#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nln s ILE 2 N 0.00 0.25 0.00 2.46 1.09 -1.26 -4.86 121.20 118.88 2nln s ILE 2 Ca 0.00 0.18 0.00 0.00 -1.10 0.00 0.00 60.65 59.73 2nln s ILE 2 Cb 0.00 -0.45 0.00 0.00 -1.06 0.00 0.00 42.46 40.95 2nln s ILE 2 CO 0.00 0.22 0.46 0.35 -0.10 0.00 0.00 174.94 175.87 2nln n THR 3 N 5.19 0.00 -0.03 2.92 -2.24 -1.26 -4.79 114.28 114.06 2nln n THR 3 Ca -0.06 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.64 2nln n THR 3 Cb 0.50 0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 69.56 2nln n THR 3 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2nln h ASP 4 N 0.00 -0.51 -2.52 3.42 5.19 -1.96 -3.35 116.42 116.69 2nln h ASP 4 Ca 0.00 0.10 -0.53 0.00 -0.62 0.00 0.00 57.03 55.98 2nln h ASP 4 Cb 1.01 0.25 -0.38 0.00 0.18 0.00 0.00 39.33 40.40 2nln h ASP 4 CO 0.00 -0.20 -0.80 -0.63 -3.12 0.00 0.00 179.24 174.48 2nln s ILE 5 N -6.14 0.01 -0.07 0.35 1.09 -1.26 -5.12 121.20 110.05 2nln s ILE 5 Ca -0.14 -1.37 -0.31 0.00 -1.10 0.00 0.00 60.65 57.73 2nln s ILE 5 Cb 0.11 -1.02 0.12 0.00 -1.06 0.00 0.00 42.46 40.61 2nln s ILE 5 CO 0.68 -0.86 1.11 -0.76 -0.10 0.00 0.00 174.94 175.01 2nln s LEU 6 N 1.38 -0.19 -0.41 2.97 1.02 -1.26 -4.95 118.68 117.25 2nln s LEU 6 Ca 0.16 -0.07 -0.27 0.00 0.02 0.00 0.00 54.13 53.96 2nln s LEU 6 Cb -0.20 1.64 0.02 0.00 0.02 0.00 0.00 46.19 47.67 2nln s LEU 6 CO -0.08 -0.43 1.02 -0.44 0.02 0.00 0.00 176.35 176.44 2nln s SER 7 N -2.50 6.69 0.11 2.29 0.01 -1.26 -4.93 113.70 114.10 2nln s SER 7 Ca 0.09 0.57 -0.22 0.00 1.31 0.00 0.00 55.95 57.70 2nln s SER 7 Cb 0.00 -2.50 -0.09 0.00 0.21 0.00 0.00 66.02 63.64 2nln s SER 7 CO -0.05 -1.01 1.71 0.00 0.41 0.00 0.00 173.24 174.30 2nln h ALA 8 N 8.72 -0.01 0.24 1.44 0.00 -1.95 0.91 119.26 128.61 2nln h ALA 8 Ca -0.23 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2nln h ALA 8 Cb 1.07 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2nln h ALA 8 CO 1.04 -0.53 -0.12 0.93 0.00 0.00 0.00 179.25 180.57 2nln h GLU 9 N -0.08 -0.32 -0.49 0.00 4.39 -2.00 -2.06 114.58 114.03 2nln h GLU 9 Ca 0.05 0.02 0.14 0.00 0.34 0.00 0.00 59.36 59.91 2nln h GLU 9 Cb 0.14 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2nln h GLU 9 CO -0.11 -0.06 0.37 -0.44 -1.16 0.00 0.00 179.01 177.61 2nln h ASP 10 N -0.55 0.00 -0.08 1.42 5.19 -1.94 0.93 116.42 121.39 2nln h ASP 10 Ca -0.03 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 2nln h ASP 10 Cb 0.40 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.91 2nln h ASP 10 CO 0.05 0.00 0.00 0.40 -3.12 0.00 0.00 179.24 176.58 2nln h ILE 11 N 0.00 1.24 -0.01 0.35 2.04 -0.33 1.34 117.51 122.14 2nln h ILE 11 Ca 0.23 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.36 2nln h ILE 11 Cb 0.96 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 2nln h ILE 11 CO -0.00 0.21 -0.08 0.00 0.00 0.00 0.00 178.15 178.28 2nln h ALA 12 N 0.74 -0.07 0.28 1.87 0.00 -0.20 1.09 119.26 122.97 2nln h ALA 12 Ca 0.02 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2nln h ALA 12 Cb 0.33 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2nln h ALA 12 CO 0.00 -0.57 -0.14 0.00 0.00 0.00 0.00 179.25 178.55 2nln h ALA 13 N 0.86 -0.38 -0.82 0.00 0.00 -1.09 1.55 119.26 119.38 2nln h ALA 13 Ca 0.04 -0.16 0.19 0.00 0.00 0.00 0.00 54.91 54.98 2nln h ALA 13 Cb 0.18 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.00 2nln h ALA 13 CO -0.09 -0.60 0.27 0.00 0.00 0.00 0.00 179.25 178.83 2nln h ALA 14 N 0.04 1.19 0.09 0.00 0.00 0.20 1.25 119.26 122.03 2nln h ALA 14 Ca -0.04 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2nln h ALA 14 Cb 0.44 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2nln h ALA 14 CO 0.06 -0.35 -0.04 1.25 0.00 0.00 0.00 179.25 180.17 2nln h LEU 15 N 0.32 -0.10 0.00 0.00 6.46 0.14 -3.31 115.31 118.82 2nln h LEU 15 Ca 0.49 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.26 2nln h LEU 15 Cb 0.90 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.86 2nln h LEU 15 CO -0.54 0.26 0.00 0.00 -0.62 0.00 0.00 178.44 177.54 2nln n GLN 16 N -4.16 0.24 0.00 1.25 1.13 0.53 -3.14 117.38 113.23 2nln n GLN 16 Ca -0.01 0.12 0.00 0.00 -1.94 0.00 0.00 57.00 55.16 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 -1.20 0.00 -0.11 -1.09 2.13 0.43 -4.35 120.64 116.46 2nln n GLU 17 Ca 0.07 0.30 0.07 0.00 0.66 0.00 0.00 57.16 58.26 2nln n GLU 17 Cb 0.08 -1.18 0.13 0.00 0.27 0.00 0.00 31.44 30.74 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 0.84 0.41 0.00 0.00 7.27 -1.19 -4.71 117.38 119.99 2nln n GLN 19 Ca 0.12 0.14 0.00 0.00 0.07 0.00 0.00 57.00 57.33 2nln n GLN 19 Cb 0.42 -1.26 0.00 0.00 2.41 0.00 0.00 30.24 31.81 2nln n GLN 19 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 2nln n ASP 20 N 1.76 0.00 -2.53 1.69 5.68 -1.26 -4.98 116.55 116.90 2nln n ASP 20 Ca 0.15 0.00 -0.24 0.00 -0.50 0.00 0.00 54.79 54.20 2nln n ASP 20 Cb 0.28 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.17 2nln n ASP 20 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2nln n PRO 21 N -0.22 2.70 0.00 0.11 -0.04 -1.26 -3.76 135.00 132.54 2nln n PRO 21 Ca 0.00 -1.92 0.00 0.00 -0.04 0.00 0.00 63.50 61.54 2nln n PRO 21 Cb 0.00 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 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 2.02 0.00 -0.10 3.54 -0.08 -1.26 -3.53 116.55 117.15 2nln n ASP 22 Ca 0.53 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.67 2nln n ASP 22 Cb 0.62 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.93 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 1.46 0.00 5.18 5.66 -1.25 -4.88 114.28 120.46 2nln n THR 23 Ca 0.00 -0.74 0.00 0.00 -3.05 0.00 0.00 64.05 60.26 2nln n THR 23 Cb 0.00 -0.92 0.00 0.00 -1.55 0.00 0.00 70.33 67.86 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 -3.00 0.00 -0.01 1.09 3.01 -1.26 -4.97 117.46 112.32 2nln n PHE 24 Ca -0.36 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 57.93 2nln n PHE 24 Cb 1.08 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 40.43 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 0.20 0.07 -1.08 5.08 -1.86 -3.25 114.58 113.74 2nln h GLU 25 Ca 0.00 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2nln h GLU 25 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2nln h GLU 25 CO 0.00 1.05 -0.03 -1.00 -1.00 0.00 0.00 179.01 178.03 2nln h PRO 26 N -0.53 -0.09 -0.89 2.33 0.13 -1.95 -3.11 132.00 127.90 2nln