0.30 0.92 0.00 -1.33 0.00 0.00 177.39 177.49 3dxo s GLN 43 N -0.87 0.43 0.08 3.23 -2.07 -1.26 -5.21 119.66 113.98 3dxo s GLN 43 Ca 0.09 -0.11 -0.26 0.00 -1.82 0.00 0.00 55.36 53.26 3dxo s GLN 43 Cb 0.07 0.20 0.08 0.00 -1.09 0.00 0.00 33.01 32.27 3dxo s GLN 43 CO 0.14 -0.18 0.80 0.20 -1.32 0.00 0.00 175.29 174.94 3dxo s GLY 44 N -1.99 -0.46 -0.06 2.60 0.00 -0.60 -4.97 107.32 101.83 3dxo s GLY 44 Ca 0.07 0.67 -0.09 0.00 0.00 0.00 0.00 44.72 45.37 3dxo s GLY 44 CO -0.05 0.22 0.23 -1.83 0.00 0.00 0.00 173.10 171.67 3dxo s GLU 45 N -3.37 0.37 0.00 2.90 -1.05 -1.26 -1.33 118.70 114.97 3dxo s GLU 45 Ca 0.05 0.13 0.00 0.00 -0.15 0.00 0.00 54.97 55.00 3dxo s GLU 45 Cb -0.01 0.17 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 3dxo s GLU 45 CO -0.08 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.47 3dxo n GLY 46 N 2.44 -0.52 0.13 -3.83 0.00 -0.75 -3.74 105.19 98.92 3dxo n GLY 46 Ca -0.16 -1.63 -0.08 0.00 0.00 0.00 0.00 46.02 44.15 3dxo n GLY 46 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3dxo h GLN 47 N 0.00 0.28 0.53 1.61 4.20 -1.75 -1.70 115.11 118.27 3dxo h GLN 47 Ca 0.00 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3dxo h GLN 47 Cb 0.00 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3dxo h GLN 47 CO 0.00 0.19 -0.47 1.96 -0.67 0.00 0.00 178.83 179.83 3dxo h GLN 48 N 0.29 -0.96 -0.78 1.46 1.08 -1.96 -1.24 115.11 113.00 3dxo h GLN 48 Ca 0.11 0.07 0.12 0.00 -1.45 0.00 0.00 58.65 57.50 3dxo h GLN 48 Cb 0.03 0.22 -0.08 0.00 -0.05 0.00 0.00 27.48 27.60 3dxo h GLN 48 CO -0.08 -0.64 0.39 0.78 -0.95 0.00 0.00 178.83 178.33 3dxo h GLY 49 N -0.99 1.22 0.99 3.46 0.00 -1.62 0.75 103.07 106.88 3dxo h GLY 49 Ca -0.06 -0.23 -0.11 0.00 0.00 0.00 0.00 47.33 46.93 3dxo h GLY 49 CO -0.03 0.00 -0.21 -2.22 0.00 0.00 0.00 176.54 174.07 3dxo h ILE 50 N 0.60 1.29 -0.53 2.60 2.04 -1.23 -2.88 117.51 119.39 3dxo h ILE 50 Ca 0.41 -1.35 0.05 0.00 1.00 0.00 0.00 64.86 64.96 3dxo h ILE 50 Cb 0.52 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 3dxo h ILE 50 CO -0.33 0.44 0.27 0.00 0.00 0.00 0.00 178.15 178.54 3dxo h ALA 51 N 0.78 0.68 0.00 1.87 0.00 -0.20 -0.62 119.26 121.77 3dxo h ALA 51 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3dxo h ALA 51 Cb 0.77 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3dxo h ALA 51 CO 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.24 3dxo n ALA 52 N -2.33 1.41 0.00 0.00 0.00 0.16 -1.87 120.51 117.88 3dxo n ALA 52 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3dxo n ALA 52 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3dxo n ALA 52 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3dxo n ILE 54 N 0.62 0.00 -0.20 0.00 5.41 -0.24 -0.83 119.36 124.11 3dxo n ILE 54 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.68 3dxo n ILE 54 Cb 0.06 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 