#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qeu h SER 9 N 0.00 0.34 -0.66 8.00 0.02 -1.93 -3.13 113.55 116.20 2qeu h SER 9 Ca 0.00 0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.03 2qeu h SER 9 Cb 0.00 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.45 2qeu h SER 9 CO 0.00 0.16 0.37 1.56 -1.14 0.00 0.00 176.83 177.78 2qeu h GLN 10 N 0.36 0.67 -0.22 3.45 7.50 -1.99 -0.13 115.11 124.74 2qeu h GLN 10 Ca 0.40 -0.04 -0.17 0.00 0.50 0.00 0.00 58.65 59.34 2qeu h GLN 10 Cb 1.02 -0.15 0.00 0.00 0.05 0.00 0.00 27.48 28.41 2qeu h GLN 10 CO -0.12 0.44 -0.54 0.38 -1.50 0.00 0.00 178.83 177.49 2qeu h ASP 11 N 0.69 0.86 -0.61 1.46 -0.00 -1.98 -2.00 116.42 114.83 2qeu h ASP 11 Ca 0.29 -0.56 -0.07 0.00 -0.00 0.00 0.00 57.03 56.69 2qeu h ASP 11 Cb 0.17 -0.25 -0.03 0.00 -0.00 0.00 0.00 39.33 39.23 2qeu h ASP 11 CO -0.18 1.27 0.10 0.40 -0.00 0.00 0.00 179.24 180.84 2qeu h ILE 12 N 0.49 1.26 -0.49 4.15 2.04 -1.50 -1.10 117.51 122.35 2qeu h ILE 12 Ca -0.00 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 64.84 2qeu h ILE 12 Cb 1.15 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 2qeu h ILE 12 CO 0.12 0.38 0.28 -0.07 0.00 0.00 0.00 178.15 178.85 2qeu h LEU 13 N 0.98 0.61 -0.82 1.44 3.38 -1.00 -2.54 115.31 117.36 2qeu h LEU 13 Ca 0.20 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2qeu h LEU 13 Cb 0.42 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2qeu h LEU 13 CO 0.01 0.52 0.52 0.11 0.09 0.00 0.00 178.44 179.69 2qeu h LYS 14 N 0.66 0.98 -0.76 1.13 1.57 -1.10 -1.15 116.57 117.89 2qeu h LYS 14 Ca 0.17 -0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.01 2qeu h LYS 14 Cb 0.04 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.08 2qeu h LYS 14 CO -0.03 0.65 0.50 1.96 -0.57 0.00 0.00 179.45 181.96 2qeu h GLN 15 N 1.01 0.56 -0.07 3.15 4.20 -0.78 -3.11 115.11 120.06 2qeu h GLN 15 Ca 0.33 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.01 2qeu h GLN 15 Cb 0.03 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.69 2qeu h GLN 15 CO -0.12 0.37 0.00 0.72 -0.67 0.00 0.00 178.83 179.13 2qeu n HIS 16 N -4.50 0.09 -0.33 2.96 8.25 -0.97 -4.68 115.22 116.04 2qeu n HIS 16 Ca 0.14 -0.15 -0.04 0.00 -0.26 0.00 0.00 57.72 57.41 2qeu n HIS 16 Cb 0.42 -0.01 0.08 0.00 1.12 0.00 0.00 29.99 31.60 2qeu n HIS 16 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qeu h ALA 17 N 1.33 1.12 -0.73 -1.41 0.00 -1.15 -2.43 119.26 115.99 2qeu h ALA 17 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2qeu h ALA 17 Cb 0.40 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2qeu h ALA 17 CO 0.00 0.58 0.32 0.00 0.00 0.00 0.00 179.25 180.15 2qeu h ALA 18 N 1.29 1.18 0.21 0.00 0.00 -1.83 -0.56 119.26 119.54 2qeu h ALA 18 Ca 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qeu h ALA 18 Cb -0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2qeu h ALA 18 CO -0.06 0.61 -0.13 1.25 0.00 0.00 0.00 179.25 180.92 2qeu h HIS 19 N 1.05 -0.33 -0.23 0.00 6.17 -1.77 -1.69 115.15 118.35 2qeu h HIS 19 Ca 0.25 -0.00 -0.14 0.00 0.71 0.00 0.00 60.37 61.19 2qeu h HIS 19 Cb 0.16 0.11 -0.01 0.00 2.52 0.00 0.00 27.41 30.20 2qeu h HIS 19 CO 0.02 -0.20 -0.42 1.88 0.71 0.00 0.00 177.93 179.92 2qeu h TYR 20 N -0.32 0.68 -0.01 5.26 0.05 -1.22 0.13 116.97 121.53 2qeu h TYR 20 Ca -0.02 -0.20 -0.00 0.00 0.05 0.00 0.00 58.73 58.56 2qeu h TYR 20 Cb 0.27 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 37.86 2qeu h TYR 20 CO -0.08 0.89 0.01 1.49 -1.05 0.00 0.00 178.16 179.42 2qeu h GLU 21 N 0.46 0.01 0.02 4.88 4.57 -1.11 -1.16 114.58 122.25 2qeu h GLU 21 Ca 0.04 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2qeu h GLU 21 Cb 0.92 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 2qeu h GLU 21 CO 0.08 0.05 -0.01 1.03 -1.18 0.00 0.00 179.01 178.99 2qeu h SER 22 N -0.03 -0.02 0.48 1.04 0.87 -1.13 0.79 113.55 115.56 2qeu h SER 22 Ca 0.00 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 2qeu h SER 22 Cb 0.04 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2qeu h SER 22 CO -0.00 0.24 0.00 -0.67 -0.53 0.00 0.00 176.83 175.87 2qeu n ASP 23 N -4.98 0.00 -0.50 6.23 2.03 0.44 -5.03 116.55 114.74 2qeu n ASP 23 Ca -0.08 -0.06 -0.00 0.00 0.52 0.00 0.00 54.79 55.17 2qeu n ASP 23 Cb 0.15 -0.29 -0.00 0.00 -0.72 0.00 0.00 41.12 40.26 2qeu n ASP 23 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qeu n GLY 25 N 0.86 0.99 0.00 0.27 0.00 0.27 -4.67 105.19 102.91 2qeu n