h PRO 26 Ca -0.06 0.01 0.10 0.00 -0.87 0.00 0.00 66.00 65.17 2nln h PRO 26 Cb 1.22 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 2nln h PRO 26 CO 0.08 0.34 0.57 1.96 -0.23 0.00 0.00 178.00 180.72 2nln h GLN 27 N -0.97 0.86 -0.28 0.86 1.08 -1.86 -1.68 115.11 113.11 2nln h GLN 27 Ca -0.01 -0.05 -0.10 0.00 -1.45 0.00 0.00 58.65 57.03 2nln h GLN 27 Cb 0.46 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 2nln h GLN 27 CO 0.02 0.57 -0.23 0.87 -0.95 0.00 0.00 178.83 179.10 2nln h LYS 28 N 0.88 0.66 -0.48 1.46 1.79 -1.70 0.11 116.57 119.29 2nln h LYS 28 Ca 0.41 -0.33 0.09 0.00 -2.18 0.00 0.00 60.65 58.65 2nln h LYS 28 Cb 0.41 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.98 2nln h LYS 28 CO -0.18 0.93 -0.00 0.35 -1.08 0.00 0.00 179.45 179.47 2nln h PHE 29 N 0.40 -0.03 0.57 -1.35 3.04 -1.27 -1.70 116.94 116.59 2nln h PHE 29 Ca 0.05 0.04 -0.03 0.00 3.98 0.00 0.00 57.97 62.01 2nln h PHE 29 Cb 0.78 0.09 0.01 0.00 2.56 0.00 0.00 35.95 39.39 2nln h PHE 29 CO 0.07 -0.11 -0.28 0.74 -2.02 0.00 0.00 178.31 176.72 2nln h PHE 30 N 0.11 -0.72 0.26 0.41 0.04 -1.16 -3.26 116.94 112.63 2nln h PHE 30 Ca 0.24 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.98 2nln h PHE 30 Cb 0.36 0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.75 2nln h PHE 30 CO -0.31 -0.44 -0.16 0.37 -0.60 0.00 0.00 178.31 177.17 2nln h GLN 31 N -1.20 -0.39 -0.46 1.51 5.75 -0.70 2.15 115.11 121.76 2nln h GLN 31 Ca -0.08 0.03 0.07 0.00 -0.15 0.00 0.00 58.65 58.51 2nln h GLN 31 Cb 0.60 0.09 -0.09 0.00 1.07 0.00 0.00 27.48 29.14 2nln h GLN 31 CO 0.13 -0.26 -0.48 1.15 -2.65 0.00 0.00 178.83 176.72 2nln h THR 32 N -0.40 0.06 0.01 2.39 2.02 -1.51 -0.76 112.91 114.71 2nln h THR 32 Ca -0.04 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2nln h THR 32 Cb 0.32 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 2nln h THR 32 CO 0.04 0.00 -0.00 -1.28 0.37 0.00 0.00 175.52 174.64 2nln h SER 33 N -0.32 -0.01 0.00 4.18 0.87 -1.59 -3.44 113.55 113.24 2nln h SER 33 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2nln h SER 33 Cb 0.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2nln h SER 33 CO -0.62 0.49 -0.19 0.61 -0.53 0.00 0.00 176.83 176.59 2nln n GLY 34 N 1.77 -0.50 0.38 5.77 0.00 0.40 -4.54 105.19 108.47 2nln n GLY 34 Ca -0.00 -0.06 0.31 0.00 0.00 0.00 0.00 46.02 46.27 2nln n GLY 34 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nln h LEU 35 N -0.19 0.36 -1.12 0.99 4.07 0.28 -0.31 115.31 119.39 2nln h LEU 35 Ca 0.00 0.18 0.39 0.00 0.08 0.00 0.00 57.88 58.53 2nln h LEU 35 Cb 0.19 0.16 -0.11 0.00 1.08 0.00 0.00 40.66 41.98 2nln h LEU 35 CO 0.00 -0.23 0.72 -0.24 -1.08 0.00 0.00 178.44 177.62 2nln n SER 36 N -4.96 0.17 -2.70 -0.43 2.88 -0.29 -2.40 113.62 105.89 2nln n SER 36 Ca 0.35 1.11 -0.05 0.00 -1.33 0.00 0.00 58.87 58.95 2nln n SER 36 Cb 1.23 -0.55 0.09 0.00 -0.75 0.00 0.00 64.21 64.24 2nln n SER 36 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2nln n LYS 37 N -4.29 1.30 -4.22 -1.46 5.02 -0.14 -5.13 118.16 109.24 2nln n LYS 37 Ca 0.33 -2.25 -0.27 0.00 -2.02 0.00 0.00 58.31 54.09 2nln n LYS 37 Cb 1.27 -0.44 -0.08 0.00 -0.02 0.00 0.00 35.03 35.76 2nln n LYS 37 