#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 0.00-11.03 0.66 0.44 -0.00 -1.26 -4.68 119.36 103.50 2nln n ILE 2 Ca 0.00 2.26 0.07 0.00 -0.00 0.00 0.00 62.75 65.08 2nln n ILE 2 Cb 0.00 -5.98 0.36 0.00 -0.00 0.00 0.00 39.64 34.02 2nln n ILE 2 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 2nln n THR 3 N 1.36 0.66 0.00 1.39 -2.24 -1.26 -4.35 114.28 109.84 2nln n THR 3 Ca -0.35 0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2nln n THR 3 Cb 0.53 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 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 -1.32 0.00 -3.81 3.42 9.92 -1.26 -4.27 116.55 119.23 2nln n ASP 4 Ca 0.06 0.08 -0.30 0.00 -0.53 0.00 0.00 54.79 54.11 2nln n ASP 4 Cb 0.13 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.47 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 -0.17 1.94 -0.04 0.53 1.01 -1.26 -5.06 121.20 118.15 2nln s ILE 5 Ca 0.00 -2.96 -0.31 0.00 0.00 0.00 0.00 60.65 57.38 2nln s ILE 5 Cb 0.00 -2.35 0.12 0.00 0.01 0.00 0.00 42.46 40.25 2nln s ILE 5 CO 0.00 -0.87 1.28 -1.48 0.00 0.00 0.00 174.94 173.87 2nln s LEU 6 N -0.02 -0.07 -0.18 2.97 -0.00 -1.26 -4.88 118.68 115.24 2nln s LEU 6 Ca 0.18 -0.12 -0.29 0.00 -0.00 0.00 0.00 54.13 53.91 2nln s LEU 6 Cb -0.23 1.38 -0.05 0.00 -0.00 0.00 0.00 46.19 47.29 2nln s LEU 6 CO -0.01 -0.29 1.94 -0.44 -0.00 0.00 0.00 176.35 177.55 2nln s SER 7 N -2.88 5.97 0.23 1.48 0.01 -1.25 -4.87 113.70 112.40 2nln s SER 7 Ca 0.14 1.89 -0.08 0.00 1.31 0.00 0.00 55.95 59.21 2nln s SER 7 Cb 0.04 -2.52 0.23 0.00 0.21 0.00 0.00 66.02 63.98 2nln s SER 7 CO -0.04 -1.55 1.90 0.00 0.41 0.00 0.00 173.24 173.96 2nln h ALA 8 N 12.66 1.15 0.10 1.44 0.00 -1.93 -2.58 119.26 130.10 2nln h ALA 8 Ca -0.40 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2nln h ALA 8 Cb 1.20 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2nln h ALA 8 CO 0.98 0.51 -0.05 0.93 0.00 0.00 0.00 179.25 181.62 2nln h GLU 9 N 1.19 -0.13 -0.33 0.00 4.39 -2.00 -2.37 114.58 115.33 2nln h GLU 9 Ca 0.34 0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.14 2nln h GLU 9 Cb -0.11 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2nln h GLU 9 CO -0.08 0.04 0.34 -0.44 -1.16 0.00 0.00 179.01 177.71 2nln h ASP 10 N -0.28 0.00 0.15 1.42 3.32 -1.88 -1.42 116.42 117.72 2nln h ASP 10 Ca -0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2nln h ASP 10 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2nln h ASP 10 CO 0.02 0.00 -0.07 0.40 -1.72 0.00 0.00 179.24 177.87 2nln h ILE 11 N 0.00 0.87 -0.08 0.35 2.04 -1.02 1.73 117.51 121.40 2nln h ILE 11 Ca 0.16 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.93 2nln h ILE 11 Cb 0.83 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2nln h ILE 11 CO -0.00 0.03 -0.05 0.00 0.00 0.00 0.00 178.15 178.13 2nln h ALA 12 N 0.58 0.03 0.05 1.87 0.00 -1.28 0.55 119.26 121.07 2nln h ALA 12 Ca -0.02 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2nln h ALA 12 Cb 0.20 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2nln h ALA 12 CO 0.03 -0.51 -0.03 0.00 0.00 0.00 0.00 179.25 178.75 2nln h ALA 13 N 1.03 -0.07 -0.73 0.00 0.00 -1.38 1.26 119.26 119.38 2nln h ALA 13 Ca 0.05 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.02 2nln h ALA 13 Cb 0.12 0.03 -0.12 0.00 0.00 0.00 0.00 17.79 17.81 2nln h ALA 13 CO -0.11 -0.45 0.05 0.00 0.00 0.00 0.00 179.25 178.73 2nln h ALA 14 N 0.69 0.80 0.10 0.00 0.00 0.30 1.40 119.26 122.55 2nln h ALA 14 Ca -0.01 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2nln h ALA 14 Cb 0.22 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2nln h ALA 14 CO 0.01 -0.41 -0.05 1.25 0.00 0.00 0.00 179.25 180.06 