GLY 25 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2qeu n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qeu n GLY 26 N 0.00 2.21 3.58 -0.02 0.00 -0.75 -4.86 105.19 105.35 2qeu n GLY 26 Ca -0.00 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 2qeu n GLY 26 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qeu s LEU 27 N 0.00 4.20 0.64 0.99 2.96 -1.26 -4.58 118.68 121.63 2qeu s LEU 27 Ca 0.00 0.08 -0.18 0.00 -0.22 0.00 0.00 54.13 53.81 2qeu s LEU 27 Cb 0.00 -2.41 -0.02 0.00 0.50 0.00 0.00 46.19 44.26 2qeu s LEU 27 CO 0.00 -0.26 1.17 -2.65 -1.32 0.00 0.00 176.35 173.28 2qeu n PRO 28 N 5.39 1.00 -0.34 0.98 -0.02 -1.26 -4.69 135.00 136.05 2qeu n PRO 28 Ca -0.08 0.39 0.07 0.00 -2.02 0.00 0.00 63.50 61.86 2qeu n PRO 28 Cb 0.50 -2.39 0.23 0.00 -0.02 0.00 0.00 33.50 31.82 2qeu n PRO 28 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2qeu h GLU 29 N 0.46 0.87 -0.88 -0.52 4.57 -1.99 -0.32 114.58 116.78 2qeu h GLU 29 Ca -0.50 -0.05 0.07 0.00 -1.18 0.00 0.00 59.36 57.69 2qeu h GLU 29 Cb 1.35 -0.20 -0.06 0.00 -0.16 0.00 0.00 28.75 29.68 2qeu h GLU 29 CO 0.52 0.58 0.54 0.00 -1.18 0.00 0.00 179.01 179.47 2qeu h ALA 30 N 1.54 1.21 0.00 2.92 0.00 -1.99 -0.95 119.26 121.99 2qeu h ALA 30 Ca 0.49 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 55.20 2qeu h ALA 30 Cb 0.53 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2qeu h ALA 30 CO -0.28 0.28 -0.90 -0.07 0.00 0.00 0.00 179.25 178.27 2qeu h LEU 31 N 0.98 0.02 -0.40 0.00 3.38 -1.47 -1.26 115.31 116.56 2qeu h LEU 31 Ca 0.39 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.41 2qeu h LEU 31 Cb 0.20 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 2qeu h LEU 31 CO -0.18 0.91 0.05 0.58 0.09 0.00 0.00 178.44 179.88 2qeu h VAL 32 N 0.01 0.75 -0.17 1.22 2.07 -0.71 0.69 116.25 120.11 2qeu h VAL 32 Ca -0.01 -0.06 -0.14 0.00 0.82 0.00 0.00 66.70 67.31 2qeu h VAL 32 Cb 1.59 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2qeu h VAL 32 CO 0.12 0.03 -0.49 1.56 0.02 0.00 0.00 177.57 178.81 2qeu h GLN 33 N 0.16 0.44 -0.62 1.57 4.20 -1.04 -1.52 115.11 118.31 2qeu h GLN 33 Ca 0.20 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2qeu h GLN 33 Cb 0.25 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 2qeu h GLN 33 CO -0.28 0.83 0.34 1.25 -0.67 0.00 0.00 178.83 180.29 2qeu h LEU 34 N 0.35 0.77 -0.87 1.46 5.85 -0.96 -1.73 115.31 120.18 2qeu h LEU 34 Ca 0.02 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.65 2qeu h LEU 34 Cb 0.98 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 2qeu h LEU 34 CO 0.09 0.64 0.58 0.00 -0.34 0.00 0.00 178.44 179.40 2qeu h ALA 35 N 1.16 1.11 0.04 1.25 0.00 -0.46 0.15 119.26 122.51 2qeu h ALA 35 Ca 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2qeu h ALA 35 Cb 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2qeu h ALA 35 CO -0.03 0.51 -0.02 1.49 0.00 0.00 0.00 179.25 181.19 2qeu h GLU 36 N 1.18 -0.06 0.00 0.00 4.81 -0.98 -3.20 114.58 116.33 2qeu h GLU 36 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2qeu h GLU 36 Cb -0.13 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.26 2qeu h GLU 36 CO -0.07 0.14 -1.33 0.66 -0.73 0.00 0.00 179.01 177.68 2qeu n TYR 37 N -5.03 0.48 -3.04 0.92 4.01 -0.68 -4.55 117.16 109.27 2qeu n TYR 37 Ca -0.08 0.14 -0.15 0.00 -0.16 0.00 0.00 57.90 57.65 2qeu n TYR 37 Cb 0.13 -0.68 0.01 0.00 -0.31 0.00 0.00 39.34 38.49 2qeu n TYR 37 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qeu n ALA 38 N -2.11 1.07 0.08 -0.72 0.00 0.51 -5.01 120.51 114.32 2qeu n ALA 38 Ca -0.01 -2.74 0.01 0.00 0.00 0.00 0.00 53.44 50.70 2qeu n ALA 38 Cb 0.53 -1.01 0.35 0.00 0.00 0.00 0.00 19.45 19.32 2qeu n ALA 38 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qeu h PRO 39 N 3.13 0.32 -0.54 0.00 0.13 -1.61 0.31 132.00 133.74 2qeu h PRO 39 Ca 0.03 -0.08 -0.10 0.00 -0.87 0.00 0.00 66.00 64.98 2qeu h PRO 39 Cb 1.00 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.07 2qeu h PRO 39 CO 0.38 0.44 -0.06 0.93 -0.23 0.00 0.00 178.00 179.46 2qeu h GLU 40 N 0.30 0.98 -0.47 0.86 5.08 -1.91 -0.13 114.58 119.29 2qeu h GLU 40 Ca 0.06 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 2qeu h GLU 40 Cb 0.39 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2qeu h GLU 40 CO 0.02 1.00 0.06 1.15 -1.00 0.00 0.00 179.01 180.24 2qeu h THR 41 N 0.88 1.25 -0.87 1.13 2.02 -1.77 -2.42 112.91 113.14 2qeu h THR 41 Ca 0.15 