39.01 3dxo n ILE 54 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3dxo h GLU 55 N 0.00 0.82 -0.63 0.38 4.81 -1.62 -1.48 114.58 116.86 3dxo h GLU 55 Ca 0.00 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 3dxo h GLU 55 Cb 0.00 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 3dxo h GLU 55 CO 0.00 0.66 0.33 0.00 -0.73 0.00 0.00 179.01 179.27 3dxo h ALA 56 N 1.12 0.81 -0.21 2.92 0.00 -1.26 -1.53 119.26 121.11 3dxo h ALA 56 Ca 0.20 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3dxo h ALA 56 Cb 0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3dxo h ALA 56 CO -0.03 0.35 0.04 0.00 0.00 0.00 0.00 179.25 179.62 3dxo h ALA 57 N 1.15 0.22 -0.23 0.00 0.00 -1.75 -2.59 119.26 116.06 3dxo h ALA 57 Ca 0.22 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 3dxo h ALA 57 Cb 0.07 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3dxo h ALA 57 CO -0.03 -0.38 -0.24 0.00 0.00 0.00 0.00 179.25 178.60 3dxo h ARG 58 N 0.13 0.42 0.00 0.00 3.08 -1.14 -1.98 114.38 114.89 3dxo h ARG 58 Ca 0.10 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 3dxo h ARG 58 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3dxo h ARG 58 CO -0.13 0.64 -0.19 1.96 -1.07 0.00 0.00 179.97 181.18 3dxo h GLN 59 N 0.38 0.00 0.00 0.04 4.20 -0.93 -2.00 115.11 116.80 3dxo h GLN 59 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3dxo h GLN 59 Cb 0.62 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.40 3dxo h GLN 59 CO 0.04 0.19 -0.15 0.87 -0.67 0.00 0.00 178.83 179.11 3dxo h LYS 60 N 0.00 0.00 -2.13 1.46 1.57 -1.01 -3.37 116.57 113.09 3dxo h LYS 60 Ca -0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 3dxo h LYS 60 Cb 0.34 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.24 3dxo h LYS 60 CO 0.02 0.00 -0.88 1.19 -0.57 0.00 0.00 179.45 179.22 3dxo n PHE 61 N -3.03 2.03 -2.11 -1.35 3.01 -0.79 -5.10 117.46 110.11 3dxo n PHE 61 Ca 0.03 -3.90 -0.41 0.00 1.01 0.00 0.00 57.45 54.19 3dxo n PHE 61 Cb 0.53 -0.46 -0.02 0.00 -0.01 0.00 0.00 39.48 39.52 3dxo n PHE 61 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3dxo s PRO 62 N -2.52 4.35 0.00 -1.08 0.04 -0.97 -2.42 135.00 132.39 3dxo s PRO 62 Ca 0.42 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.66 3dxo s PRO 62 Cb 0.25 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.70 3dxo s PRO 62 CO -0.09 -0.23 0.00 0.41 0.04 0.00 0.00 177.00 177.13 3dxo n GLY 63 N 1.26 2.68 3.79 0.56 0.00 -1.26 -4.82 105.19 107.41 3dxo n GLY 63 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3dxo n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dxo s TYR 64 N -2.27 2.87 0.13 1.61 1.51 -1.02 -3.83 117.35 116.35 3dxo s TYR 64 Ca 0.00 1.51 0.03 0.00 -1.01 0.00 0.00 57.07 57.60 3dxo s TYR 64 Cb 0.00 -3.04 -0.04 0.00 -0.11 0.00 0.00 41.96 38.76 3dxo s TYR 64 CO 0.00 -1.34 -0.07 1.03 -1.11 0.00 0.00 175.55 174.06 3dxo s ARG 