#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nln n ILE 2 N 0.00 0.24 0.00 -1.33 2.08 -1.26 -4.37 119.36 114.72 2nln n ILE 2 Ca 0.00 -0.54 0.00 0.00 0.56 0.00 0.00 62.75 62.77 2nln n ILE 2 Cb 0.00 0.99 0.00 0.00 -0.75 0.00 0.00 39.64 39.88 2nln n ILE 2 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2nln n THR 3 N 1.10 0.00 0.00 1.39 -2.24 -1.26 -4.97 114.28 108.30 2nln n THR 3 Ca 0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 2nln n THR 3 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2nln n THR 3 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2nln n ASP 4 N 0.00 0.00 -3.78 3.42 9.92 -1.26 -4.28 116.55 120.57 2nln n ASP 4 Ca 0.00 0.78 -0.29 0.00 -0.53 0.00 0.00 54.79 54.76 2nln n ASP 4 Cb 0.00 -0.28 -0.12 0.00 -0.64 0.00 0.00 41.12 40.07 2nln n ASP 4 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2nln s ILE 5 N -2.13 2.02 0.01 0.53 1.09 -1.26 -5.06 121.20 116.39 2nln s ILE 5 Ca 0.00 -3.33 -0.30 0.00 -1.10 0.00 0.00 60.65 55.92 2nln s ILE 5 Cb 0.00 -2.37 0.11 0.00 -1.06 0.00 0.00 42.46 39.14 2nln s ILE 5 CO 0.00 -0.96 1.25 -1.48 -0.10 0.00 0.00 174.94 173.64 2nln s LEU 6 N -0.46 -0.07 -0.17 2.97 -0.00 -1.26 -4.87 118.68 114.82 2nln s LEU 6 Ca 0.22 -0.17 -0.29 0.00 -0.00 0.00 0.00 54.13 53.89 2nln s LEU 6 Cb -0.14 1.48 -0.03 0.00 -0.00 0.00 0.00 46.19 47.50 2nln s LEU 6 CO -0.09 -0.38 1.64 -0.44 -0.00 0.00 0.00 176.35 177.08 2nln s SER 7 N -3.00 6.44 0.19 1.48 0.01 -1.26 -4.83 113.70 112.73 2nln s SER 7 Ca 0.14 1.80 -0.09 0.00 1.31 0.00 0.00 55.95 59.11 2nln s SER 7 Cb 0.04 -2.53 0.09 0.00 0.21 0.00 0.00 66.02 63.83 2nln s SER 7 CO -0.03 -1.18 1.68 0.00 0.41 0.00 0.00 173.24 174.12 2nln h ALA 8 N 10.48 0.88 0.27 1.44 0.00 -1.97 -3.04 119.26 127.32 2nln h ALA 8 Ca -0.35 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 2nln h ALA 8 Cb 1.16 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2nln h ALA 8 CO 0.99 0.67 -0.13 0.93 0.00 0.00 0.00 179.25 181.71 2nln h GLU 9 N 1.03 -0.34 -0.06 0.00 4.39 -2.01 -2.74 114.58 114.84 2nln h GLU 9 Ca 0.20 0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.94 2nln h GLU 9 Cb 0.48 0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2nln h GLU 9 CO 0.02 -0.05 0.30 -0.44 -1.16 0.00 0.00 179.01 177.68 2nln h ASP 10 N -0.64 0.00 -0.10 1.42 5.19 -1.95 0.01 116.42 120.35 2nln h ASP 10 Ca -0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.37 2nln h ASP 10 Cb 0.45 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.96 2nln h ASP 10 CO 0.06 0.00 0.03 0.40 -3.12 0.00 0.00 179.24 176.61 2nln h ILE 11 N 0.00 1.17 -0.18 0.35 2.04 -1.36 1.02 117.51 120.55 2nln h ILE 11 Ca 0.03 -0.51 0.05 0.00 1.00 0.00 0.00 64.86 65.43 2nln h ILE 11 Cb 0.63 1.32 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 2nln h ILE 11 CO -0.00 0.15 -0.17 0.00 0.00 0.00 0.00 178.15 178.13 2nln h ALA 12 N 0.85 -0.06 -0.22 1.87 0.00 -1.03 1.09 119.26 121.76 2nln h ALA 12 Ca 0.03 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2nln h ALA 12 Cb 0.21 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2nln h ALA 12 CO -0.00 -0.61 0.07 0.00 0.00 0.00 0.00 179.25 178.71 2nln h ALA 13 N 0.89 0.29 -0.49 0.00 0.00 -1.48 1.28 119.26 119.75 2nln h ALA 13 Ca 0.11 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2nln h ALA 13 Cb 0.36 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.97 2nln h ALA 13 CO -0.29 -0.08 -0.17 0.00 0.00 0.00 0.00 179.25 178.71 2nln h ALA 14 N 0.89 0.24 0.26 0.00 0.00 0.19 1.20 119.26 122.04 2nln h ALA 14 Ca 0.07 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2nln h ALA 14 Cb 0.23 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2nln h ALA 14 CO -0.00 -0.49 -0.13 1.25 0.00 0.00 0.00 179.25 179.88 2nln h LEU 15 N -0.05 -0.30 0.00 0.00 6.46 0.15 -2.78 115.31 118.79 2nln h LEU 15 Ca 0.23 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 2nln h LEU 15 Cb 0.41 0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 2nln h LEU 15 CO -0.53 0.20 0.00 0.00 -0.62 0.00 0.00 178.44 177.49 2nln n GLN 16 N -5.01 0.21 0.00 1.25 3.00 0.44 -3.27 117.38 114.00 2nln n GLN 16 Ca -0.07 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 2nln n GLN 16 Cb 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.97 2nln n GLN 16 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2nln n GLU 17 N -1.16 0.00 -0.10 -1.09 4.07 0.41 -4.42 120.64 118.35 2nln n GLU 17 Ca 0.06 0.16 0.07 0.00 -0.06 0.00 0.00 57.16 57.39 2nln n GLU 17 Cb 0.06 -1.06 0.12 0.00 -0.06 0.00 0.00 31.44 30.50 2nln n GLU 17 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2nln n GLN 19 N 0.75 0.50 0.00 0.00 7.27 -1.20 -4.51 117.38 120.19 2nln n GLN 19 Ca 0.11 0.18 0.00 0.00 0.07 0.00 0.00 57.00 57.36 2nln n GLN 19 Cb 0.39 -1.34 0.00 0.00 2.41 0.00 0.00 30.24 31.70 2nln n GLN 19 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2nln n ASP 20 N 1.66 0.00 -3.31 1.69 8.00 -1.26 -4.85 116.55 118.48 2nln n ASP 20 Ca 0.14 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.25 2nln n ASP 20 Cb 0.31 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 2nln n ASP 20 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2nln n PRO 21 N -0.26 3.88 0.03 -0.24 -0.04 -1.26 -2.45 135.00 134.66 2nln n PRO 21 Ca 0.00 -2.50 0.00 0.00 -0.04 0.00 0.00 63.50 60.96 2nln n PRO 21 Cb 0.00 -2.73 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 2nln n PRO 21 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2nln n ASP 22 N 3.03 -0.53 0.01 3.54 -0.08 -1.26 -4.07 116.55 117.19 2nln n ASP 22 Ca 0.73 0.41 -0.11 0.00 -1.51 0.00 0.00 54.79 54.31 2nln n ASP 22 Cb 0.26 0.81 -0.09 0.00 2.34 0.00 0.00 41.12 44.44 2nln n ASP 22 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2nln h THR 23 N 0.00 1.11 0.00 5.18 1.03 -1.82 -3.39 112.91 115.02 2nln h THR 23 Ca 0.00 -1.40 0.00 0.00 -0.01 0.00 0.00 66.41 65.00 2nln h THR 23 Cb 0.00 1.92 0.00 0.00 -1.07 0.00 0.00 68.15 69.00 2nln h THR 23 CO 0.00 0.31 0.00 0.33 -0.01 0.00 0.00 175.52 176.15 2nln n PHE 24 N -4.83 0.00 -0.01 0.00 7.35 -1.03 -4.35 117.46 114.59 2nln n PHE 24 Ca -0.08 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.56 2nln n PHE 24 Cb 0.29 -0.02 -0.12 0.00 0.35 0.00 0.00 39.48 39.98 2nln n PHE 24 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2nln n GLU 25 N -0.92 0.64 -0.00 -4.13 0.00 -1.26 -4.38 120.64 110.58 2nln n GLU 25 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 57.16 57.36 2nln n GLU 25 Cb 0.00 -1.75 -0.01 0.00 0.00 0.00 0.00 31.44 29.69 2nln n GLU 25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 2nln h PRO 26 N 0.00 -0.03 -0.75 3.44 0.11 -1.94 0.83 132.00 133.66 2nln h PRO 26 Ca -0.27 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.85 2nln h PRO 26 Cb 1.85 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.93 2nln h PRO 26 CO 0.06 -0.02 0.50 1.96 -0.21 0.00 0.00 178.00 180.28 2nln h GLN 27 N -0.03 0.98 -0.43 1.05 4.20 -1.89 -1.31 115.11 117.67 2nln h GLN 27 Ca 0.00 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 2nln h GLN 27 Cb 0.04 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 2nln h GLN 27 CO -0.03 0.65 0.05 0.87 -0.67 0.00 0.00 178.83 179.69 2nln h LYS 28 N 1.01 0.73 -0.33 1.46 1.79 -1.70 0.49 116.57 120.02 2nln h LYS 28 Ca 0.28 -0.21 0.07 0.00 -2.18 0.00 0.00 60.65 58.61 2nln h LYS 28 Cb -0.11 -0.08 -0.08 0.00 -1.58 0.00 0.00 32.23 30.39 2nln h LYS 28 