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 66.39 2qeu h THR 41 Cb 0.60 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.91 2qeu h THR 41 CO 0.04 0.33 0.55 0.15 0.37 0.00 0.00 175.52 176.96 2qeu h PHE 42 N 0.66 1.12 0.10 3.16 3.57 -0.77 -0.77 116.94 124.01 2qeu h PHE 42 Ca 0.14 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2qeu h PHE 42 Cb 0.41 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.78 2qeu h PHE 42 CO 0.03 0.72 -0.05 0.22 -2.23 0.00 0.00 178.31 177.01 2qeu h ASP 43 N 1.19 -0.12 -0.36 0.41 3.58 -0.91 0.22 116.42 120.43 2qeu h ASP 43 Ca 0.32 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 2qeu h ASP 43 Cb -0.10 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 2qeu h ASP 43 CO -0.06 0.09 0.13 0.00 -2.88 0.00 0.00 179.24 176.52 2qeu h ALA 44 N 0.55 0.46 -0.86 -0.78 0.00 -1.27 -1.16 119.26 116.21 2qeu h ALA 44 Ca -0.01 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.81 2qeu h ALA 44 Cb 0.27 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2qeu h ALA 44 CO 0.02 0.08 0.53 -0.92 0.00 0.00 0.00 179.25 178.97 2qeu h TYR 45 N 0.43 0.99 -0.19 0.00 3.20 -1.13 -2.43 116.97 117.84 2qeu h TYR 45 Ca 0.12 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 2qeu h TYR 45 Cb 0.21 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2qeu h TYR 45 CO 0.00 0.51 -0.38 0.77 -1.64 0.00 0.00 178.16 177.43 2qeu h SER 46 N 0.98 0.44 0.00 -2.11 0.02 -0.31 -0.06 113.55 112.51 2qeu h SER 46 Ca 0.37 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2qeu h SER 46 Cb 0.15 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2qeu h SER 46 CO -0.17 0.78 0.00 0.54 -1.14 0.00 0.00 176.83 176.84 2qeu n ARG 47 N -4.05 0.25 0.00 3.45 1.74 -0.50 -0.88 116.66 116.68 2qeu n ARG 47 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2qeu n ARG 47 Cb 0.48 -1.21 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 2qeu n ARG 47 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2qeu n ARG 49 N 0.56 0.00 -0.20 5.56 0.63 -0.04 -2.43 116.66 120.74 2qeu n ARG 49 Ca 0.00 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.86 2qeu n ARG 49 Cb 0.08 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.02 2qeu n ARG 49 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 2qeu h THR 50 N 0.00 1.20 0.00 5.15 2.02 -1.26 -0.35 112.91 119.66 2qeu h THR 50 Ca 0.00 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.63 2qeu h THR 50 Cb 0.00 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2qeu h THR 50 CO 0.00 0.22 0.00 1.07 0.37 0.00 0.00 175.52 177.18 2qeu n THR 51 N -4.57 0.33 0.00 3.16 5.66 -1.02 -2.30 114.28 115.54 2qeu n THR 51 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 2qeu n THR 51 Cb 0.11 -0.61 0.00 0.00 -1.55 0.00 0.00 70.33 68.29 2qeu n THR 51 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2qeu n LEU 53 N 0.69 0.00 -4.55 1.09 4.77 -0.14 -4.93 117.00 113.93 2qeu n LEU 53 Ca 0.00 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.51 2qeu n LEU 53 Cb 0.19 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2qeu n LEU 53 CO 0.00 0.00 0.52 1.17 -1.33 0.00 0.00 177.39 177.75 2qeu n LYS 54 N 0.00 0.97 -1.78 3.23 4.81 -0.97 -4.97 118.16 119.44 2qeu n LYS 54 Ca 0.00 0.34 -0.30 0.00 -0.87 0.00 0.00 58.31 57.48 2qeu n LYS 54 Cb 0.00 -1.70 0.05 0.00 0.02 0.00 0.00 35.03 33.40 2qeu n LYS 54 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2qeu s SER 55 N -0.40 5.41 0.25 3.14 1.04 -1.26 -4.60 113.70 117.27 2qeu s SER 55 Ca 0.67 1.28 -0.05 0.00 0.48 0.00 0.00 55.95 58.32 2qeu s SER 55 Cb -0.83 -2.12 0.31 0.00 0.10 0.00 0.00 66.02 63.49 2qeu s SER 55 CO 0.56 -1.38 1.88 -0.33 0.98 0.00 0.00 173.24 174.95 2qeu h GLU 56 N -0.68 1.09 -0.22 4.02 5.08 -1.85 0.17 114.58 122.20 2qeu h GLU 56 Ca -0.45 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 57.89 2qeu h GLU 56 Cb 1.24 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2qeu h GLU 56 CO 0.62 0.72 0.15 0.00 -1.00 0.00 0.00 179.01 179.50 2qeu h ALA 57 N 1.39 2.11 -0.55 3.43 0.00 -1.94 0.18 119.26 123.88 2qeu h ALA 57 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2qeu h ALA 57 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2qeu h ALA 57 CO -0.14 -0.16 0.00 -0.25 0.00 0.00 0.00 179.25 178.71 2qeu n ASP 58 N -4.49 4.11 0.00 0.00 8.00 -0.76 -4.92 116.55 118.49 2qeu n ASP 58 Ca 0.02 -2.39 0.00 0.00 0.71 0.00 0.00 54.79 53.13 2qeu n ASP 58 Cb 0.24 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 