65 N -4.25 0.95 -0.27 -0.62 0.52 -0.21 -4.97 118.95 110.11 3dxo s ARG 65 Ca 0.64 -1.40 0.03 0.00 -0.52 0.00 0.00 55.73 54.47 3dxo s ARG 65 Cb -0.17 -0.37 0.06 0.00 0.52 0.00 0.00 34.95 35.00 3dxo s ARG 65 CO 0.42 0.00 -0.09 -0.06 0.02 0.00 0.00 175.30 175.59 3dxo s PHE 66 N -3.52 3.33 -0.10 -0.53 0.40 -1.26 -1.04 117.98 115.26 3dxo s PHE 66 Ca 0.15 -2.41 -0.00 0.00 -0.60 0.00 0.00 56.93 54.07 3dxo s PHE 66 Cb 0.04 -2.05 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 3dxo s PHE 66 CO -0.02 -0.89 -0.07 0.08 0.70 0.00 0.00 175.22 175.02 3dxo s VAL 67 N 1.08 3.63 0.38 -0.44 1.01 -0.15 -4.89 120.40 121.02 3dxo s VAL 67 Ca -0.07 -0.49 -0.27 0.00 0.00 0.00 0.00 61.98 61.15 3dxo s VAL 67 Cb -0.20 -2.51 -0.10 0.00 0.00 0.00 0.00 36.38 33.57 3dxo s VAL 67 CO -0.05 0.56 1.41 -0.22 0.00 0.00 0.00 175.10 176.80 3dxo s LEU 68 N -0.37 4.30 -0.05 3.92 2.96 -1.26 -0.07 118.68 128.11 3dxo s LEU 68 Ca 0.05 2.89 0.04 0.00 -0.22 0.00 0.00 54.13 56.89 3dxo s LEU 68 Cb -0.12 -3.74 -0.00 0.00 0.50 0.00 0.00 46.19 42.82 3dxo s LEU 68 CO 0.02 -0.84 -0.18 0.00 -1.32 0.00 0.00 176.35 174.04 3dxo s ALA 69 N -1.16 1.58 0.00 5.97 0.00 0.19 -4.76 121.76 123.58 3dxo s ALA 69 Ca 0.54 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.79 3dxo s ALA 69 Cb -0.43 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.14 3dxo s ALA 69 CO 0.58 0.27 0.00 0.41 0.00 0.00 0.00 175.76 177.02 3dxo n GLY 70 N 3.23 -1.01 3.43 0.00 0.00 -1.26 -3.98 105.19 105.60 3dxo n GLY 70 Ca -0.19 -1.11 -0.36 0.00 0.00 0.00 0.00 46.02 44.36 3dxo n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dxo s THR 71 N 0.00 4.23 0.67 2.61 2.01 -1.26 -4.96 115.64 118.94 3dxo s THR 71 Ca 0.00 -0.22 -0.17 0.00 0.31 0.00 0.00 61.69 61.61 3dxo s THR 71 Cb 0.00 -2.99 -0.02 0.00 0.01 0.00 0.00 72.50 69.50 3dxo s THR 71 CO 0.00 0.33 0.89 -2.65 -0.69 0.00 0.00 174.62 172.51 3dxo n PRO 72 N 4.91 0.63 -2.31 4.92 -0.02 -1.26 -4.93 135.00 136.94 3dxo n PRO 72 Ca -0.16 0.26 -0.04 0.00 -2.02 0.00 0.00 63.50 61.54 3dxo n PRO 72 Cb 0.51 -2.13 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 3dxo n PRO 72 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3dxo n ASP 73 N -1.08 -0.26 0.00 2.55 5.75 -0.31 -4.80 116.55 118.41 3dxo n ASP 73 Ca 0.13 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 3dxo n ASP 73 Cb 0.49 0.52 0.00 0.00 -1.03 0.00 0.00 41.12 41.09 3dxo n ASP 73 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dxo n GLY 74 N -0.14 -0.72 3.58 6.12 0.00 -1.26 -0.62 105.19 112.14 3dxo n GLY 74 Ca 0.01 -1.27 -0.10 0.00 0.00 0.00 0.00 46.02 44.65 3dxo n GLY 74 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3dxo s HIS 75 N -2.93 -0.37 0.00 1.61 -3.43 -0.51 -5.01 115.29 104.65 3dxo s HIS 75 Ca 0.00 0.63 0.00 0.00 -0.80 0.00 0.00 55.06 54.89 3dxo s HIS 75 Cb 0.00 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.60 