2nln h LEU 15 N 0.14 -0.11 0.00 0.00 6.46 0.34 -3.29 115.31 118.85 2nln h LEU 15 Ca 0.40 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.17 2nln h LEU 15 Cb 0.70 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 2nln h LEU 15 CO -0.61 0.17 0.00 0.00 -0.62 0.00 0.00 178.44 177.38 2nln n GLN 16 N -3.77 0.18 0.00 1.25 1.13 0.43 -3.11 117.38 113.49 2nln n GLN 16 Ca -0.02 0.16 0.00 0.00 -1.94 0.00 0.00 57.00 55.20 2nln n GLN 16 Cb 0.05 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.90 2nln n GLN 16 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2nln n GLU 17 N -1.23 0.00 -0.12 -1.09 2.13 0.48 -4.42 120.64 116.39 2nln n GLU 17 Ca 0.05 0.25 0.07 0.00 0.66 0.00 0.00 57.16 58.19 2nln n GLU 17 Cb 0.07 -1.10 0.13 0.00 0.27 0.00 0.00 31.44 30.81 2nln n GLU 17 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2nln n GLN 19 N 0.80 0.38 0.00 0.00 7.27 -1.18 -4.74 117.38 119.91 2nln n GLN 19 Ca 0.12 0.13 0.00 0.00 0.07 0.00 0.00 57.00 57.32 2nln n GLN 19 Cb 0.42 -1.25 0.00 0.00 2.41 0.00 0.00 30.24 31.82 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 1.78 0.00 -2.48 1.69 8.00 -1.26 -4.98 116.55 119.29 2nln n ASP 20 Ca 0.15 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.45 2nln n ASP 20 Cb 0.29 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.28 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 -0.35 2.37 0.00 -0.24 -0.04 -1.26 -3.29 135.00 132.19 2nln n PRO 21 Ca 0.00 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.15 2nln n PRO 21 Cb 0.00 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 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 2.96 0.00 -0.03 3.54 -0.08 -1.26 -3.52 116.55 118.16 2nln n ASP 22 Ca 0.51 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.84 2nln n ASP 22 Cb 0.61 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.91 2nln n ASP 22 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2nln n THR 23 N 0.00 0.38 0.00 5.18 5.66 -1.21 -4.88 114.28 119.41 2nln n THR 23 Ca 0.00 -0.59 0.00 0.00 -3.05 0.00 0.00 64.05 60.41 2nln n THR 23 Cb 0.00 -0.13 0.00 0.00 -1.55 0.00 0.00 70.33 68.65 2nln n THR 23 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2nln n PHE 24 N -2.38 0.00 0.03 1.09 3.01 -1.26 -4.95 117.46 112.99 2nln n PHE 24 Ca -0.12 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.15 2nln n PHE 24 Cb 0.72 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 40.10 2nln n PHE 24 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2nln h GLU 25 N 0.00 0.71 0.00 -1.08 5.08 -1.90 -3.30 114.58 114.09 2nln h GLU 25 Ca 0.00 -0.71 -0.03 0.00 -1.00 0.00 0.00 59.36 57.62 2nln h GLU 25 Cb 0.00 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 2nln h GLU 25 CO 0.00 1.30 -0.39 -1.00 -1.00 0.00 0.00 179.01 177.92 2nln h PRO 26 N 0.43 0.00 -0.96 2.33 0.13 -1.96 -3.29 132.00 128.68 2nln h PRO 26 Ca -0.11 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.04 2nln h PRO 26 Cb 1.62 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.69 2nln h PRO 26 CO 0.19 0.24 0.63 1.96 -0.23 0.00 0.00 178.00 180.80 2nln h GLN 27 N -1.00 1.22 -0.68 0.86 7.50 -1.90 -1.91 115.11 119.20 2nln h GLN 27 Ca -0.05 -0.07 -0.08 0.00 0.50 0.00 0.00 58.65 58.95 2nln h GLN 27 Cb 0.50 -0.28 -0.03 0.00 0.05 0.00 0.00 27.48 27.73 2nln h GLN 27 CO -0.03 0.81 0.11 0.87 -1.50 0.00 0.00 178.83 179.09 2nln h LYS 28 N 1.26 1.13 -0.81 1.46 1.57 -1.78 -0.76 116.57 118.64 2nln h LYS 28 Ca 0.36 -0.30 0.16 0.00 -1.87 0.00 0.00 60.65 59.00 2nln h LYS 28 Cb -0.08 -0.13 -0.10 0.00 0.08 0.00 0.00 32.23 32.00 2nln h LYS 28 CO -0.10 1.03 0.36 0.35 -0.57 0.00 0.00 179.45 180.52 2nln h PHE 29 N 1.05 