2qeu n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qeu n GLY 59 N 1.00 0.92 3.78 0.44 0.00 0.62 -4.86 105.19 107.09 2qeu n GLY 59 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 2qeu n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qeu s ALA 60 N -2.00 2.85 -0.08 4.61 0.00 -0.03 -4.94 121.76 122.18 2qeu s ALA 60 Ca 0.00 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.75 2qeu s ALA 60 Cb 0.00 -3.31 -0.24 0.00 0.00 0.00 0.00 23.12 19.57 2qeu s ALA 60 CO 0.00 -0.50 0.52 1.63 0.00 0.00 0.00 175.76 177.41 2qeu n LYS 61 N -0.90 0.68 -3.15 0.00 4.76 -1.26 -4.22 118.16 114.06 2qeu n LYS 61 Ca 0.09 0.28 -0.40 0.00 -2.87 0.00 0.00 58.31 55.41 2qeu n LYS 61 Cb 0.51 -1.75 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 2qeu n LYS 61 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2qeu s LEU 62 N -6.46 4.11 0.31 -0.35 2.96 -1.26 -5.02 118.68 112.98 2qeu s LEU 62 Ca -0.12 0.74 -0.28 0.00 -0.22 0.00 0.00 54.13 54.24 2qeu s LEU 62 Cb 0.07 -2.82 -0.13 0.00 0.50 0.00 0.00 46.19 43.81 2qeu s LEU 62 CO 0.80 -0.28 1.18 -2.65 -1.32 0.00 0.00 176.35 174.09 2qeu n PRO 63 N 5.21 1.81 -0.36 0.98 -0.02 -1.26 -4.72 135.00 136.64 2qeu n PRO 63 Ca -0.02 0.63 0.06 0.00 -2.02 0.00 0.00 63.50 62.15 2qeu n PRO 63 Cb 0.50 -2.14 0.23 0.00 -0.02 0.00 0.00 33.50 32.07 2qeu n PRO 63 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2qeu h LEU 64 N 2.42 0.95 -1.17 2.45 5.85 -1.91 -0.51 115.31 123.39 2qeu h LEU 64 Ca -0.43 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.42 2qeu h LEU 64 Cb 1.31 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 2qeu h LEU 64 CO 0.62 0.54 0.58 0.07 -0.34 0.00 0.00 178.44 179.92 2qeu h LYS 65 N 1.04 0.89 0.02 1.25 2.10 -1.82 -1.21 116.57 118.84 2qeu h LYS 65 Ca 0.47 -0.05 -0.20 0.00 -2.00 0.00 0.00 60.65 58.86 2qeu h LYS 65 Cb 0.39 -0.20 -0.02 0.00 -0.90 0.00 0.00 32.23 31.50 2qeu h LYS 65 CO -0.23 0.59 -0.94 1.88 -2.00 0.00 0.00 179.45 178.74 2qeu h TYR 66 N 0.92 0.16 -0.03 0.07 0.05 -1.48 -0.91 116.97 115.74 2qeu h TYR 66 Ca 0.42 -0.10 0.02 0.00 0.05 0.00 0.00 58.73 59.12 2qeu h TYR 66 Cb 0.39 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.09 2qeu h TYR 66 CO -0.00 0.98 -0.10 0.87 -1.05 0.00 0.00 178.16 178.86 2qeu h LYS 67 N 0.04 -0.15 -0.08 4.88 1.57 -0.86 -0.56 116.57 121.41 2qeu h LYS 67 Ca -0.04 0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2qeu h LYS 67 Cb 1.63 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.96 2qeu h LYS 67 CO 0.13 -0.10 -0.37 0.45 -0.57 0.00 0.00 179.45 178.99 2qeu h HIS 68 N -0.15 0.18 -0.63 -1.35 3.86 -1.22 -2.37 115.15 113.47 2qeu h HIS 68 Ca 0.05 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2qeu h HIS 68 Cb 0.22 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 28.61 2qeu h HIS 68 CO -0.18 0.52 0.41 1.25 0.86 0.00 0.00 177.93 180.79 2qeu h LEU 69 N 0.14 0.73 -0.70 2.43 5.85 -0.88 0.16 115.31 123.04 2qeu h LEU 69 Ca 0.01 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.77 2qeu h LEU 69 Cb 0.73 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.52 2qeu h LEU 69 CO 0.05 0.53 0.40 0.40 -0.34 0.00 0.00 178.44 179.49 2qeu h ILE 70 N 0.86 0.98 -0.38 4.05 2.04 -0.77 -1.32 117.51 122.97 2qeu h ILE 70 Ca 0.23 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.77 2qeu h ILE 70 Cb -0.09 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.16 2qeu h ILE 70 CO -0.05 0.13 -0.05 -0.07 0.00 0.00 0.00 178.15 178.12 2qeu h LEU 71 N 0.73 0.60 0.05 1.44 3.38 -0.90 -0.75 115.31 119.87 2qeu h LEU 71 Ca 0.31 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2qeu h LEU 71 Cb 0.18 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2qeu h LEU 71 CO -0.18 0.70 -0.06 0.58 0.09 0.00 0.00 178.44 179.57 2qeu h VAL 72 N 0.59 0.86 -0.56 1.22 2.07 -0.01 0.90 116.25 121.31 2qeu h VAL 72 Ca 0.11 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 2qeu h VAL 72 Cb 0.44 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2qeu h VAL 72 CO 0.02 0.00 0.24 0.58 0.02 0.00 0.00 177.57 178.43 2qeu h VAL 73 N -0.13 1.22 -0.72 2.57 2.07 -0.77 0.29 116.25 120.78 2qeu h VAL 73 Ca 0.01 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2qeu h VAL 73 Cb 0.13 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2qeu h VAL 73 CO -0.02 0.26 0.46 -0.07 0.02 0.00 0.00 177.57 178.22 2qeu h LEU 74 N 0.77 0.83 -1.34 2.57 3.38 -1.00 -1.31 115.31 119.22 2qeu h LEU 74 Ca 0.19 