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2nln s MET 38 N -1.18 2.31 0.78 1.97 -1.94 -1.01 -5.10 119.30 115.13 2nln s MET 38 Ca 0.21 -1.13 -0.11 0.00 -1.71 0.00 0.00 55.69 52.94 2nln s MET 38 Cb 0.41 -2.31 0.06 0.00 2.01 0.00 0.00 34.83 35.00 2nln s MET 38 CO -0.06 0.46 1.09 0.45 -0.01 0.00 0.00 175.02 176.94 2nln s SER 39 N -2.85 4.67 0.18 3.03 0.15 -1.26 -4.94 113.70 112.68 2nln s SER 39 Ca 0.26 1.40 -0.13 0.00 0.70 0.00 0.00 55.95 58.18 2nln s SER 39 Cb -0.09 -2.17 0.09 0.00 -1.71 0.00 0.00 66.02 62.14 2nln s SER 39 CO 0.17 -1.87 1.84 0.00 1.20 0.00 0.00 173.24 174.59 2nln h ALA 40 N -1.02 0.71 0.12 5.45 0.00 -1.99 -3.12 119.26 119.43 2nln h ALA 40 Ca -0.46 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.43 2nln h ALA 40 Cb 1.25 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 2nln h ALA 40 CO 0.58 0.13 -0.49 0.66 0.00 0.00 0.00 179.25 180.13 2nln h SER 41 N 0.74 -1.46 -0.48 0.00 4.64 -1.99 -0.34 113.55 114.65 2nln h SER 41 Ca 0.21 0.16 0.14 0.00 -0.47 0.00 0.00 61.79 61.83 2nln h SER 41 Cb -0.06 0.54 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 2nln h SER 41 CO -0.06 -0.54 0.47 0.06 -0.87 0.00 0.00 176.83 175.89 2nln h GLN 42 N -0.72 0.00 -0.74 4.77 -0.00 -1.94 0.44 115.11 116.91 2nln h GLN 42 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 2nln h GLN 42 Cb 0.74 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.18 2nln h GLN 42 CO -0.27 0.00 0.48 0.28 -0.00 0.00 0.00 178.83 179.32 2nln h VAL 43 N 0.00 1.20 -0.68 1.86 2.07 -0.99 -1.80 116.25 117.91 2nln h VAL 43 Ca 0.23 -0.38 0.14 0.00 0.82 0.00 0.00 66.70 67.50 2nln h VAL 43 Cb 1.16 0.11 -0.10 0.00 -1.52 0.00 0.00 31.29 30.94 2nln h VAL 43 CO -0.00 0.19 0.16 0.11 0.02 0.00 0.00 177.57 178.06 2nln h LYS 44 N 1.01 0.27 -0.08 1.57 1.57 -0.04 0.92 116.57 121.80 2nln h LYS 44 Ca 0.27 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 2nln h LYS 44 Cb -0.10 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.15 2nln h LYS 44 CO -0.06 0.18 0.01 -0.44 -0.57 0.00 0.00 179.45 178.58 2nln h ASP 45 N 0.28 0.12 -0.05 0.86 5.19 -1.45 -3.00 116.42 118.38 2nln h ASP 45 Ca 0.37 -0.25 0.04 0.00 -0.62 0.00 0.00 57.03 56.56 2nln h ASP 45 Cb 0.58 -0.03 -0.06 0.00 0.18 0.00 0.00 39.33 40.00 2nln h ASP 45 CO -0.45 0.34 -0.38 0.40 -3.12 0.00 0.00 179.24 176.03 2nln h ILE 46 N -0.11 0.21 -0.85 0.35 5.03 -0.41 -0.61 117.51 121.12 2nln h ILE 46 Ca 0.02 0.00 0.32 0.00 -0.12 0.00 0.00 64.86 65.09 2nln h ILE 46 Cb 0.27 0.21 -0.15 0.00 -3.03 0.00 0.00 36.82 34.11 2nln h ILE 46 CO 0.00 0.00 0.33 0.33 -0.68 0.00 0.00 178.15 178.14 2nln n PHE 47 N -5.43 0.87 -0.02 1.37 7.35 0.30 0.16 117.46 122.06 2nln n PHE 47 Ca -0.05 1.01 0.18 0.00 -0.76 0.00 0.00 57.45 57.83 2nln n PHE 47 Cb 0.35 -1.34 0.64 0.00 0.35 0.00 0.00 39.48 39.48 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 0.11 -0.01 -4.13 2.47 -0.96 -2.28 114.38 109.57 2nln h ARG 48 Ca 0.67 -0.01 0.02 0.00 -1.26 0.00 0.00 59.98 59.40 2nln h ARG 48 Cb 1.68 -0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 29.92 2nln h ARG 48 CO -0.70 0.07 -0.45 0.35 0.56 0.00 0.00 179.97 179.80 2nln h PHE 49 N 0.11 -1.33 -3.46 3.04 3.57 0.16 -3.39 116.94 115.63 2nln h PHE 49 Ca 0.26 