CO -0.06 0.78 -0.18 0.35 -1.08 0.00 0.00 179.45 179.25 2nln h PHE 29 N 0.58 -0.46 0.34 -1.35 3.04 0.11 -2.23 116.94 116.98 2nln h PHE 29 Ca 0.13 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 2nln h PHE 29 Cb 0.42 0.26 0.00 0.00 2.56 0.00 0.00 35.95 39.19 2nln h PHE 29 CO 0.03 -0.26 -0.17 0.74 -2.02 0.00 0.00 178.31 176.63 2nln h PHE 30 N -0.14 -0.43 0.24 0.41 0.04 -0.98 -3.29 116.94 112.79 2nln h PHE 30 Ca 0.17 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 2nln h PHE 30 Cb 0.40 0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 2nln h PHE 30 CO -0.39 -0.14 -0.21 0.37 -0.60 0.00 0.00 178.31 177.34 2nln h GLN 31 N -1.03 -0.42 -0.45 1.51 5.75 -0.01 1.73 115.11 122.19 2nln h GLN 31 Ca -0.05 0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.56 2nln h GLN 31 Cb 0.48 0.10 -0.09 0.00 1.07 0.00 0.00 27.48 29.03 2nln h GLN 31 CO 0.08 -0.28 -0.42 1.15 -2.65 0.00 0.00 178.83 176.71 2nln h THR 32 N -0.44 0.12 0.00 2.39 2.02 -1.59 -2.12 112.91 113.29 2nln h THR 32 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2nln h THR 32 Cb 0.37 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2nln h THR 32 CO -0.01 0.00 -0.00 -1.28 0.37 0.00 0.00 175.52 174.60 2nln h SER 33 N -0.29 0.00 0.00 4.18 0.87 -1.62 -3.44 113.55 113.25 2nln h SER 33 Ca 0.15 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2nln h SER 33 Cb 0.57 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 2nln h SER 33 CO -0.60 0.37 -0.32 0.61 -0.53 0.00 0.00 176.83 176.36 2nln n GLY 34 N 1.84 -0.51 0.31 5.77 0.00 0.40 -4.53 105.19 108.46 2nln n GLY 34 Ca -0.00 -0.11 0.23 0.00 0.00 0.00 0.00 46.02 46.14 2nln n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nln n LEU 35 N -3.15 0.14 -0.48 0.99 4.32 0.49 -0.93 117.00 118.38 2nln n LEU 35 Ca -0.05 1.55 0.37 0.00 -0.02 0.00 0.00 56.01 57.86 2nln n LEU 35 Cb 0.17 -0.67 0.59 0.00 -1.62 0.00 0.00 43.42 41.89 2nln n LEU 35 CO 0.07 -1.66 1.06 -1.54 -1.22 0.00 0.00 177.39 174.10 2nln n SER 36 N -5.20 0.06 0.00 -1.43 3.41 -0.80 -3.42 113.62 106.25 2nln n SER 36 Ca 0.29 0.86 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 2nln n SER 36 Cb 0.98 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 2nln n SER 36 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2nln n LYS 37 N -3.73 1.05 -1.42 4.33 4.76 -0.11 -5.12 118.16 117.92 2nln n LYS 37 Ca 0.33 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.36 2nln n LYS 37 Cb 1.42 -0.39 0.01 0.00 -1.84 0.00 0.00 35.03 34.23 2nln n LYS 37 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2nln n MET 38 N -0.39 0.44 -1.27 1.97 2.81 -0.94 -4.95 117.12 114.79 2nln n MET 38 Ca 0.00 0.16 -0.29 0.00 -1.81 0.00 0.00 57.70 55.76 2nln n MET 38 Cb 0.00 -1.43 0.18 0.00 -0.71 0.00 0.00 33.22 31.26 2nln n MET 38 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2nln s SER 39 N -1.00 2.47 0.14 7.83 0.01 -1.26 -4.90 113.70 117.00 2nln s SER 39 Ca 0.63 0.97 -0.15 0.00 1.31 0.00 0.00 55.95 58.71 2nln s SER 39 Cb -0.57 -1.50 0.01 0.00 0.21 0.00 0.00 66.02 64.17 2nln s SER 39 CO 0.59 -3.20 1.68 0.00 0.41 0.00 0.00 173.24 172.72 2nln h ALA 40 N -1.94 0.58 -0.28 1.44 0.00 -1.95 -3.27 119.26 113.83 2nln h ALA 40 Ca -0.52 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.28 2nln h ALA 40 Cb 1.32 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 2nln h ALA 40 CO 0.54 0.20 -0.55 0.66 0.00 0.00 0.00 179.25 180.09 2nln h SER 41 N 0.57 -1.79 -0.49 0.00 4.64 -2.01 0.25 113.55 114.72 2nln h SER 41 Ca 0.15 0.23 0.14 0.00 -0.47 0.00 0.00 61.79 61.83 2nln h SER 41 Cb 0.21 0.72 -0.02 0.00 -0.31 0.00 0.00 62.40 63.00 2nln h SER 41 CO -0.01 -0.44 0.40 0.06 -0.87 0.00 0.00 176.83 175.97 2nln h GLN 