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 2qeu h LEU 74 Cb 0.18 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2qeu h LEU 74 CO -0.02 0.62 -0.15 0.44 0.09 0.00 0.00 178.44 179.42 2qeu h ASP 75 N 0.97 0.24 0.05 -0.43 3.32 -0.34 -0.26 116.42 119.97 2qeu h ASP 75 Ca 0.26 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2qeu h ASP 75 Cb -0.09 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 2qeu h ASP 75 CO -0.05 0.42 -0.04 0.00 -1.72 0.00 0.00 179.24 177.84 2qeu h ALA 76 N 1.61 -0.09 0.00 3.45 0.00 -0.27 -0.35 119.26 123.61 2qeu h ALA 76 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qeu h ALA 76 Cb 0.42 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2qeu h ALA 76 CO 0.03 -0.56 0.00 -0.84 0.00 0.00 0.00 179.25 177.88 2qeu h ILE 77 N -0.10 0.00 -0.02 0.00 3.07 -0.85 -2.78 117.51 116.84 2qeu h ILE 77 Ca -0.00 -0.63 0.00 0.00 1.55 0.00 0.00 64.86 65.78 2qeu h ILE 77 Cb 0.09 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.26 2qeu h ILE 77 CO -0.00 0.00 -0.20 -1.14 -1.05 0.00 0.00 178.15 175.76 2qeu n ARG 78 N -3.05 1.48 -3.58 0.16 3.00 -0.15 -4.98 116.66 109.54 2qeu n ARG 78 Ca 0.02 -1.08 -0.27 0.00 -0.00 0.00 0.00 57.85 56.52 2qeu n ARG 78 Cb 0.36 -1.48 0.05 0.00 0.00 0.00 0.00 32.46 31.39 2qeu n ARG 78 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2qeu n ASP 79 N 0.18 -5.69 -3.98 6.15 8.00 -0.50 -4.96 116.55 115.76 2qeu n ASP 79 Ca 0.13 -0.92 -0.31 0.00 0.71 0.00 0.00 54.79 54.40 2qeu n ASP 79 Cb 0.44 -3.75 -0.10 0.00 -0.02 0.00 0.00 41.12 37.70 2qeu n ASP 79 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qeu n GLU 80 N -3.86 2.19 0.21 -1.24 -0.58 -0.26 -4.97 120.64 112.13 2qeu n GLU 80 Ca -0.09 -4.50 0.04 0.00 -0.42 0.00 0.00 57.16 52.20 2qeu n GLU 80 Cb 0.59 -2.34 0.45 0.00 -0.57 0.00 0.00 31.44 29.57 2qeu n GLU 80 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2qeu h PRO 81 N 5.59 0.00 0.11 3.49 0.13 -1.93 0.21 132.00 139.60 2qeu h PRO 81 Ca 0.16 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.28 2qeu h PRO 81 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2qeu h PRO 81 CO 0.78 0.27 -0.05 0.82 -0.23 0.00 0.00 178.00 179.59 2qeu h ILE 82 N 0.00 1.09 -0.98 -3.56 1.08 -1.98 -2.99 117.51 110.17 2qeu h ILE 82 Ca -0.00 -1.16 0.07 0.00 -0.39 0.00 0.00 64.86 63.38 2qeu h ILE 82 Cb 0.49 1.78 -0.07 0.00 -3.07 0.00 0.00 36.82 35.96 2qeu h ILE 82 CO 0.04 0.26 0.62 1.23 -0.69 0.00 0.00 178.15 179.61 2qeu h GLY 83 N -0.73 1.50 1.03 5.37 0.00 -1.94 -0.95 103.07 107.35 2qeu h GLY 83 Ca -0.02 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 46.83 2qeu h GLY 83 CO 0.02 0.30 0.32 1.19 0.00 0.00 0.00 176.54 178.38 2qeu h ILE 84 N 1.11 1.25 -0.18 2.60 2.10 -0.63 0.34 117.51 124.10 2qeu h ILE 84 Ca 0.43 -0.76 -0.12 0.00 1.08 0.00 0.00 64.86 65.49 2qeu h ILE 84 Cb 0.21 0.35 0.00 0.00 -1.09 0.00 0.00 36.82 36.29 2qeu h ILE 84 CO -0.19 0.31 -0.35 0.58 -1.08 0.00 0.00 178.15 177.43 2qeu h VAL 85 N 1.07 1.34 -0.68 2.19 2.07 -1.34 -0.72 116.25 120.19 2qeu h VAL 85 Ca 0.25 -1.58 0.08 0.00 0.82 0.00 0.00 66.70 66.27 2qeu h VAL 85 Cb 0.18 1.90 -0.06 0.00 -1.52 0.00 0.00 31.29 31.79 2qeu h VAL 85 CO -0.02 0.48 0.35 0.78 0.02 0.00 0.00 177.57 179.18 2qeu h ASN 86 N 0.21 0.47 0.57 0.57 2.35 -0.74 -0.68 115.58 118.33 2qeu h ASN 86 Ca 0.01 0.05 -0.15 0.00 -0.55 0.00 0.00 56.30 55.66 2qeu h ASN 86 Cb 0.94 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.26 2qeu h ASN 86 CO 0.08 0.28 -0.66 0.45 -1.65 0.00 0.00 177.43 175.93 2qeu h HIS 87 N 0.61 0.11 0.00 1.19 3.86 -0.91 -1.47 115.15 118.55 2qeu h HIS 87 Ca 0.32 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 2qeu h HIS 87 Cb 0.30 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2qeu h HIS 87 CO -0.10 0.72 -0.00 1.15 0.86 0.00 0.00 177.93 180.56 2qeu h THR 88 N 0.06 1.10 -0.37 2.45 2.02 -0.62 0.18 112.91 117.74 2qeu h THR 88 Ca -0.01 -0.32 0.04 0.00 0.77 0.00 0.00 66.41 66.89 2qeu h THR 88 Cb 1.18 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 68.87 2qeu h THR 88 CO 0.09 0.08 0.14 -0.09 0.37 0.00 0.00 175.52 176.12 2qeu h ARG 89 N -0.14 0.30 -0.24 6.66 2.43 -1.12 -2.70 114.38 119.56 2qeu h ARG 89 Ca -0.00 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2qeu h ARG 89 Cb 0.14 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 2qeu h ARG 89 CO 0.00 0.20 0.07 0.00 -1.51 0.00 0.00 179.97 178.73 2qeu h ALA 90 N 1.23 0.26 0.00 2.80 0.00 -1.15 0.14 119.26 