0.04 -0.54 0.00 3.53 0.00 0.00 57.97 61.27 2nln h PHE 49 Cb 0.88 0.58 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 2nln h PHE 49 CO -0.00 -0.48 0.26 0.96 -2.23 0.00 0.00 178.31 176.82 2nln s ILE 50 N -5.29 4.74 0.00 1.41 -4.36 -0.86 -4.83 121.20 112.01 2nln s ILE 50 Ca -0.13 1.85 0.00 0.00 -0.26 0.00 0.00 60.65 62.11 2nln s ILE 50 Cb 0.06 -4.22 0.00 0.00 1.25 0.00 0.00 42.46 39.55 2nln s ILE 50 CO 0.51 0.28 0.00 0.47 0.24 0.00 0.00 174.94 176.44 2nln n ASP 51 N 3.20 0.00 -1.96 4.36 8.00 -1.26 -4.72 116.55 124.17 2nln n ASP 51 Ca 0.01 0.03 -0.14 0.00 0.71 0.00 0.00 54.79 55.41 2nln n ASP 51 Cb 0.50 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.51 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 0.35 5.94 -1.74 -2.24 5.15 -1.26 -4.65 115.26 116.82 2nln n ASN 52 Ca 0.00 -2.82 -0.04 0.00 -0.60 0.00 0.00 54.58 51.12 2nln n ASN 52 Cb 0.00 -1.19 0.02 0.00 -0.53 0.00 0.00 39.78 38.08 2nln n ASN 52 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2nln n ASP 53 N 1.21 -2.40 -0.35 1.20 2.03 -1.26 -4.92 116.55 112.05 2nln n ASP 53 Ca 0.30 -0.17 0.23 0.00 0.52 0.00 0.00 54.79 55.67 2nln n ASP 53 Cb 0.63 -1.71 0.47 0.00 -0.72 0.00 0.00 41.12 39.79 2nln n ASP 53 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2nln h GLN 54 N -0.42 0.40 -0.20 -0.67 4.20 -1.83 -3.13 115.11 113.45 2nln h GLN 54 Ca -0.15 -0.02 -0.20 0.00 0.06 0.00 0.00 58.65 58.33 2nln h GLN 54 Cb 1.09 -0.09 -0.28 0.00 0.30 0.00 0.00 27.48 28.50 2nln h GLN 54 CO 0.12 0.26 -0.70 0.45 -0.67 0.00 0.00 178.83 178.29 2nln n SER 55 N -4.85 0.08 0.00 1.46 2.88 -1.26 -4.95 113.62 106.97 2nln n SER 55 Ca 0.29 -2.11 0.00 0.00 -1.33 0.00 0.00 58.87 55.72 2nln n SER 55 Cb 0.92 0.08 0.00 0.00 -0.75 0.00 0.00 64.21 64.46 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 -0.97 3.16 3.73 0.46 0.00 -1.18 -4.97 105.19 105.42 2nln n GLY 56 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.89 -0.29 0.02 1.61 1.51 -1.26 -4.95 117.35 111.10 2nln s TYR 57 Ca 0.00 -0.10 -0.01 0.00 -1.01 0.00 0.00 57.07 55.95 2nln s TYR 57 Cb 0.00 0.66 -0.04 0.00 -0.11 0.00 0.00 41.96 42.47 2nln s TYR 57 CO 0.00 -1.12 0.17 -0.51 -1.11 0.00 0.00 175.55 172.97 2nln s LEU 58 N -2.87 4.26 0.06 -1.29 1.43 -1.12 -4.27 118.68 114.88 2nln s LEU 58 Ca 0.08 0.27 -0.07 0.00 -1.03 0.00 0.00 54.13 53.38 2nln s LEU 58 Cb -0.04 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 2nln s LEU 58 CO 0.01 0.23 0.15 -0.62 0.23 0.00 0.00 176.35 176.36 2nln s ASP 59 N -2.09 0.14 0.32 2.29 -1.08 -1.26 0.16 116.67 115.14 2nln s ASP 59 Ca 0.29 -0.57 0.18 0.00 -0.52 0.00 0.00 52.55 51.93 2nln s ASP 59 Cb -0.13 0.29 1.15 0.00 -1.46 0.00 0.00 42.92 42.77 2nln s ASP 59 CO 0.21 -0.61 1.35 0.61 0.52 0.00 0.00 175.17 177.24 2nln n GLY 60 N 0.37 -0.65 0.12 2.66 0.00 -0.98 0.11 105.19 106.83 2nln n GLY 60 Ca -0.17 0.70 -0.17 0.00 0.00 0.00 0.00 46.02 46.38 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 0.41 0.85 1.61 5.19 -1.96 -3.33 116.42 119.19 2nln h ASP 61 Ca 0.73 -0.79 -0.18 0.00 -0.62 0.00 0.00 57.03 56.16 2nln h ASP 61 Cb 1.92 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 41.27 2nln h ASP 61 CO -0.66 1.15 -0.86 -0.33 -3.12 0.00 0.00 179.24 175.43 