3dxo s HIS 75 CO 0.00 -0.34 0.00 0.41 -2.00 0.00 0.00 174.74 172.81 3dxo n GLY 76 N 0.73 3.06 1.01 -1.38 0.00 -1.26 -0.24 105.19 107.11 3dxo n GLY 76 Ca -0.10 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 45.83 3dxo n GLY 76 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dxo n ASN 77 N 2.71 2.88 -4.72 1.61 6.94 -1.26 -4.89 115.26 118.53 3dxo n ASN 77 Ca 0.00 -2.26 -0.35 0.00 -0.02 0.00 0.00 54.58 51.95 3dxo n ASN 77 Cb 0.00 -0.44 -0.08 0.00 -2.36 0.00 0.00 39.78 36.90 3dxo n ASN 77 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3dxo s PHE 78 N -1.71 3.34 -0.01 -2.53 0.08 0.67 -1.51 117.98 116.30 3dxo s PHE 78 Ca 0.28 0.25 0.06 0.00 0.12 0.00 0.00 56.93 57.65 3dxo s PHE 78 Cb 0.18 -1.98 -0.02 0.00 -0.57 0.00 0.00 43.02 40.64 3dxo s PHE 78 CO 0.14 0.40 -0.20 0.99 -0.10 0.00 0.00 175.22 176.44 3dxo s THR 79 N -0.30 1.58 -0.03 0.64 2.01 -0.69 -1.42 115.64 117.44 3dxo s THR 79 Ca 0.09 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.27 3dxo s THR 79 Cb -0.12 -1.32 -0.00 0.00 0.01 0.00 0.00 72.50 71.07 3dxo s THR 79 CO 0.01 0.44 -0.15 -0.60 -0.69 0.00 0.00 174.62 173.64 3dxo s ARG 80 N -0.48 1.41 0.18 4.92 3.52 0.20 -1.09 118.95 127.61 3dxo s ARG 80 Ca 0.08 -0.51 -0.20 0.00 -0.13 0.00 0.00 55.73 54.96 3dxo s ARG 80 Cb -0.08 -1.28 0.05 0.00 -1.56 0.00 0.00 34.95 32.08 3dxo s ARG 80 CO -0.01 0.24 0.57 -0.59 -0.81 0.00 0.00 175.30 174.70 3dxo s PHE 81 N -0.05 -0.33 0.16 5.12 -0.12 -1.04 -1.16 117.98 120.56 3dxo s PHE 81 Ca -0.00 0.04 0.08 0.00 -0.05 0.00 0.00 56.93 56.99 3dxo s PHE 81 Cb -0.09 0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 42.75 3dxo s PHE 81 CO 0.01 -0.90 -0.17 -1.12 -0.05 0.00 0.00 175.22 172.99 3dxo s SER 82 N -2.81 2.55 0.07 1.98 0.01 -1.26 -1.06 113.70 113.18 3dxo s SER 82 Ca 0.05 -0.87 -0.06 0.00 1.31 0.00 0.00 55.95 56.37 3dxo s SER 82 Cb -0.01 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.07 3dxo s SER 82 CO -0.07 -0.07 0.12 -1.66 0.41 0.00 0.00 173.24 171.96 3dxo s TRP 83 N -2.19 0.25 0.06 2.43 1.48 -0.66 -0.63 118.94 119.68 3dxo s TRP 83 Ca 0.15 -0.69 0.07 0.00 -1.06 0.00 0.00 56.10 54.57 3dxo s TRP 83 Cb -0.05 -0.16 -0.03 0.00 -1.16 0.00 0.00 33.47 32.07 3dxo s TRP 83 CO 0.06 -0.48 -0.15 1.03 -4.06 0.00 0.00 176.95 173.35 3dxo s ARG 84 N -3.70 2.10 -0.34 3.25 1.81 0.90 -1.28 118.95 121.69 3dxo s ARG 84 Ca 0.04 -0.98 -0.15 0.00 -1.72 0.00 0.00 55.73 52.91 3dxo s ARG 84 Cb 0.05 -2.24 -0.01 0.00 -0.45 0.00 0.00 34.95 32.30 3dxo s ARG 84 CO -0.10 0.53 0.37 -1.17 -0.68 0.00 0.00 175.30 174.26 3dxo s LEU 85 N -1.67 4.40 -0.19 2.53 2.96 0.10 -0.97 118.68 125.84 3dxo s LEU 85 Ca 0.17 -0.18 -0.07 0.00 -0.22 0.00 0.00 54.13 53.82 3dxo s LEU 85 Cb -0.11 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 3dxo s LEU 85 CO 0.08 -0.34 0.05 -0.63 -1.32 0.00 0.00 176.35 174.19 3dxo s ILE 86 N 2.04 4.60 0.72 6.68 -1.09 -0.21 -1.85 121.20 132.10 3dxo s ILE 86 Ca 0.12 -0.10 -0.13 0.00 -2.23 0.00 0.00 60.65 58.32 3dxo s ILE 86 Cb -0.16 -3.08 0.03 0.00 -1.58 0.00 0.00 42.46 37.66 3dxo s ILE 86 CO 0.12 0.44 1.12 -0.55 -1.23 0.00 0.00 174.94 174.83 3dxo s SER 87 N 0.62 4.66 0.32 3.58 0.15 0.67 -1.04 113.70 122.66 3dxo s SER 87 Ca 0.03 2.00 0.08 0.00 0.70 0.00 0.00 55.95 58.76 3dxo s SER 87 Cb -0.13 -2.55 0.82 0.00 -1.71 0.00 0.00 66.02 62.46 3dxo s SER 87 CO 0.02 -1.93 1.77 -0.65 1.20 0.00 0.00 173.24 173.64 3dxo h PRO 88 N -0.50 0.65 0.00 5.44 0.11 -1.88 0.10 132.00 135.93 3dxo h PRO 88 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dxo h PRO 88 Cb 1.25 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3dxo h PRO 88 CO 0.52 0.43 0.00 -0.40 -0.21 0.00 0.00 178.00 178.34 3dxo n ASP 89 N -4.78 0.00 0.00 -2.05 5.68 -1.26 -4.89 116.55 109.25 3dxo n ASP 89 Ca 0.24 -0.70 0.00 0.00 -0.50 0.00 0.00 54.79 53.84 3dxo n ASP 89 Cb 0.65 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 3dxo n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dxo n GLY 90 N 0.75 0.66 3.78 6.12 0.00 0.36 -5.08 105.19 111.78 3dxo n GLY 90 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3dxo n GLY 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dxo s ASP 91 N -2.76 6.97 -0.48 1.61 1.01 -1.26 -4.67 116.67 117.09 3dxo s ASP 91 Ca 0.00 2.03 -0.23 0.00 0.71 0.00 0.00 52.55 55.06 3dxo s ASP 91 Cb 0.00 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 41.37 3dxo s ASP 91 CO 0.00 -0.34 0.81 -0.62 0.21 0.00 0.00 175.17 175.24 3dxo s ASP 92 N -1.46 6.38 -0.07 0.27 -1.08 -1.26 -0.24 116.67 119.22 3dxo s ASP 92 Ca 0.54 -0.22 0.20 0.00 -0.52 0.00 0.00 52.55 52.55 3dxo s ASP 92 Cb -0.23 -2.39 -0.28 0.00 -1.46 0.00 0.00 42.92 38.56 3dxo s ASP 92 CO 0.29 -0.99 0.40 1.33 0.52 0.00 0.00 175.17 176.72 3dxo n VAL 93 N 6.12 0.57 -3.03 1.11 0.24 -0.77 -5.02 118.33 117.56 3dxo n VAL 93 Ca 0.02 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 3dxo n VAL 93 Cb 0.48 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 3dxo n VAL 93 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dxo n ALA 94 N -2.43 0.00 -3.81 2.33 0.00 -1.24 -5.01 120.51 110.36 3dxo n ALA 94 Ca -0.14 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.33 3dxo n ALA 94 Cb 0.78 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.26 3dxo n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dxo n GLY 95 N -0.00 0.85 3.45 0.00 0.00 -0.89 0.03 105.19 108.63 3dxo n GLY 95 Ca 0.00 -1.21 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 3dxo n GLY 95 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dxo s GLY 96 N -3.17 1.50 -0.00 -0.02 0.00 -0.41 -0.67 107.32 104.55 3dxo s GLY 96 Ca 0.18 -1.54 0.00 0.00 0.00 0.00 0.00 44.72 43.36 3dxo s GLY 96 CO 0.09 -1.05 0.00 -1.59 0.00 0.00 0.00 173.10 170.55 3dxo s THR 97 N -3.28 0.00 