122.54 2qeu h ALA 90 Ca 0.17 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2qeu h ALA 90 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2qeu h ALA 90 CO -0.16 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 178.75 2qeu n ALA 91 N -2.28 1.09 0.00 0.00 0.00 0.63 -1.40 120.51 118.55 2qeu n ALA 91 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2qeu n ALA 91 Cb 0.09 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2qeu n ALA 91 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qeu n ASN 93 N 0.13 0.00 -0.49 0.00 3.02 0.48 -0.94 115.26 117.46 2qeu n ASN 93 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.65 2qeu n ASN 93 Cb 0.00 0.00 0.37 0.00 -0.61 0.00 0.00 39.78 39.54 2qeu n ASN 93 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qeu n ALA 94 N 0.00 2.52 0.00 5.41 0.00 -0.49 -4.92 120.51 123.03 2qeu n ALA 94 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.96 2qeu n ALA 94 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2qeu n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeu n GLY 95 N 1.07 0.84 3.75 0.00 0.00 -0.83 -4.42 105.19 105.61 2qeu n GLY 95 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2qeu n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qeu s LEU 96 N 0.00 4.42 0.52 0.99 2.96 -0.12 -5.01 118.68 122.44 2qeu s LEU 96 Ca 0.00 2.53 -0.11 0.00 -0.22 0.00 0.00 54.13 56.33 2qeu s LEU 96 Cb 0.00 -3.62 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 2qeu s LEU 96 CO 0.00 -0.54 0.91 -0.94 -1.32 0.00 0.00 176.35 174.46 2qeu s SER 97 N 0.04 6.39 0.23 3.68 1.04 -1.26 -4.85 113.70 118.97 2qeu s SER 97 Ca 0.54 1.29 -0.08 0.00 0.48 0.00 0.00 55.95 58.18 2qeu s SER 97 Cb -0.38 -2.40 0.24 0.00 0.10 0.00 0.00 66.02 63.58 2qeu s SER 97 CO 0.43 -0.64 1.87 0.58 0.98 0.00 0.00 173.24 176.47 2qeu h VAL 98 N 0.40 1.13 -0.55 5.02 2.07 -1.94 -1.26 116.25 121.12 2qeu h VAL 98 Ca -0.46 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 66.77 2qeu h VAL 98 Cb 1.19 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 2qeu h VAL 98 CO 0.62 0.19 0.24 0.44 0.02 0.00 0.00 177.57 179.08 2qeu h ASP 99 N 1.03 0.29 -0.61 0.57 3.32 -2.00 -1.03 116.42 117.99 2qeu h ASP 99 Ca 0.33 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.37 2qeu h ASP 99 Cb 0.00 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2qeu h ASP 99 CO -0.11 0.19 0.17 -0.33 -1.72 0.00 0.00 179.24 177.44 2qeu h GLU 100 N 0.45 0.99 -0.03 3.56 5.08 -1.86 -1.66 114.58 121.12 2qeu h GLU 100 Ca 0.26 -0.21 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2qeu h GLU 100 Cb 0.25 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2qeu h GLU 100 CO -0.23 0.87 -0.08 1.25 -1.00 0.00 0.00 179.01 179.83 2qeu h LEU 101 N 0.95 -0.23 -0.24 1.33 5.85 -0.53 -1.32 115.31 121.13 2qeu h LEU 101 Ca 0.21 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 2qeu h LEU 101 Cb 0.31 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2qeu h LEU 101 CO -0.00 -0.11 0.14 0.40 -0.34 0.00 0.00 178.44 178.53 2qeu h ILE 102 N -0.12 1.10 -0.92 4.05 2.04 -1.07 -1.08 117.51 121.51 2qeu h ILE 102 Ca 0.04 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.73 2qeu h ILE 102 Cb 0.17 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 2qeu h ILE 102 CO -0.10 0.10 0.58 -0.33 0.00 0.00 0.00 178.15 178.39 2qeu h GLU 103 N 0.29 1.00 -0.10 2.37 5.08 -1.02 -1.80 114.58 120.39 2qeu h GLU 103 Ca 0.08 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2qeu h GLU 103 Cb 0.03 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 2qeu h GLU 103 CO -0.02 0.66 -0.03 0.78 -1.00 0.00 0.00 179.01 179.40 2qeu h GLY 104 N 1.03 0.22 0.86 -3.84 0.00 -0.91 -3.25 103.07 97.19 2qeu h GLY 104 Ca 0.41 -0.18 0.03 0.00 0.00 0.00 0.00 47.33 47.59 2qeu h GLY 104 CO -0.19 0.17 0.45 -2.22 0.00 0.00 0.00 176.54 174.75 2qeu h ILE 105 N -0.14 1.10 -0.79 2.60 2.04 -0.98 -2.47 117.51 118.87 2qeu h ILE 105 Ca 0.02 -0.30 0.17 0.00 1.00 0.00 0.00 64.86 65.75 2qeu h ILE 105 Cb 0.46 0.14 -0.05 0.00 -0.74 0.00 0.00 36.82 36.63 2qeu h ILE 105 CO 0.01 0.16 0.53 -0.07 0.00 0.00 0.00 178.15 178.78 2qeu h LEU 106 N 0.88 0.36 -2.03 1.44 3.38 -1.36 -1.63 115.31 116.35 2qeu h LEU 106 Ca 0.29 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 2qeu h LEU 106 Cb 0.02 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2qeu h LEU 106 CO -0.11 0.17 -0.09 -0.07 0.09 0.00 0.00 178.44 178.43 2qeu h LEU 107 N 0.38 0.00 -2.05 1.67 3.38 -1.48 -1.16 115.31 116.05 2qeu h LEU 107 Ca 0.39 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.46 2qeu h LEU 107 Cb 0.