0.62 0.26 -1.35 3.04 -1.43 -2.31 116.94 116.82 2nln h PHE 29 Ca 0.21 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.18 2nln h PHE 29 Cb 0.45 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.81 2nln h PHE 29 CO 0.03 0.09 -0.12 0.74 -2.02 0.00 0.00 178.31 177.03 2nln h PHE 30 N 0.50 -0.32 -0.05 0.41 0.04 -0.78 0.15 116.94 116.88 2nln h PHE 30 Ca 0.45 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 61.23 2nln h PHE 30 Cb 0.71 0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.92 2nln h PHE 30 CO -0.14 0.05 -0.38 0.37 -0.60 0.00 0.00 178.31 177.62 2nln h GLN 31 N -0.85 -0.42 -0.15 1.51 5.75 -0.82 1.96 115.11 122.09 2nln h GLN 31 Ca -0.04 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.54 2nln h GLN 31 Cb 0.51 0.09 -0.06 0.00 1.07 0.00 0.00 27.48 29.10 2nln h GLN 31 CO 0.06 -0.28 -0.27 1.15 -2.65 0.00 0.00 178.83 176.84 2nln h THR 32 N -0.43 0.37 0.00 2.39 2.02 -1.59 0.28 112.91 115.95 2nln h THR 32 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 2nln h THR 32 Cb 0.48 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2nln h THR 32 CO -0.28 0.00 -0.10 -1.28 0.37 0.00 0.00 175.52 174.23 2nln h SER 33 N -0.33 0.00 0.00 4.18 0.87 -1.48 -3.42 113.55 113.37 2nln h SER 33 Ca 0.11 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.51 2nln h SER 33 Cb 0.49 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 2nln h SER 33 CO -0.33 0.39 -1.43 0.61 -0.53 0.00 0.00 176.83 175.54 2nln n GLY 34 N 1.80 -0.59 0.00 5.77 0.00 0.55 -3.74 105.19 108.98 2nln n GLY 34 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 46.02 45.81 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 -4.41 0.00 -0.04 0.99 4.32 0.48 -4.04 117.00 114.29 2nln n LEU 35 Ca -0.27 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.66 2nln n LEU 35 Cb 0.61 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.37 2nln n LEU 35 CO 0.14 0.00 0.50 0.28 -1.22 0.00 0.00 177.39 177.09 2nln h SER 36 N 0.00 -0.80 0.00 -1.43 0.02 -0.56 -3.41 113.55 107.38 2nln h SER 36 Ca 0.00 0.10 -0.20 0.00 -0.84 0.00 0.00 61.79 60.85 2nln h SER 36 Cb 0.00 0.32 -0.14 0.00 0.14 0.00 0.00 62.40 62.72 2nln h SER 36 CO 0.00 -0.19 -0.28 2.29 -1.14 0.00 0.00 176.83 177.51 2nln n LYS 37 N -3.86 1.05 -2.93 3.45 2.85 -1.26 -5.05 118.16 112.42 2nln n LYS 37 Ca -0.02 -1.67 -0.20 0.00 -1.05 0.00 0.00 58.31 55.37 2nln n LYS 37 Cb 0.16 -0.07 0.07 0.00 -0.65 0.00 0.00 35.03 34.54 2nln n LYS 37 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 2nln s MET 38 N 0.18 2.19 0.91 -1.58 1.00 -1.26 -5.11 119.30 115.63 2nln s MET 38 Ca 0.19 -1.49 -0.12 0.00 0.00 0.00 0.00 55.69 54.27 2nln s MET 38 Cb 0.35 -2.58 0.14 0.00 0.00 0.00 0.00 34.83 32.74 2nln s MET 38 CO -0.08 -0.96 1.13 0.45 0.00 0.00 0.00 175.02 175.56 2nln s SER 39 N -4.66 3.48 0.16 3.03 0.15 -1.26 -4.99 113.70 109.61 2nln s SER 39 Ca 0.62 0.98 -0.11 0.00 0.70 0.00 0.00 55.95 58.15 2nln s SER 39 Cb -0.06 -1.56 0.02 0.00 -1.71 0.00 0.00 66.02 62.71 2nln s SER 39 CO 0.40 -2.57 1.58 0.00 1.20 0.00 0.00 173.24 173.85 2nln h ALA 40 N -1.51 0.70 -0.15 5.45 0.00 -1.99 -3.32 119.26 118.45 2nln h ALA 40 Ca -0.51 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.09 2nln h ALA 40 Cb 1.33 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 2nln h ALA 40 CO 0.62 0.60 -0.54 0.66 0.00 0.00 0.00 179.25 180.59 2nln h SER 41 N 0.84 -1.72 -0.11 0.00 4.64 -2.02 0.13 113.55 115.30 2nln h SER 41 Ca 0.13 0.21 0.03 0.00 -0.47 0.00 0.00 61.79 61.69 2nln h SER 41 Cb 0.66 0.67 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2nln h SER 41 CO 0.05 -0.48 0.12 0.06 -0.87 0.00 0.00 176.83 175.71 2nln h GLN 42 N -0.57 0.00 -0.84 4.77 