0.09 0.90 2.01 -0.53 -1.65 115.64 113.18 3dxo s THR 97 Ca 0.32 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.37 3dxo s THR 97 Cb 0.00 -0.02 -0.03 0.00 0.01 0.00 0.00 72.50 72.47 3dxo s THR 97 CO 0.19 0.01 -0.13 -1.81 -0.69 0.00 0.00 174.62 172.19 3dxo s ASP 98 N 0.05 1.68 -0.19 3.53 1.01 -0.22 -0.60 116.67 121.92 3dxo s ASP 98 Ca -0.00 -0.71 0.00 0.00 0.71 0.00 0.00 52.55 52.55 3dxo s ASP 98 Cb -0.01 -0.04 0.01 0.00 1.01 0.00 0.00 42.92 43.90 3dxo s ASP 98 CO -0.00 -0.14 -0.17 -0.69 0.21 0.00 0.00 175.17 174.38 3dxo s VAL 99 N -1.75 2.31 -0.04 -1.27 1.01 -0.70 -2.50 120.40 117.47 3dxo s VAL 99 Ca 0.02 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.18 3dxo s VAL 99 Cb -0.07 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3dxo s VAL 99 CO 0.02 0.52 -0.13 -0.69 0.00 0.00 0.00 175.10 174.82 3dxo s VAL 100 N 1.30 3.20 -0.05 2.92 1.01 -0.25 -1.54 120.40 126.99 3dxo s VAL 100 Ca 0.05 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.34 3dxo s VAL 100 Cb -0.13 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 3dxo s VAL 100 CO -0.11 0.54 -0.25 -0.44 0.00 0.00 0.00 175.10 174.85 3dxo s SER 101 N -0.91 2.99 -0.05 3.32 0.01 0.07 -1.71 113.70 117.42 3dxo s SER 101 Ca 0.13 -0.49 -0.04 0.00 1.31 0.00 0.00 55.95 56.86 3dxo s SER 101 Cb -0.11 -0.72 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 3dxo s SER 101 CO 0.02 0.25 0.14 -0.76 0.41 0.00 0.00 173.24 173.31 3dxo s LEU 102 N -0.24 4.26 0.87 2.44 1.02 -0.57 -0.99 118.68 125.47 3dxo s LEU 102 Ca -0.01 0.35 -0.11 0.00 0.02 0.00 0.00 54.13 54.38 3dxo s LEU 102 Cb -0.13 -2.33 0.17 0.00 0.02 0.00 0.00 46.19 43.92 3dxo s LEU 102 CO 0.03 0.32 1.21 0.54 0.02 0.00 0.00 176.35 178.46 3dxo s ASN 103 N -1.53 3.60 0.00 2.29 2.20 -0.19 -4.84 114.94 116.47 3dxo s ASN 103 Ca 0.22 0.09 0.10 0.00 -0.94 0.00 0.00 52.86 52.33 3dxo s ASN 103 Cb -0.12 -0.27 0.56 0.00 -2.00 0.00 0.00 41.25 39.42 3dxo s ASN 103 CO 0.12 -2.40 1.07 0.35 -2.94 0.00 0.00 177.10 173.30 3dxo n THR 104 N -3.44 0.19 -0.95 0.54 -2.24 -1.26 -1.86 114.28 105.26 3dxo n THR 104 Ca 0.15 0.05 0.09 0.00 -2.27 0.00 0.00 64.05 62.06 3dxo n THR 104 Cb 0.60 -0.89 0.23 0.00 -2.10 0.00 0.00 70.33 68.17 3dxo n THR 104 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dxo n GLU 105 N -1.07 2.69 -0.95 -0.78 1.02 -1.26 -4.97 120.64 115.31 3dxo n GLU 105 Ca 0.07 -2.75 0.00 0.00 -0.02 0.00 0.00 57.16 54.46 3dxo n GLU 105 Cb 0.04 -1.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 3dxo n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dxo n GLY 106 N -0.59 0.59 3.75 0.62 0.00 -0.78 -5.04 105.19 103.75 3dxo n GLY 106 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 3dxo n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dxo s ARG 107 N -0.31 2.83 -0.13 1.61 0.52 -1.26 -4.81 118.95 117.40 3dxo s ARG 107 Ca 0.00 -0.69 -0.29 0.00 -0.52 0.00 0.00 