42 N -0.49 0.00 -0.30 4.77 -0.00 -1.94 0.25 115.11 117.40 2nln h GLN 42 Ca 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.70 2nln h GLN 42 Cb 0.64 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.10 2nln h GLN 42 CO -0.52 0.00 0.18 0.28 -0.00 0.00 0.00 178.83 178.77 2nln h VAL 43 N 0.00 1.09 -0.98 1.86 2.07 -0.55 0.17 116.25 119.90 2nln h VAL 43 Ca 0.23 -0.20 0.18 0.00 0.82 0.00 0.00 66.70 67.72 2nln h VAL 43 Cb 1.03 0.67 -0.09 0.00 -1.52 0.00 0.00 31.29 31.37 2nln h VAL 43 CO -0.00 0.09 0.61 0.11 0.02 0.00 0.00 177.57 178.40 2nln h LYS 44 N 0.41 0.73 -0.20 1.57 6.56 -0.32 0.44 116.57 125.76 2nln h LYS 44 Ca 0.11 -0.04 -0.21 0.00 -1.06 0.00 0.00 60.65 59.45 2nln h LYS 44 Cb -0.01 -0.16 0.01 0.00 -0.57 0.00 0.00 32.23 31.49 2nln h LYS 44 CO -0.02 0.48 -0.69 -0.44 -2.06 0.00 0.00 179.45 176.72 2nln h ASP 45 N 0.75 0.94 0.08 0.86 3.32 -1.10 -3.24 116.42 118.03 2nln h ASP 45 Ca 0.54 -0.57 0.02 0.00 0.02 0.00 0.00 57.03 57.04 2nln h ASP 45 Cb 0.85 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.08 2nln h ASP 45 CO -0.31 1.37 -0.39 0.40 -1.72 0.00 0.00 179.24 178.59 2nln h ILE 46 N 0.58 0.21 -0.71 0.35 5.03 0.44 -1.30 117.51 122.10 2nln h ILE 46 Ca -0.03 0.00 0.28 0.00 -0.12 0.00 0.00 64.86 64.99 2nln h ILE 46 Cb 1.31 0.21 -0.13 0.00 -3.03 0.00 0.00 36.82 35.18 2nln h ILE 46 CO 0.15 0.00 0.31 0.33 -0.68 0.00 0.00 178.15 178.25 2nln n PHE 47 N -5.45 0.76 0.03 1.37 7.35 0.81 0.16 117.46 122.49 2nln n PHE 47 Ca -0.07 0.85 0.14 0.00 -0.76 0.00 0.00 57.45 57.61 2nln n PHE 47 Cb 0.36 -1.22 0.60 0.00 0.35 0.00 0.00 39.48 39.57 2nln n PHE 47 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2nln h ARG 48 N 0.00 0.17 -0.47 -4.13 2.47 -1.31 -2.77 114.38 108.34 2nln h ARG 48 Ca 0.57 -0.01 0.07 0.00 -1.26 0.00 0.00 59.98 59.35 2nln h ARG 48 Cb 1.46 -0.04 -0.09 0.00 -1.65 0.00 0.00 29.97 29.65 2nln h ARG 48 CO -0.58 0.11 -0.48 0.27 0.56 0.00 0.00 179.97 179.86 2nln h PHE 49 N 0.17 -1.43 -0.16 3.04 -5.15 0.15 -3.41 116.94 110.16 2nln h PHE 49 Ca 0.20 0.08 0.00 0.00 -0.20 0.00 0.00 57.97 58.05 2nln h PHE 49 Cb 0.57 0.69 0.00 0.00 0.22 0.00 0.00 35.95 37.43 2nln h PHE 49 CO -0.00 -0.45 0.00 0.44 -2.00 0.00 0.00 178.31 176.30 2nln n ILE 50 N -5.40 0.00 -0.35 0.88 -5.35 -1.04 -4.86 119.36 103.24 2nln n ILE 50 Ca -0.01 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.18 2nln n ILE 50 Cb 0.35 -0.32 0.28 0.00 -1.74 0.00 0.00 39.64 38.20 2nln n ILE 50 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2nln n ASP 51 N 0.00 -3.13 -2.62 7.28 9.92 -1.26 -4.83 116.55 121.91 2nln n ASP 51 Ca 0.00 -0.55 -0.36 0.00 -0.53 0.00 0.00 54.79 53.35 2nln n ASP 51 Cb 0.00 -1.10 0.05 0.00 -0.64 0.00 0.00 41.12 39.43 2nln n ASP 51 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2nln n ASN 52 N -5.20 7.16 0.00 -2.24 2.85 -1.26 -4.69 115.26 111.87 2nln n ASN 52 Ca 0.08 -3.81 0.00 0.00 -0.11 0.00 0.00 54.58 50.74 2nln n ASN 52 Cb 0.57 -0.93 0.00 0.00 1.24 0.00 0.00 39.78 40.66 2nln n ASN 52 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2nln n ASP 53 N -0.67 0.00 0.00 1.20 8.00 -1.26 -4.84 116.55 118.98 2nln n ASP 53 Ca 0.55 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.05 2nln n ASP 53 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 2nln n ASP 53 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nln n GLN 54 N 0.00 0.00 -1.95 -1.24 6.02 -1.26 -2.30 117.38 116.66 2nln n GLN 54 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.98 2nln n GLN 54 Cb 0.00 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.29 2nln n GLN 54 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2nln n SER 55 N 0.77 -0.00 0.00 1.08 2.88 -1.26 -4.96 113.62 112.13 