3.07 -1.96 0.54 115.11 120.11 2nln h GLN 42 Ca 0.03 0.00 0.04 0.00 0.09 0.00 0.00 58.65 58.82 2nln h GLN 42 Cb 0.67 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.18 2nln h GLN 42 CO -0.44 0.00 0.55 0.28 0.09 0.00 0.00 178.83 179.31 2nln h VAL 43 N 0.00 1.12 -0.39 1.86 2.07 -0.84 0.98 116.25 121.05 2nln h VAL 43 Ca 0.05 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.26 2nln h VAL 43 Cb 0.30 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 2nln h VAL 43 CO -0.00 0.19 0.18 0.11 0.02 0.00 0.00 177.57 178.07 2nln h LYS 44 N 1.02 0.36 -0.27 1.57 6.56 -0.68 1.01 116.57 126.14 2nln h LYS 44 Ca 0.34 -0.02 -0.09 0.00 -1.06 0.00 0.00 60.65 59.82 2nln h LYS 44 Cb 0.08 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 2nln h LYS 44 CO -0.11 0.24 -0.20 -0.44 -2.06 0.00 0.00 179.45 176.89 2nln h ASP 45 N 0.37 0.64 0.22 0.86 3.32 -1.19 -3.11 116.42 117.52 2nln h ASP 45 Ca 0.17 -0.44 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 2nln h ASP 45 Cb 0.10 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2nln h ASP 45 CO -0.13 0.94 -0.18 0.40 -1.72 0.00 0.00 179.24 178.55 2nln h ILE 46 N 0.33 0.60 -1.34 0.35 5.03 0.14 -1.61 117.51 121.02 2nln h ILE 46 Ca 0.05 0.00 0.39 0.00 -0.12 0.00 0.00 64.86 65.18 2nln h ILE 46 Cb 0.74 0.60 -0.06 0.00 -3.03 0.00 0.00 36.82 35.07 2nln h ILE 46 CO 0.05 0.00 0.96 0.15 -0.68 0.00 0.00 178.15 178.63 2nln h PHE 47 N -0.42 0.04 -0.40 1.37 3.57 0.11 0.36 116.94 121.57 2nln h PHE 47 Ca -0.01 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.61 2nln h PHE 47 Cb 0.38 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2nln h PHE 47 CO -0.13 -0.00 0.45 0.00 -2.23 0.00 0.00 178.31 176.40 2nln h ARG 48 N 0.02 0.00 -0.10 1.11 2.47 -1.22 -2.22 114.38 114.45 2nln h ARG 48 Ca 0.64 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 59.38 2nln h ARG 48 Cb 2.54 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 30.82 2nln h ARG 48 CO -0.03 0.00 -0.29 0.35 0.56 0.00 0.00 179.97 180.56 2nln h PHE 49 N 0.00 -0.87 -3.84 3.04 3.57 -0.42 -3.39 116.94 115.03 2nln h PHE 49 Ca 0.19 0.03 -0.49 0.00 3.53 0.00 0.00 57.97 61.24 2nln h PHE 49 Cb 1.08 0.39 -0.00 0.00 2.79 0.00 0.00 35.95 40.22 2nln h PHE 49 CO 0.00 -0.29 0.40 0.96 -2.23 0.00 0.00 178.31 177.15 2nln s ILE 50 N -4.43 3.87 0.13 1.41 -4.36 -0.83 -4.95 121.20 112.03 2nln s ILE 50 Ca -0.08 1.71 -0.05 0.00 -0.26 0.00 0.00 60.65 61.97 2nln s ILE 50 Cb 0.04 -4.02 -0.04 0.00 1.25 0.00 0.00 42.46 39.69 2nln s ILE 50 CO 0.32 0.28 -0.02 0.47 0.24 0.00 0.00 174.94 176.23 2nln n ASP 51 N 0.88 -0.93 -0.00 4.36 8.00 -1.26 -4.94 116.55 122.66 2nln n ASP 51 Ca 0.01 0.18 -0.00 0.00 0.71 0.00 0.00 54.79 55.69 2nln n ASP 51 Cb 0.48 -0.23 -0.00 0.00 -0.02 0.00 0.00 41.12 41.35 2nln n ASP 51 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2nln n ASN 52 N 0.66 2.77 0.00 -2.24 5.15 -1.26 -4.86 115.26 115.48 2nln n ASN 52 Ca 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 2nln n ASN 52 Cb 0.12 -0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 2nln n ASN 52 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2nln n ASP 53 N -2.66 0.00 0.00 1.20 9.92 -1.26 -4.36 116.55 119.39 2nln n ASP 53 Ca -0.00 0.01 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 2nln n ASP 53 Cb 0.50 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 2nln n ASP 53 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2nln n GLN 54 N -1.21 0.00 -0.82 -1.24 1.13 -1.26 -0.61 117.38 113.37 2nln n GLN 54 Ca 0.00 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 55.02 2nln n GLN 54 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.31 2nln n GLN 54 