55.73 54.22 3dxo s ARG 107 Cb 0.00 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.72 3dxo s ARG 107 CO 0.00 0.57 1.73 0.42 0.02 0.00 0.00 175.30 178.04 3dxo s ILE 108 N -1.34 3.51 -0.41 1.52 1.01 0.70 -1.02 121.20 125.17 3dxo s ILE 108 Ca 0.28 0.59 0.11 0.00 0.00 0.00 0.00 60.65 61.62 3dxo s ILE 108 Cb -0.12 -3.47 -0.13 0.00 0.01 0.00 0.00 42.46 38.75 3dxo s ILE 108 CO 0.20 -0.15 0.41 -0.90 0.00 0.00 0.00 174.94 174.50 3dxo n ASP 109 N 8.20 0.87 -3.64 3.58 5.68 -0.16 -0.65 116.55 130.42 3dxo n ASP 109 Ca 0.19 -0.61 -0.07 0.00 -0.50 0.00 0.00 54.79 53.80 3dxo n ASP 109 Cb 0.44 1.09 -0.07 0.00 -1.14 0.00 0.00 41.12 41.44 3dxo n ASP 109 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 3dxo s ASN 110 N -2.23 -0.93 -0.03 -1.12 2.47 -1.20 -2.23 114.94 109.66 3dxo s ASN 110 Ca 0.03 1.50 0.01 0.00 0.42 0.00 0.00 52.86 54.81 3dxo s ASN 110 Cb 0.08 1.37 0.02 0.00 -1.45 0.00 0.00 41.25 41.27 3dxo s ASN 110 CO 0.44 -0.24 -0.02 -0.69 -3.72 0.00 0.00 177.10 172.87 3dxo s VAL 111 N 1.59 0.33 -0.19 -5.21 1.01 -0.14 -0.75 120.40 117.04 3dxo s VAL 111 Ca -0.10 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3dxo s VAL 111 Cb -0.05 -0.38 0.04 0.00 0.00 0.00 0.00 36.38 35.99 3dxo s VAL 111 CO -0.19 0.16 -0.10 -0.69 0.00 0.00 0.00 175.10 174.28 3dxo s VAL 112 N 0.79 1.56 0.16 2.92 1.01 -0.59 -1.86 120.40 124.39 3dxo s VAL 112 Ca -0.09 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.03 3dxo s VAL 112 Cb -0.12 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 3dxo s VAL 112 CO -0.01 0.20 0.14 -0.83 0.00 0.00 0.00 175.10 174.61 3dxo s GLY 113 N 1.44 1.73 0.08 4.51 0.00 -0.21 -1.72 107.32 113.15 3dxo s GLY 113 Ca -0.00 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.54 3dxo s GLY 113 CO -0.08 -1.21 -0.07 -1.36 0.00 0.00 0.00 173.10 170.37 3dxo s PHE 114 N -1.74 0.85 -0.01 1.90 0.40 0.23 -4.01 117.98 115.61 3dxo s PHE 114 Ca 0.31 -0.77 -0.02 0.00 -0.60 0.00 0.00 56.93 55.85 3dxo s PHE 114 Cb -0.10 -0.49 -0.04 0.00 0.51 0.00 0.00 43.02 42.90 3dxo s PHE 114 CO 0.24 -0.11 0.16 -0.51 0.70 0.00 0.00 175.22 175.69 3dxo s LEU 115 N -2.57 4.25 0.05 -0.37 1.43 -1.26 -1.46 118.68 118.76 3dxo s LEU 115 Ca 0.05 0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.51 3dxo s LEU 115 Cb 0.00 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 3dxo s LEU 115 CO -0.03 0.26 -0.17 -1.81 0.23 0.00 0.00 176.35 174.83 3dxo s ASP 116 N -1.91 2.08 0.00 2.29 1.01 0.16 -4.89 116.67 115.41 3dxo s ASP 116 Ca 0.26 -0.53 0.00 0.00 0.71 0.00 0.00 52.55 52.99 3dxo s ASP 116 Cb -0.12 -0.14 0.00 0.00 1.01 0.00 0.00 42.92 43.67 3dxo s ASP 116 CO 0.18 0.07 0.00 0.61 0.21 0.00 0.00 175.17 176.24 3dxo n GLY 117 N 1.68 0.66 0.68 0.21 0.00 -1.26 -2.10 105.19 105.07 3dxo n GLY 117 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 3dxo n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32