2nln h GLU 62 N -0.28 0.01 -0.94 3.56 4.39 -0.56 -3.30 114.58 117.46 2nln h GLU 62 Ca -0.07 -0.01 0.28 0.00 0.34 0.00 0.00 59.36 59.90 2nln h GLU 62 Cb 1.24 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.75 2nln h GLU 62 CO 0.10 0.86 0.36 -0.07 -1.16 0.00 0.00 179.01 179.09 2nln h LEU 63 N 0.00 0.17 -1.19 1.33 3.38 0.68 1.20 115.31 120.88 2nln h LEU 63 Ca -0.01 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2nln h LEU 63 Cb 1.52 0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2nln h LEU 63 CO 0.11 -0.17 0.00 2.29 0.09 0.00 0.00 178.44 180.76 2nln n LYS 64 N -5.18 0.14 0.17 1.13 2.85 -1.24 -0.95 118.16 115.07 2nln n LYS 64 Ca 0.26 0.58 0.13 0.00 -1.05 0.00 0.00 58.31 58.23 2nln n LYS 64 Cb 0.82 -1.91 0.36 0.00 -0.65 0.00 0.00 35.03 33.65 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 -0.79 5.58 0.05 0.12 -3.34 116.97 118.59 2nln h TYR 65 Ca 0.00 0.00 0.16 0.00 0.05 0.00 0.00 58.73 58.94 2nln h TYR 65 Cb 0.07 0.00 -0.15 0.00 1.01 0.00 0.00 36.73 37.66 2nln h TYR 65 CO 0.00 0.00 -0.20 0.35 -1.05 0.00 0.00 178.16 177.26 2nln h PHE 66 N 0.00 -0.43 -0.06 4.88 3.57 -1.12 1.41 116.94 125.19 2nln h PHE 66 Ca 0.00 0.07 -0.14 0.00 3.53 0.00 0.00 57.97 61.43 2nln h PHE 66 Cb 0.77 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 2nln h PHE 66 CO 0.00 -0.34 -0.58 -0.07 -2.23 0.00 0.00 178.31 175.09 2nln h LEU 67 N -0.00 0.21 0.00 0.59 3.38 -1.80 -2.79 115.31 114.91 2nln h LEU 67 Ca 0.38 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2nln h LEU 67 Cb 0.58 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2nln h LEU 67 CO -0.82 0.74 0.00 0.00 0.09 0.00 0.00 178.44 178.46 2nln n GLN 68 N -3.88 0.43 -0.01 1.13 6.02 0.41 0.34 117.38 121.82 2nln n GLN 68 Ca -0.02 0.01 -0.08 0.00 -0.01 0.00 0.00 57.00 56.91 2nln n GLN 68 Cb 0.59 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.29 2nln n GLN 68 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2nln h LYS 69 N 0.00 -0.10 0.06 -1.09 1.79 0.93 -2.72 116.57 115.44 2nln h LYS 69 Ca 0.00 0.01 -0.30 0.00 -2.18 0.00 0.00 60.65 58.18 2nln h LYS 69 Cb 0.26 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 2nln h LYS 69 CO 0.00 0.32 -1.64 1.97 -1.08 0.00 0.00 179.45 179.02 2nln n PHE 70 N -4.80 1.11 1.22 -1.35 -1.74 -1.23 -4.21 117.46 106.47 2nln n PHE 70 Ca -0.05 0.35 0.14 0.00 -0.56 0.00 0.00 57.45 57.32 2nln n PHE 70 Cb 0.22 -1.13 0.58 0.00 1.52 0.00 0.00 39.48 40.68 2nln n PHE 70 CO 0.00 0.00 0.00 0.94 -0.56 0.00 0.00 176.76 177.14 2nln n GLN 71 N -3.98 0.32 -1.85 3.97 7.27 0.15 -4.90 117.38 118.36 2nln n GLN 71 Ca -0.33 -0.08 -0.06 0.00 0.07 0.00 0.00 57.00 56.61 2nln n GLN 71 Cb 0.86 -1.50 -0.01 0.00 2.41 0.00 0.00 30.24 32.00 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 -1.27 -0.25 -0.37 1.69 7.64 -1.03 -4.35 113.62 115.69 2nln n SER 72 Ca 0.11 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.83 2nln n SER 72 Cb 0.30 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 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 0.31 0.00 -4.69 6.43 2.03 -1.26 -5.00 116.55 114.37 2nln n ASP 73 Ca 0.02 -0.91 -0.32 0.00 0.52 0.00 0.00 54.79 54.10 2nln n ASP 73 Cb 0.06 0.00 0.15 0.00 -0.72 0.00 