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2nln n SER 55 N 1.45 -0.64 0.00 1.08 2.88 -1.26 -4.97 113.62 112.16 2nln n SER 55 Ca 0.00 -1.64 0.00 0.00 -1.33 0.00 0.00 58.87 55.90 2nln n SER 55 Cb 0.00 0.19 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 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 0.00 2.39 3.78 0.46 0.00 0.22 -5.05 105.19 106.99 2nln n GLY 56 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 2nln n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nln s TYR 57 N -2.29 -0.19 -0.00 1.61 2.02 -0.84 -4.94 117.35 112.72 2nln s TYR 57 Ca 0.00 -0.18 -0.03 0.00 -0.37 0.00 0.00 57.07 56.48 2nln s TYR 57 Cb 0.00 0.67 -0.04 0.00 -0.40 0.00 0.00 41.96 42.19 2nln s TYR 57 CO 0.00 -1.02 0.20 -0.51 -1.57 0.00 0.00 175.55 172.65 2nln s LEU 58 N -2.91 4.37 0.05 -1.29 1.43 -0.77 -4.54 118.68 115.02 2nln s LEU 58 Ca 0.11 0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 53.49 2nln s LEU 58 Cb -0.04 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.55 2nln s LEU 58 CO 0.03 0.26 0.22 -0.62 0.23 0.00 0.00 176.35 176.47 2nln s ASP 59 N -1.92 0.02 0.50 2.29 2.15 -1.26 -0.22 116.67 118.23 2nln s ASP 59 Ca 0.28 -0.40 0.41 0.00 0.43 0.00 0.00 52.55 53.26 2nln s ASP 59 Cb -0.13 0.32 1.60 0.00 -0.30 0.00 0.00 42.92 44.42 2nln s ASP 59 CO 0.18 -0.62 1.60 1.23 -0.17 0.00 0.00 175.17 177.39 2nln h GLY 60 N 3.21 0.64 0.51 2.66 0.00 -1.93 1.06 103.07 109.22 2nln h GLY 60 Ca -0.33 -0.05 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 2nln h GLY 60 CO 0.50 -0.21 -0.29 -1.80 0.00 0.00 0.00 176.54 174.73 2nln h ASP 61 N 0.02 0.27 0.94 0.19 3.58 -1.96 -3.32 116.42 116.14 2nln h ASP 61 Ca 0.88 -0.75 -0.20 0.00 0.42 0.00 0.00 57.03 57.38 2nln h ASP 61 Cb 3.20 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 44.14 2nln h ASP 61 CO -0.22 0.99 -0.94 -0.33 -2.88 0.00 0.00 179.24 175.86 2nln h GLU 62 N -0.42 0.00 -0.89 0.28 4.39 -0.53 -3.33 114.58 114.08 2nln h GLU 62 Ca -0.03 -0.00 0.24 0.00 0.34 0.00 0.00 59.36 59.90 2nln h GLU 62 Cb 1.02 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.53 2nln h GLU 62 CO 0.06 0.94 0.21 -0.07 -1.16 0.00 0.00 179.01 178.99 2nln h LEU 63 N 0.00 -0.06 -1.25 1.33 3.38 0.78 0.78 115.31 120.27 2nln h LEU 63 Ca -0.01 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2nln h LEU 63 Cb 1.66 0.29 0.00 0.00 0.09 0.00 0.00 40.66 42.70 2nln h LEU 63 CO 0.12 -0.19 0.00 2.29 0.09 0.00 0.00 178.44 180.76 2nln n LYS 64 N -5.26 0.12 0.20 1.13 2.85 -1.25 -1.31 118.16 114.63 2nln n LYS 64 Ca 0.22 0.62 0.13 0.00 -1.05 0.00 0.00 58.31 58.23 2nln n LYS 64 Cb 0.70 -1.90 0.33 0.00 -0.65 0.00 0.00 35.03 33.50 2nln n LYS 64 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 2nln h TYR 65 N 0.00 0.00 -0.47 5.58 0.05 0.35 -3.35 116.97 119.13 2nln h TYR 65 Ca 0.00 0.00 0.09 0.00 0.05 0.00 0.00 58.73 58.87 2nln h TYR 65 Cb 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 37.64 2nln h TYR 65 CO 0.00 0.00 -0.36 0.35 -1.05 0.00 0.00 178.16 177.10 2nln h PHE 66 N 0.00 -1.00 -0.18 4.88 3.57 -1.31 0.94 116.94 123.83 2nln h PHE 66 Ca 0.00 0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 2nln h PHE 66 Cb 0.82 0.51 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 2nln h PHE 66 CO 0.00 -0.40 -0.18 -0.07 -2.23 0.00 0.00 178.31 175.43 2nln h LEU 67 N -0.24 0.30 -0.83 0.59 3.38 -1.80 -2.52 115.31 114.19 2nln h LEU 67 Ca 0.18 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 2nln h LEU 67 Cb 0.55 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2nln h LEU 67 CO -0.60 0.51 -0.17 1.56 0.09 0.00 0.00 178.44 179.83 2nln h GLN 68 N 0.29 0.68 -0.18 1.13 4.20 -0.53 1.78 115.11 122.49 2nln h GLN 68 