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2qeu h LEU 107 CO -0.12 0.09 0.27 1.23 0.09 0.00 0.00 178.44 180.00 2qeu h GLY 108 N 0.51 0.00 1.38 0.83 0.00 -1.40 -1.86 103.07 102.52 2qeu h GLY 108 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2qeu h GLY 108 CO 0.01 0.00 0.18 -2.22 0.00 0.00 0.00 176.54 174.51 2qeu h ILE 109 N 0.00 1.21 -0.25 2.60 2.04 -1.35 0.10 117.51 121.86 2qeu h ILE 109 Ca 0.16 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.37 2qeu h ILE 109 Cb 0.70 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 2qeu h ILE 109 CO -0.00 0.27 -0.01 0.40 0.00 0.00 0.00 178.15 178.80 2qeu h ILE 110 N 0.78 0.81 0.00 -0.67 2.04 -1.48 -0.15 117.51 118.83 2qeu h ILE 110 Ca 0.18 -0.02 -0.27 0.00 1.00 0.00 0.00 64.86 65.75 2qeu h ILE 110 Cb 0.21 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 2qeu h ILE 110 CO -0.01 0.01 -1.77 0.52 0.00 0.00 0.00 178.15 176.90 2qeu n VAL 111 N -5.17 1.44 -0.29 1.67 0.31 -1.11 -4.55 118.33 110.64 2qeu n VAL 111 Ca -0.01 -0.78 0.00 0.00 -0.01 0.00 0.00 64.34 63.54 2qeu n VAL 111 Cb 0.14 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 2qeu n VAL 111 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2qeu n TYR 112 N -2.94 0.00 0.00 3.52 4.01 0.34 -5.14 117.16 116.95 2qeu n TYR 112 Ca -0.18 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 2qeu n TYR 112 Cb 1.01 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 40.02 2qeu n TYR 112 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qeu n GLY 113 N -0.27 1.67 1.48 2.72 0.00 -0.07 -4.10 105.19 106.63 2qeu n GLY 113 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2qeu n GLY 113 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qeu n PRO 115 N 0.00 0.00 0.19 1.61 -0.02 -1.26 -4.09 135.00 131.42 2qeu n PRO 115 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.60 2qeu n PRO 115 Cb 0.00 0.00 0.67 0.00 -0.02 0.00 0.00 33.50 34.15 2qeu n PRO 115 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qeu h ALA 116 N 0.00 2.13 0.00 3.55 0.00 -1.86 -2.31 119.26 120.77 2qeu h ALA 116 Ca 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 2qeu h ALA 116 Cb 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2qeu h ALA 116 CO 0.00 -0.20 -1.56 1.87 0.00 0.00 0.00 179.25 179.37 2qeu n TRP 117 N -4.46 0.75 0.01 0.00 -0.00 -1.26 -3.23 117.44 109.26 2qeu n TRP 117 Ca 0.01 0.33 -0.06 0.00 -0.00 0.00 0.00 57.50 57.78 2qeu n TRP 117 Cb 0.24 -1.06 0.14 0.00 -0.00 0.00 0.00 31.31 30.63 2qeu n TRP 117 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 2qeu h GLY 118 N -1.00 0.56 0.00 5.87 0.00 -1.88 0.14 103.07 106.75 2qeu h GLY 118 Ca -0.42 -0.53 -0.09 0.00 0.00 0.00 0.00 47.33 46.29 2qeu h GLY 118 CO -0.26 0.48 -0.56 1.70 0.00 0.00 0.00 176.54 177.90 2qeu h LYS 119 N 0.43 0.00 0.00 4.80 3.64 -1.72 -3.45 116.57 120.27 2qeu h LYS 119 Ca 0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2qeu h LYS 119 Cb 0.84 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2qeu h LYS 119 CO 0.07 0.67 -0.69 2.41 -2.27 0.00 0.00 179.45 179.64 2qeu n THR 120 N -4.57 0.00 -0.24 1.00 -1.04 -1.26 -4.83 114.28 103.35 2qeu n THR 120 Ca -0.16 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.87 2qeu n THR 120 Cb 0.44 -0.46 0.15 0.00 -1.82 0.00 0.00 70.33 68.64 2qeu n THR 120 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2qeu h GLY 121 N 0.00 1.04 2.00 3.41 0.00 -1.51 0.05 103.07 108.05 2qeu h GLY 121 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 2qeu h GLY 121 CO 0.00 -0.01 -0.07 0.07 0.00 0.00 0.00 176.54 176.53 2qeu h ARG 122 N 0.50 0.00 -0.11 4.80 0.11 -0.98 -2.18 114.38 116.52 2qeu h ARG 122 Ca 0.36 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.39 2qeu h ARG 122 Cb 0.46 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.52 2qeu h ARG 122 CO -0.32 0.07 -0.18 0.87 0.10 0.00 0.00 179.97 180.51 2qeu h LYS 123 N 0.00 0.18 -0.84 0.08 1.57 -1.24 -1.36 116.57 114.97 2qeu h LYS 123 Ca -0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2qeu h LYS 123 Cb 0.28 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2qeu h LYS 123 CO 0.01 0.37 0.47 0.00 -0.57 0.00 0.00 179.45 179.73 2qeu h ALA 124 N 1.65 1.26 -0.12 3.86 0.00 -1.45 -1.29 119.26 123.16 2qeu h ALA 124 Ca 0.03 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2qeu h ALA 124 Cb 0.43 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2qeu h ALA 124 CO 0.03 0.61 -0.37 0.28 0.00 0.00 0.00 179.25 179.80 2qeu h VAL 125 N 1.16 1.37 -0.27 0.00 2.07 -1.41 0.18 116.25 119.34 2qeu h VAL 125 Ca 0.30 -1.69 0.06 0.00 0.82 0.00 0.00 66.70 66.19 2qeu h VAL 125 Cb 0.00 2.