2nln n SER 55 Ca 0.00 -2.06 0.00 0.00 -1.33 0.00 0.00 58.87 55.48 2nln n SER 55 Cb 0.00 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 2nln n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2nln n GLY 56 N -0.38 2.79 3.67 0.46 0.00 -1.10 -5.01 105.19 105.63 2nln n GLY 56 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2nln n GLY 56 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2nln s TYR 57 N -2.63 -0.27 0.02 1.61 -0.85 -0.97 -4.98 117.35 109.28 2nln s TYR 57 Ca 0.00 -0.03 -0.00 0.00 -0.52 0.00 0.00 57.07 56.51 2nln s TYR 57 Cb 0.00 0.63 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 2nln s TYR 57 CO 0.00 -0.91 0.12 -0.51 -1.52 0.00 0.00 175.55 172.73 2nln s LEU 58 N -2.82 4.03 0.14 -3.49 1.43 -1.19 -4.56 118.68 112.23 2nln s LEU 58 Ca 0.08 0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 53.26 2nln s LEU 58 Cb -0.03 -2.46 -0.00 0.00 0.03 0.00 0.00 46.19 43.73 2nln s LEU 58 CO -0.01 0.24 0.28 -0.62 0.23 0.00 0.00 176.35 176.47 2nln s ASP 59 N -1.99 0.03 0.31 2.29 2.15 -1.26 0.15 116.67 118.34 2nln s ASP 59 Ca 0.26 -0.75 0.19 0.00 0.43 0.00 0.00 52.55 52.68 2nln s ASP 59 Cb -0.12 0.42 1.12 0.00 -0.30 0.00 0.00 42.92 44.04 2nln s ASP 59 CO 0.18 -0.86 1.28 0.61 -0.17 0.00 0.00 175.17 176.22 2nln n GLY 60 N -0.18 -0.62 0.12 2.66 0.00 -1.23 0.91 105.19 106.84 2nln n GLY 60 Ca -0.10 0.65 -0.17 0.00 0.00 0.00 0.00 46.02 46.40 2nln n GLY 60 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2nln h ASP 61 N 0.00 0.40 0.87 1.61 5.19 -1.96 -3.34 116.42 119.20 2nln h ASP 61 Ca 0.70 -0.81 -0.19 0.00 -0.62 0.00 0.00 57.03 56.10 2nln h ASP 61 Cb 1.91 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 41.27 2nln h ASP 61 CO -0.59 1.17 -0.91 -0.33 -3.12 0.00 0.00 179.24 175.46 2nln h GLU 62 N -0.31 0.02 -1.06 3.56 4.39 -0.53 -3.31 114.58 117.35 2nln h GLU 62 Ca -0.07 -0.03 0.29 0.00 0.34 0.00 0.00 59.36 59.89 2nln h GLU 62 Cb 1.27 0.01 -0.11 0.00 -0.10 0.00 0.00 28.75 29.81 2nln h GLU 62 CO 0.10 0.92 0.66 -0.07 -1.16 0.00 0.00 179.01 179.45 2nln h LEU 63 N 0.01 0.50 -2.78 1.33 3.38 0.41 1.10 115.31 119.26 2nln h LEU 63 Ca -0.02 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2nln h LEU 63 Cb 1.60 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.40 2nln h LEU 63 CO 0.12 0.03 -0.00 0.11 0.09 0.00 0.00 178.44 178.78 2nln h LYS 64 N 0.40 0.00 0.00 1.13 1.57 -1.74 -0.29 116.57 117.64 2nln h LYS 64 Ca 0.66 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 2nln h LYS 64 Cb 1.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.89 2nln h LYS 64 CO -0.41 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.14 2nln n TYR 65 N -3.15 0.83 -0.14 -1.35 4.01 0.38 -3.78 117.16 113.96 2nln n TYR 65 Ca -0.03 0.27 -0.07 0.00 -0.16 0.00 0.00 57.90 57.91 2nln n TYR 65 Cb 0.10 -0.95 -0.02 0.00 -0.31 0.00 0.00 39.34 38.17 2nln n TYR 65 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 2nln h PHE 66 N 0.00 -0.99 -0.00 -0.72 3.57 -1.11 1.28 116.94 118.96 2nln h PHE 66 Ca 0.00 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 2nln h PHE 66 Cb 0.58 0.50 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 2nln h PHE 66 CO 0.00 -0.40 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.36 2nln h LEU 67 N -0.25 0.00 -0.45 0.59 3.38 -1.78 -2.45 115.31 114.35 2nln h LEU 67 Ca 0.18 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 2nln h LEU 67 Cb 0.55 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2nln h LEU 67 CO -0.58 0.26 -0.42 1.56 0.09 0.00 0.00 178.44 179.35 2nln h GLN 68 N 0.00 0.82 -0.01 1.13 4.20 -0.01 1.60 115.11 122.85 2nln h GLN 68 Ca -0.00 -0.45 0.02 0.00 0.06 0.00 0.00 58.65 58.28 2nln h GLN 68 Cb 0.45 