Ca 0.05 -0.24 0.05 0.00 0.06 0.00 0.00 58.65 58.57 2nln h GLN 68 Cb 0.49 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.16 2nln h GLN 68 CO 0.03 0.82 -0.26 0.87 -0.67 0.00 0.00 178.83 179.62 2nln h LYS 69 N 0.61 -0.29 0.00 1.46 1.79 0.11 0.67 116.57 120.92 2nln h LYS 69 Ca 0.10 0.02 -0.11 0.00 -2.18 0.00 0.00 60.65 58.47 2nln h LYS 69 Cb 0.64 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.33 2nln h LYS 69 CO 0.04 -0.20 -0.89 0.34 -1.08 0.00 0.00 179.45 177.67 2nln n PHE 70 N -5.38 0.94 1.83 -1.35 7.35 -1.16 -4.35 117.46 115.35 2nln n PHE 70 Ca -0.02 0.41 0.16 0.00 -0.76 0.00 0.00 57.45 57.23 2nln n PHE 70 Cb 0.30 -0.92 0.90 0.00 0.35 0.00 0.00 39.48 40.10 2nln n PHE 70 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 2nln n GLN 71 N -4.53 0.83 -2.14 -4.13 7.27 0.60 -4.91 117.38 110.38 2nln n GLN 71 Ca -0.19 -0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.88 2nln n GLN 71 Cb 0.46 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.61 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 -1.08 0.00 0.00 1.69 7.64 0.23 -4.09 113.62 118.01 2nln n SER 72 Ca 0.21 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.09 2nln n SER 72 Cb 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 0.45 0.00 0.00 6.43 -0.08 -1.26 -5.00 116.55 117.09 2nln n ASP 73 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2nln n ASP 73 Cb 0.00 0.03 0.00 0.00 2.34 0.00 0.00 41.12 43.49 2nln n ASP 73 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2nln n ALA 74 N -1.56 -0.06 1.33 -1.67 0.00 -1.26 -4.73 120.51 112.55 2nln n ALA 74 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2nln n ALA 74 Cb 0.00 0.00 0.52 0.00 0.00 0.00 0.00 19.45 19.97 2nln n ALA 74 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2nln n ARG 75 N 0.00 0.66 -0.98 0.00 0.00 -1.26 -4.75 116.66 110.34 2nln n ARG 75 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2nln n ARG 75 Cb 0.00 -1.41 0.00 0.00 -0.00 0.00 0.00 32.46 31.05 2nln n ARG 75 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2nln n GLU 76 N -0.91 0.00 -2.48 2.89 1.02 -1.26 -4.29 120.64 115.60 2nln n GLU 76 Ca 0.13 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.13 2nln n GLU 76 Cb 0.06 -1.02 -0.03 0.00 -0.02 0.00 0.00 31.44 30.43 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 -0.18 -0.26 -0.11 -4.62 4.77 -1.26 -4.50 117.00 110.83 2nln n LEU 77 Ca 0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 2nln n LEU 77 Cb 0.20 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 2nln n LEU 77 CO 0.00 0.03 0.00 0.35 -1.33 0.00 0.00 177.39 176.44 2nln n THR 78 N -1.94 0.00 -0.12 -5.08 -2.24 -1.26 -0.59 114.28 103.06 2nln n THR 78 Ca 0.04 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.71 2nln n THR 78 Cb 0.24 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 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 -0.22 0.63 0.12 -0.78 5.08 -1.91 -3.24 114.58 114.27 2nln h GLU 79 Ca 0.00 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2nln h GLU 79 Cb 0.93 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2nln h GLU 79 CO 0.00 0.76 -0.06 1.03 -1.00 0.00 0.00 179.01 179.75 2nln h SER 80 N 0.44 -0.13 -0.36 1.42 0.87 -1.79 -3.30 113.55 110.69 2nln h SER 80 Ca 0.10 -0.39 0.05 0.00 -1.23 0.00 0.00 61.79 60.32 2nln h SER 80 Cb 0.49 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.44 2nln h SER 80 CO 0.02 0.36 0.08 -0.08 -0.53 0.00 0.00 176.83 176.68 2nln h GLU 81 N -0.68 0.19 -0.25 2.24 4.22 -1.47 0.12 114.58 118.96 2nln h GLU 81 Ca -0.02 -0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.48 2nln h GLU 81 Cb 0.52 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2nln