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.84 2qeu h VAL 125 CO -0.05 0.50 -0.10 0.74 0.02 0.00 0.00 177.57 178.68 2qeu h THR 126 N 0.06 0.65 -0.37 2.57 2.02 -1.15 -1.00 112.91 115.70 2qeu h THR 126 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.20 2qeu h THR 126 Cb 1.00 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.02 2qeu h THR 126 CO 0.08 0.00 0.16 0.15 0.37 0.00 0.00 175.52 176.28 2qeu h PHE 127 N -0.05 0.29 -0.83 3.16 3.57 -1.22 -3.23 116.94 118.63 2qeu h PHE 127 Ca 0.14 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2qeu h PHE 127 Cb 0.26 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 2qeu h PHE 127 CO -0.30 0.14 0.48 0.00 -2.23 0.00 0.00 178.31 176.40 2qeu h ALA 128 N 1.21 1.06 -0.89 2.41 0.00 -0.07 0.12 119.26 123.11 2qeu h ALA 128 Ca 0.16 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2qeu h ALA 128 Cb 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 2qeu h ALA 128 CO -0.14 0.55 0.59 0.28 0.00 0.00 0.00 179.25 180.53 2qeu h VAL 129 N 1.15 1.16 0.10 0.00 2.07 -1.23 0.84 116.25 120.33 2qeu h VAL 129 Ca 0.30 -0.39 -0.26 0.00 0.82 0.00 0.00 66.70 67.17 2qeu h VAL 129 Cb -0.00 -0.07 0.03 0.00 -1.52 0.00 0.00 31.29 29.73 2qeu h VAL 129 CO -0.05 0.21 -1.06 -0.33 0.02 0.00 0.00 177.57 176.36 2qeu h GLU 130 N 1.13 0.55 -0.02 1.57 4.39 -1.44 -3.32 114.58 117.44 2qeu h GLU 130 Ca 0.35 -0.72 -0.07 0.00 0.34 0.00 0.00 59.36 59.27 2qeu h GLU 130 Cb -0.01 0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2qeu h GLU 130 CO -0.10 1.31 -0.30 0.35 -1.16 0.00 0.00 179.01 179.11 2qeu h PHE 131 N 0.12 0.03 -0.69 4.33 3.57 -0.37 -1.63 116.94 122.31 2qeu h PHE 131 Ca -0.16 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.36 2qeu h PHE 131 Cb 1.76 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 40.45 2qeu h PHE 131 CO 0.13 0.33 0.44 1.49 -2.23 0.00 0.00 178.31 178.47 2qeu h GLU 132 N 0.03 0.86 -0.16 1.11 4.81 -0.94 0.24 114.58 120.52 2qeu h GLU 132 Ca 0.00 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 2qeu h GLU 132 Cb 0.54 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2qeu h GLU 132 CO 0.04 0.57 -0.58 0.87 -0.73 0.00 0.00 179.01 179.18 2qeu h LYS 133 N 0.89 0.51 0.03 1.92 1.57 -1.49 -2.09 116.57 117.91 2qeu h LYS 133 Ca 0.27 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qeu h LYS 133 Cb -0.04 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2qeu h LYS 133 CO -0.08 0.94 -0.01 1.49 -0.57 0.00 0.00 179.45 181.21 2qeu h GLU 134 N 0.39 -0.04 -0.32 3.15 4.81 -0.71 -1.94 114.58 119.91 2qeu h GLU 134 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2qeu h GLU 134 Cb 1.12 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.47 2qeu h GLU 134 CO 0.11 0.12 0.09 -0.07 -0.73 0.00 0.00 179.01 178.52 2qeu h LEU 135 N -0.19 0.07 -1.66 1.64 3.38 -0.52 -1.67 115.31 116.36 2qeu h LEU 135 Ca -0.00 0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.13 2qeu h LEU 135 Cb 0.18 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2qeu h LEU 135 CO 0.01 0.07 0.43 0.00 0.09 0.00 0.00 178.44 179.04 2qeu h ALA 136 N 1.22 2.10 -0.00 1.53 0.00 -1.25 -0.90 119.26 121.96 2qeu h ALA 136 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qeu h ALA 136 Cb 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2qeu h ALA 136 CO -0.17 -0.26 -0.04 0.41 0.00 0.00 0.00 179.25 179.19 2qeu n GLY 137 N -1.53 -1.04 0.12 0.00 0.00 -0.65 -3.56 105.19 98.53 2qeu n GLY 137 Ca 0.11 -0.21 0.04 0.00 0.00 0.00 0.00 46.02 45.96 2qeu n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qeu n LYS 138 N -1.04 2.98 -4.23 1.61 5.02 -0.37 -5.04 118.16 117.09 2qeu n LYS 138 Ca 0.17 -0.34 -0.21 0.00 -2.02 0.00 0.00 58.31 55.90 2qeu n LYS 138 Cb 0.23 -0.98 -0.12 0.00 -0.02 0.00 0.00 35.03 34.13 2qeu n LYS 138 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2qeu s ARG 139 N -1.46 0.99 0.00 1.97 0.52 -1.05 -5.11 118.95 114.82 2qeu s ARG 139 Ca 0.06 -1.07 0.10 0.00 -0.52 0.00 0.00 55.73 54.29 2qeu s ARG 139 Cb 0.07 -1.13 0.58 0.00 0.52 0.00 0.00 34.95 34.99 2qeu s ARG 139 CO 0.27 0.26 1.03 2.41 0.02 0.00 0.00 175.30 179.28