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 2nln h GLN 68 CO 0.03 1.08 -0.10 0.87 -0.67 0.00 0.00 178.83 180.05 2nln h LYS 69 N 0.67 -0.16 0.00 1.46 1.79 0.18 0.22 116.57 120.73 2nln h LYS 69 Ca 0.05 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.49 2nln h LYS 69 Cb 0.99 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.67 2nln h LYS 69 CO 0.10 -0.10 -0.51 0.35 -1.08 0.00 0.00 179.45 178.21 2nln h PHE 70 N -0.16 0.00 -0.00 -1.35 3.57 -1.51 -3.38 116.94 114.10 2nln h PHE 70 Ca 0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2nln h PHE 70 Cb 0.22 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.96 2nln h PHE 70 CO -0.17 0.35 -0.01 0.94 -2.23 0.00 0.00 178.31 177.19 2nln n GLN 71 N -4.62 0.97 -1.67 1.11 7.27 0.54 -4.90 117.38 116.09 2nln n GLN 71 Ca -0.10 -0.14 -0.01 0.00 0.07 0.00 0.00 57.00 56.82 2nln n GLN 71 Cb 0.30 -1.50 -0.00 0.00 2.41 0.00 0.00 30.24 31.45 2nln n GLN 71 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2nln n SER 72 N -0.89 -0.03 -0.62 1.69 7.64 0.77 -4.35 113.62 117.84 2nln n SER 72 Ca 0.21 -0.02 -0.02 0.00 1.01 0.00 0.00 58.87 60.05 2nln n SER 72 Cb 0.17 -0.03 -0.02 0.00 -1.01 0.00 0.00 64.21 63.32 2nln n SER 72 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2nln n ASP 73 N 0.68 -0.34 -4.74 6.43 2.03 -1.26 -5.00 116.55 114.36 2nln n ASP 73 Ca 0.00 -1.17 -0.34 0.00 0.52 0.00 0.00 54.79 53.80 2nln n ASP 73 Cb 0.01 0.10 0.07 0.00 -0.72 0.00 0.00 41.12 40.58 2nln n ASP 73 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2nln s ALA 74 N 0.00 2.25 -2.19 -1.67 0.00 -1.26 -4.91 121.76 113.99 2nln s ALA 74 Ca 0.00 0.83 0.25 0.00 0.00 0.00 0.00 51.96 53.04 2nln s ALA 74 Cb 0.00 -3.43 1.22 0.00 0.00 0.00 0.00 23.12 20.90 2nln s ALA 74 CO 0.00 -1.64 1.82 2.89 0.00 0.00 0.00 175.76 178.82 2nln n ARG 75 N -2.49 1.34 -1.50 0.00 -4.01 -1.26 -4.88 116.66 103.85 2nln n ARG 75 Ca 0.13 -0.50 0.00 0.00 -1.04 0.00 0.00 57.85 56.44 2nln n ARG 75 Cb 0.50 -1.42 0.00 0.00 -3.04 0.00 0.00 32.46 28.51 2nln n ARG 75 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 2nln n GLU 76 N -0.34 0.00 -1.80 2.89 1.02 -1.26 -4.29 120.64 116.86 2nln n GLU 76 Ca 0.18 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.26 2nln n GLU 76 Cb 0.21 -1.65 -0.01 0.00 -0.02 0.00 0.00 31.44 29.97 2nln n GLU 76 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2nln n LEU 77 N -0.47 -0.12 0.00 -4.62 4.77 -1.26 -4.64 117.00 110.66 2nln n LEU 77 Ca 0.00 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2nln n LEU 77 Cb 0.33 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 2nln n LEU 77 CO 0.00 0.01 0.00 0.35 -1.33 0.00 0.00 177.39 176.42 2nln n THR 78 N -1.34 0.00 -0.03 -5.08 -2.24 -1.26 -1.59 114.28 102.74 2nln n THR 78 Ca 0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 2nln n THR 78 Cb 0.20 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.32 2nln n THR 78 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2nln h GLU 79 N 0.00 -0.01 0.00 -0.78 4.39 -1.92 -3.38 114.58 112.88 2nln h GLU 79 Ca 0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 2nln h GLU 79 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2nln h GLU 79 CO 0.00 0.63 -0.58 1.03 -1.16 0.00 0.00 179.01 178.93 2nln h SER 80 N -0.66 0.00 -0.50 1.42 0.87 -1.79 -3.37 113.55 109.51 2nln h SER 80 Ca -0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 2nln h SER 80 Cb 0.65 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 2nln h SER 80 CO 0.00 0.44 0.06 -0.08 -0.53 0.00 0.00 176.83 176.72 2nln h GLU 81 N 0.00 0.85 0.00 2.24 4.81 -1.45 -1.59 114.58 119.43 2nln h GLU 81 Ca -0.02 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2nln h