h GLU 81 CO 0.03 0.13 0.28 1.79 -2.18 0.00 0.00 179.01 179.06 2nln h THR 82 N 0.20 0.42 -0.66 0.32 1.35 -0.87 0.94 112.91 114.61 2nln h THR 82 Ca 0.17 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 66.03 2nln h THR 82 Cb 0.19 0.77 -0.03 0.00 -1.73 0.00 0.00 68.15 67.35 2nln h THR 82 CO -0.22 0.00 0.40 0.50 -0.25 0.00 0.00 175.52 175.94 2nln h LYS 83 N 0.00 0.89 0.23 4.72 3.64 -0.83 0.85 116.57 126.07 2nln h LYS 83 Ca 0.12 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2nln h LYS 83 Cb 0.68 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2nln h LYS 83 CO -0.00 0.62 -0.24 0.77 -2.27 0.00 0.00 179.45 178.33 2nln h SER 84 N 0.90 -0.64 -0.99 4.20 0.02 0.98 1.41 113.55 119.44 2nln h SER 84 Ca 0.24 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.32 2nln h SER 84 Cb -0.04 0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 2nln h SER 84 CO -0.04 -0.35 0.64 -0.07 -1.14 0.00 0.00 176.83 175.86 2nln h LEU 85 N -0.51 1.01 -0.15 5.07 3.38 -1.16 -1.00 115.31 121.96 2nln h LEU 85 Ca -0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2nln h LEU 85 Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2nln h LEU 85 CO -0.06 0.64 0.05 -0.03 0.09 0.00 0.00 178.44 179.13 2nln h MET 86 N 1.14 0.12 0.00 1.13 4.05 0.19 -1.58 114.93 119.98 2nln h MET 86 Ca 0.43 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.84 2nln h MET 86 Cb 0.19 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 2nln h MET 86 CO -0.18 0.08 0.00 -0.25 0.23 0.00 0.00 176.91 176.79 2nln n ASP 87 N -5.06 0.00 0.23 1.39 8.00 0.47 -3.25 116.55 118.33 2nln n ASP 87 Ca -0.04 -0.18 0.08 0.00 0.71 0.00 0.00 54.79 55.36 2nln n ASP 87 Cb 0.06 -0.17 0.53 0.00 -0.02 0.00 0.00 41.12 41.53 2nln n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nln h ALA 88 N 2.87 1.25 -3.00 2.24 0.00 -0.17 -3.46 119.26 118.98 2nln h ALA 88 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2nln h ALA 88 Cb 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2nln h ALA 88 CO 0.00 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2nln n ALA 89 N -2.33 0.00 -2.85 0.00 0.00 -1.23 -4.54 120.51 109.55 2nln n ALA 89 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.99 2nln n ALA 89 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 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 -0.89 5.27 -0.11 0.00 -0.08 -0.99 -4.67 116.55 115.08 2nln n ASP 90 Ca 0.00 -3.03 -0.22 0.00 -1.51 0.00 0.00 54.79 50.03 2nln n ASP 90 Cb 0.00 -1.52 -0.07 0.00 2.34 0.00 0.00 41.12 41.87 2nln n ASP 90 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2nln n ASN 91 N 4.79 1.78 0.00 1.67 0.23 -1.20 -0.32 115.26 122.21 2nln n ASN 91 Ca 0.36 0.31 0.07 0.00 -0.53 0.00 0.00 54.58 54.78 2nln n ASN 91 Cb 0.40 -0.72 0.41 0.00 -2.08 0.00 0.00 39.78 37.79 2nln n ASN 91 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2nln n ASP 92 N -4.18 0.00 0.00 0.53 -0.08 -1.26 -4.49 116.55 107.07 2nln n ASP 92 Ca -0.40 -1.14 0.00 0.00 -1.51 0.00 0.00 54.79 51.74 2nln n ASP 92 Cb 0.75 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.21 2nln n ASP 92 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2nln n GLY 93 N 0.45 0.54 0.10 0.27 0.00 -1.26 -5.03 105.19 100.26 2nln n GLY 93 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 2nln n GLY 93 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2nln h ASP 94 N 0.00 -0.11 0.00 1.61 5.19 -1.82 -3.49 116.42 117.81 2nln h ASP 94 Ca 0.00 -0.42 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 2nln h ASP 94 Cb 0.00 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2nln h ASP 94 CO 0.00 0.54 0.00 0.61 -3.12 