0.00 41.12 40.61 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 1.66 -1.63 -1.67 0.00 -1.26 -4.89 121.76 113.97 2nln s ALA 74 Ca 0.00 0.62 0.29 0.00 0.00 0.00 0.00 51.96 52.87 2nln s ALA 74 Cb 0.00 -3.44 1.58 0.00 0.00 0.00 0.00 23.12 21.26 2nln s ALA 74 CO 0.00 -2.52 2.05 2.89 0.00 0.00 0.00 175.76 178.17 2nln n ARG 75 N -3.91 0.60 -1.35 0.00 0.00 -1.26 -4.84 116.66 105.90 2nln n ARG 75 Ca 0.12 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.98 2nln n ARG 75 Cb 0.52 -1.50 0.00 0.00 -0.00 0.00 0.00 32.46 31.48 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 -1.18 0.00 -2.35 2.89 1.02 -1.26 -4.21 120.64 115.55 2nln n GLU 76 Ca 0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 2nln n GLU 76 Cb 0.18 -1.36 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 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 -0.27 -0.23 0.00 -4.62 4.77 -1.25 -4.60 117.00 110.80 2nln n LEU 77 Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2nln n LEU 77 Cb 0.27 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 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 -1.81 0.00 -0.03 -5.08 -2.24 -1.26 -0.92 114.28 102.93 2nln n THR 78 Ca 0.03 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.68 2nln n THR 78 Cb 0.23 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.36 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 0.07 0.00 -0.78 3.07 -1.88 -3.35 114.58 111.71 2nln h GLU 79 Ca 0.00 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 58.67 2nln h GLU 79 Cb 0.00 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 2nln h GLU 79 CO 0.00 0.66 -0.69 1.03 -1.40 0.00 0.00 179.01 178.60 2nln h SER 80 N -0.50 0.00 -0.12 1.42 0.87 -1.75 -3.35 113.55 110.12 2nln h SER 80 Ca -0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2nln h SER 80 Cb 0.66 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2nln h SER 80 CO 0.01 0.68 -0.05 -0.08 -0.53 0.00 0.00 176.83 176.86 2nln h GLU 81 N 0.00 0.25 0.00 2.24 4.81 -1.43 -2.18 114.58 118.28 2nln h GLU 81 Ca -0.01 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2nln h GLU 81 Cb 1.53 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.90 2nln h GLU 81 CO 0.09 0.58 0.00 1.79 -0.73 0.00 0.00 179.01 180.74 2nln h THR 82 N -0.09 0.00 -0.96 0.32 1.35 -1.16 -1.44 112.91 110.94 2nln h THR 82 Ca 0.03 -0.03 0.10 0.00 -0.55 0.00 0.00 66.41 65.97 2nln h THR 82 Cb 0.50 0.69 -0.07 0.00 -1.73 0.00 0.00 68.15 67.54 2nln h THR 82 CO 0.02 0.00 0.61 0.50 -0.25 0.00 0.00 175.52 176.40 2nln h LYS 83 N 0.00 0.94 0.22 4.72 3.64 -1.51 0.99 116.57 125.58 2nln h LYS 83 Ca 0.00 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.33 2nln h LYS 83 Cb 0.03 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 2nln h LYS 83 CO 0.00 0.62 -0.25 1.03 -2.27 0.00 0.00 179.45 178.59 2nln h SER 84 N 0.97 -0.68 -0.94 4.20 0.87 -1.37 1.21 113.55 117.81 2nln h SER 84 Ca 0.46 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 61.09 2nln h SER 84 Cb 0.42 0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.57 2nln h SER 84 CO -0.22 -0.36 0.60 -0.07 -0.53 0.00 0.00 176.83 176.26 2nln h LEU 85 N -0.51 1.09 0.34 2.23 3.38 -1.28 0.18 115.31 120.74 