GLU 81 Cb 1.36 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2nln h GLU 81 CO 0.05 0.85 0.00 0.25 -0.73 0.00 0.00 179.01 179.44 2nln n THR 82 N -4.38 0.98 -0.15 0.32 -2.24 -0.62 -2.93 114.28 105.25 2nln n THR 82 Ca 0.01 0.53 -0.03 0.00 -2.27 0.00 0.00 64.05 62.29 2nln n THR 82 Cb 0.27 -1.50 0.06 0.00 -2.10 0.00 0.00 70.33 67.06 2nln n THR 82 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2nln h LYS 83 N 0.00 0.18 -0.32 -0.78 1.63 -1.48 0.93 116.57 116.73 2nln h LYS 83 Ca 0.00 -0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.85 2nln h LYS 83 Cb 0.15 -0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.68 2nln h LYS 83 CO 0.00 0.12 -0.07 1.03 -3.45 0.00 0.00 179.45 177.08 2nln h SER 84 N 0.19 -0.27 -0.49 4.20 0.87 -1.69 1.07 113.55 117.42 2nln h SER 84 Ca 0.24 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 2nln h SER 84 Cb 0.33 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 2nln h SER 84 CO -0.34 -0.10 0.32 -0.07 -0.53 0.00 0.00 176.83 176.12 2nln h LEU 85 N 0.01 0.57 -0.03 2.23 3.38 -1.10 1.18 115.31 121.55 2nln h LEU 85 Ca 0.16 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.13 2nln h LEU 85 Cb 0.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2nln h LEU 85 CO -0.32 0.41 -0.08 0.24 0.09 0.00 0.00 178.44 178.78 2nln h MET 86 N 0.67 -0.12 0.00 1.13 2.86 0.20 -0.81 114.93 118.86 2nln h MET 86 Ca 0.18 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2nln h MET 86 Cb -0.07 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2nln h MET 86 CO -0.04 -0.08 0.00 -0.25 1.06 0.00 0.00 176.91 177.60 2nln n ASP 87 N -5.21 0.00 0.20 1.22 9.92 0.36 -3.26 116.55 119.79 2nln n ASP 87 Ca -0.05 -0.26 0.06 0.00 -0.53 0.00 0.00 54.79 54.01 2nln n ASP 87 Cb 0.13 -0.20 0.43 0.00 -0.64 0.00 0.00 41.12 40.84 2nln n ASP 87 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2nln h ALA 88 N 3.23 1.15 -3.00 2.24 0.00 0.30 -3.45 119.26 119.73 2nln h ALA 88 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2nln h ALA 88 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2nln h ALA 88 CO 0.00 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.65 2nln n ALA 89 N -2.33 0.28 -2.22 0.00 0.00 -1.24 -4.62 120.51 110.37 2nln n ALA 89 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 2nln n ALA 89 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2nln n ALA 89 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2nln n ASP 90 N -0.51 4.59 -0.08 0.00 -0.08 -1.12 -4.61 116.55 114.74 2nln n ASP 90 Ca 0.00 -2.94 -0.11 0.00 -1.51 0.00 0.00 54.79 50.22 2nln n ASP 90 Cb 0.00 -1.62 -0.06 0.00 2.34 0.00 0.00 41.12 41.78 2nln n ASP 90 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 2nln h ASN 91 N 6.42 0.00 -0.67 1.67 -0.26 -1.84 0.50 115.58 121.39 2nln h ASN 91 Ca 0.47 -0.29 -0.31 0.00 -0.56 0.00 0.00 56.30 55.61 2nln h ASN 91 Cb 0.72 0.00 -0.18 0.00 -1.06 0.00 0.00 38.32 37.79 2nln h ASN 91 CO 1.65 1.00 0.28 -0.67 -1.06 0.00 0.00 177.43 178.63 2nln n ASP 92 N -4.58 3.52 0.00 5.81 2.03 -1.26 -4.44 116.55 117.63 2nln n ASP 92 Ca -0.15 -3.56 0.00 0.00 0.52 0.00 0.00 54.79 51.60 2nln n ASP 92 Cb 0.40 -0.73 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 2nln n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nln n GLY 93 N -0.91 1.00 0.00 0.27 0.00 -1.26 -5.05 105.19 99.24 2nln n GLY 93 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2nln n GLY 93 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2nln n ASP 94 N 0.00 0.00 0.00 1.61 2.03 -1.26 -5.01 116.55 113.92 2nln n ASP 94 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2nln n ASP 94 Cb 0.22 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 2nln