0.00 0.00 179.24 177.27 2nln n GLY 95 N 1.10 1.43 3.70 2.75 0.00 0.57 -5.00 105.19 109.74 2nln n GLY 95 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 2nln n GLY 95 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nln s LYS 96 N -0.19 2.55 -0.29 1.61 2.36 -1.01 -3.50 119.74 121.26 2nln s LYS 96 Ca 0.00 -1.05 0.00 0.00 -2.55 0.00 0.00 55.97 52.37 2nln s LYS 96 Cb 0.00 -2.44 0.09 0.00 -1.05 0.00 0.00 37.83 34.43 2nln s LYS 96 CO 0.00 0.46 0.05 0.42 1.55 0.00 0.00 175.35 177.83 2nln s ILE 97 N -1.77 1.28 0.41 5.43 -1.09 0.70 -2.35 121.20 123.80 2nln s ILE 97 Ca 0.29 -1.51 0.07 0.00 -2.23 0.00 0.00 60.65 57.27 2nln s ILE 97 Cb -0.09 -1.87 -0.04 0.00 -1.58 0.00 0.00 42.46 38.88 2nln s ILE 97 CO 0.20 -0.52 0.24 -0.83 -1.23 0.00 0.00 174.94 172.80 2nln s GLY 98 N 1.44 2.26 0.18 6.18 0.00 -1.26 -1.85 107.32 114.27 2nln s GLY 98 Ca 0.06 -2.03 -0.13 0.00 0.00 0.00 0.00 44.72 42.62 2nln s GLY 98 CO -0.17 -1.84 1.71 0.00 0.00 0.00 0.00 173.10 172.80 2nln h ALA 99 N 1.31 0.54 -0.07 3.20 0.00 -1.94 1.37 119.26 123.68 2nln h ALA 99 Ca -0.42 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2nln h ALA 99 Cb 1.26 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2nln h ALA 99 CO 0.66 -0.32 0.04 0.38 0.00 0.00 0.00 179.25 180.02 2nln h ASP 100 N 0.22 0.08 0.18 0.00 2.03 -1.98 0.60 116.42 117.55 2nln h ASP 100 Ca 0.24 -0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.53 2nln h ASP 100 Cb 0.33 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 2nln h ASP 100 CO -0.33 0.06 -0.09 -0.33 -1.03 0.00 0.00 179.24 177.52 2nln h GLU 101 N 0.09 -0.24 -0.53 4.15 3.07 -1.71 -1.90 114.58 117.51 2nln h GLU 101 Ca 0.02 0.02 0.09 0.00 -0.50 0.00 0.00 59.36 58.99 2nln h GLU 101 Cb -0.01 0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 27.88 2nln h GLU 101 CO -0.01 -0.14 0.14 0.35 -1.40 0.00 0.00 179.01 177.95 2nln h PHE 102 N -0.26 0.24 -0.47 4.33 3.04 0.20 0.55 116.94 124.56 2nln h PHE 102 Ca -0.03 0.03 0.13 0.00 3.98 0.00 0.00 57.97 62.08 2nln h PHE 102 Cb 0.20 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.67 2nln h PHE 102 CO -0.06 0.03 0.34 1.96 -2.02 0.00 0.00 178.31 178.55 2nln h GLN 103 N 0.29 0.04 -0.63 1.11 1.08 0.61 -0.65 115.11 116.96 2nln h GLN 103 Ca 0.27 -0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.38 2nln h GLN 103 Cb 0.35 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 2nln h GLN 103 CO -0.32 0.02 0.04 0.93 -0.95 0.00 0.00 178.83 178.56 2nln h GLU 104 N 0.04 1.08 0.69 1.46 4.39 -0.09 0.28 114.58 122.43 2nln h GLU 104 Ca 0.22 -0.32 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 2nln h GLU 104 Cb 0.84 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.39 2nln h GLU 104 CO -0.01 1.03 -0.33 1.98 -1.16 0.00 0.00 179.01 180.52 2nln h MET 105 N 0.99 -0.89 -0.53 2.33 4.05 -0.95 1.27 114.93 121.20 2nln h MET 105 Ca 0.18 0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.65 2nln h MET 105 Cb 0.51 0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.49 2nln h MET 105 CO 0.02 -0.59 0.25 -0.24 0.23 0.00 0.00 176.91 176.58 2nln h VAL 106 N -0.93 1.18 0.00 -5.77 3.04 -1.51 -2.10 116.25 110.16 2nln h VAL 106 Ca -0.09 -0.51 -0.11 0.00 -1.01 0.00 0.00 66.70 64.97 2nln h VAL 106 Cb 0.71 0.50 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 2nln h VAL 106 CO 0.16 0.21 -0.52 -0.74 -1.01 0.00 0.00 177.57 175.67 2nln h HIS 107 N 0.75 0.00 0.00 3.17 6.17 -0.69 -3.49 115.15 121.06 2nln h HIS 107 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.27 2nln h HIS 107 Cb 0.09 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.02 2nln h HIS 107 CO 0.01 0.52 0.00 0.45 0.71 0.00 0.00 177.93 179.62