n ASP 94 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nln n GLY 95 N 0.00 1.01 3.84 0.27 0.00 0.18 -4.99 105.19 105.49 2nln n GLY 95 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2nln n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nln s LYS 96 N -0.05 3.00 -0.33 1.61 0.00 -1.22 -3.52 119.74 119.23 2nln s LYS 96 Ca 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 55.97 55.04 2nln s LYS 96 Cb 0.00 -2.64 0.10 0.00 0.00 0.00 0.00 37.83 35.29 2nln s LYS 96 CO 0.00 0.44 0.09 0.42 0.00 0.00 0.00 175.35 176.30 2nln s ILE 97 N -1.98 1.45 0.38 3.79 -1.09 0.38 -2.79 121.20 121.35 2nln s ILE 97 Ca 0.32 -1.84 0.08 0.00 -2.23 0.00 0.00 60.65 56.98 2nln s ILE 97 Cb -0.09 -2.08 -0.04 0.00 -1.58 0.00 0.00 42.46 38.67 2nln s ILE 97 CO 0.25 -0.66 0.21 -0.83 -1.23 0.00 0.00 174.94 172.68 2nln s GLY 98 N 1.26 2.13 0.18 6.18 0.00 -1.26 -3.14 107.32 112.67 2nln s GLY 98 Ca 0.11 -1.95 -0.14 0.00 0.00 0.00 0.00 44.72 42.75 2nln s GLY 98 CO -0.17 -1.80 1.71 0.00 0.00 0.00 0.00 173.10 172.84 2nln h ALA 99 N 1.38 0.51 -0.18 3.20 0.00 -1.94 1.36 119.26 123.59 2nln h ALA 99 Ca -0.43 0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2nln h ALA 99 Cb 1.26 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 2nln h ALA 99 CO 0.64 -0.34 0.08 -0.44 0.00 0.00 0.00 179.25 179.19 2nln h ASP 100 N 0.19 0.10 0.26 0.00 5.19 -1.98 0.64 116.42 120.83 2nln h ASP 100 Ca 0.24 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.65 2nln h ASP 100 Cb 0.33 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.83 2nln h ASP 100 CO -0.34 0.09 -0.13 -0.33 -3.12 0.00 0.00 179.24 175.41 2nln h GLU 101 N 0.17 -0.34 -0.69 3.56 3.07 -1.69 -2.44 114.58 116.23 2nln h GLU 101 Ca 0.07 0.02 0.09 0.00 -0.50 0.00 0.00 59.36 59.05 2nln h GLU 101 Cb 0.03 0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 27.94 2nln h GLU 101 CO -0.06 -0.16 0.32 0.35 -1.40 0.00 0.00 179.01 178.06 2nln h PHE 102 N -0.44 0.58 -0.56 4.33 3.04 0.20 0.21 116.94 124.29 2nln h PHE 102 Ca -0.04 0.03 0.16 0.00 3.98 0.00 0.00 57.97 62.11 2nln h PHE 102 Cb 0.33 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.67 2nln h PHE 102 CO -0.03 0.20 0.43 1.96 -2.02 0.00 0.00 178.31 178.84 2nln h GLN 103 N 0.56 0.00 -0.40 1.11 1.08 0.62 0.22 115.11 118.29 2nln h GLN 103 Ca 0.34 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.46 2nln h GLN 103 Cb 0.37 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 2nln h GLN 103 CO -0.28 0.00 -0.07 0.93 -0.95 0.00 0.00 178.83 178.46 2nln h GLU 104 N 0.00 0.68 0.66 1.46 4.39 -0.11 -2.60 114.58 119.05 2nln h GLU 104 Ca 0.27 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 2nln h GLU 104 Cb 1.12 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 2nln h GLU 104 CO -0.00 0.75 -0.34 1.98 -1.16 0.00 0.00 179.01 180.23 2nln h MET 105 N 0.63 -0.88 0.00 2.33 4.05 -0.48 -1.43 114.93 119.15 2nln h MET 105 Ca 0.12 0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.60 2nln h MET 105 Cb 0.50 0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 31.50 2nln h MET 105 CO 0.03 -0.59 -0.00 -0.24 0.23 0.00 0.00 176.91 176.34 2nln h VAL 106 N -0.91 0.30 0.00 -5.77 3.04 -1.53 0.41 116.25 111.79 2nln h VAL 106 Ca -0.09 -0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.58 2nln h VAL 106 Cb 0.71 1.00 -0.00 0.00 -2.01 0.00 0.00 31.29 30.99 2nln h VAL 106 CO 0.13 0.00 -0.09 -0.74 -1.01 0.00 0.00 177.57 175.86 2nln h HIS 107 N 0.00 0.00 0.00 3.17 6.17 -0.97 -3.50 115.15 120.02 2nln h HIS 107 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2nln h HIS 107 Cb 0.00 0.00 0.00 0.00 2.52 0.00 0.00 27.41 29.93 2nln h HIS 107 CO 0.00 0.09 0.00 -1.13 0.71 0.00 0.00 177.93 177.60