2nln h LEU 85 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2nln h LEU 85 Cb 0.49 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2nln h LEU 85 CO -0.07 0.81 -0.16 0.24 0.09 0.00 0.00 178.44 179.34 2nln h MET 86 N 1.28 -0.44 0.00 1.13 2.86 0.16 -2.59 114.93 117.32 2nln h MET 86 Ca 0.34 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 58.01 2nln h MET 86 Cb -0.11 0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.65 2nln h MET 86 CO -0.07 -0.21 0.00 -0.25 1.06 0.00 0.00 176.91 177.44 2nln n ASP 87 N -5.23 0.00 0.04 1.22 9.92 0.41 -3.10 116.55 119.81 2nln n ASP 87 Ca -0.10 -0.09 -0.10 0.00 -0.53 0.00 0.00 54.79 53.96 2nln n ASP 87 Cb 0.24 -0.22 0.03 0.00 -0.64 0.00 0.00 41.12 40.53 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 2.87 0.61 -1.73 2.24 0.00 -0.21 -3.46 119.26 119.57 2nln h ALA 88 Ca 0.00 -0.59 0.03 0.00 0.00 0.00 0.00 54.91 54.35 2nln h ALA 88 Cb 0.12 -0.06 -0.22 0.00 0.00 0.00 0.00 17.79 17.63 2nln h ALA 88 CO 0.00 0.74 0.41 0.00 0.00 0.00 0.00 179.25 180.40 2nln s ALA 89 N -3.70 -1.87 -0.98 0.00 0.00 -1.18 -4.64 121.76 109.39 2nln s ALA 89 Ca -0.06 1.50 -0.26 0.00 0.00 0.00 0.00 51.96 53.14 2nln s ALA 89 Cb 0.11 -0.47 0.04 0.00 0.00 0.00 0.00 23.12 22.79 2nln s ALA 89 CO 0.84 -0.33 0.56 -3.47 0.00 0.00 0.00 175.76 173.37 2nln n ASP 90 N 0.84 -3.53 -0.10 0.00 -0.08 -1.26 -4.45 116.55 107.98 2nln n ASP 90 Ca -0.13 -1.07 -0.18 0.00 -1.51 0.00 0.00 54.79 51.89 2nln n ASP 90 Cb 0.57 -1.33 -0.08 0.00 2.34 0.00 0.00 41.12 42.62 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 -1.71 1.88 0.00 1.67 0.23 -1.23 0.49 115.26 116.58 2nln n ASN 91 Ca -0.12 0.44 0.04 0.00 -0.53 0.00 0.00 54.58 54.42 2nln n ASN 91 Cb 0.49 -0.88 0.26 0.00 -2.08 0.00 0.00 39.78 37.56 2nln n ASN 91 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2nln n ASP 92 N -4.44 0.00 0.00 0.53 8.00 -1.26 -4.34 116.55 115.04 2nln n ASP 92 Ca -0.29 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 53.63 2nln n ASP 92 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.71 2nln n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nln n GLY 93 N 0.55 0.64 0.06 0.44 0.00 -1.26 -5.00 105.19 100.62 2nln n GLY 93 Ca 0.06 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 2nln n GLY 93 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2nln h ASP 94 N 0.00 -0.00 0.00 1.61 1.82 -1.82 -3.49 116.42 114.54 2nln h ASP 94 Ca 0.00 -0.80 0.00 0.00 -0.39 0.00 0.00 57.03 55.84 2nln h ASP 94 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2nln h ASP 94 CO 0.00 0.81 0.00 0.61 -1.61 0.00 0.00 179.24 179.05 2nln n GLY 95 N 1.09 1.04 3.79 -0.78 0.00 0.18 -4.96 105.19 105.56 2nln n GLY 95 Ca -0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.34 2.86 -0.33 1.61 0.00 -1.11 -2.31 119.74 120.12 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 -2.60 0.10 0.00 0.00 0.00 0.00 37.83 35.34 2nln s LYS 96 CO 0.00 0.46 0.10 0.42 0.00 0.00 0.00 175.35 176.33 2nln s ILE 97 N -1.85 1.33 0.38 3.79 -1.09 0.41 -4.01 121.20 120.16 2nln s ILE 97 Ca 0.31 -1.79 0.08 0.00 -2.23 0.00 0.00 60.65 57.02 2nln s ILE 97 Cb -0.09 -1.99 -0.02 0.00 -1.58 0.00 0.00 42.46 38.77 2nln s ILE 97 CO 0.23 -0.68 0.35 -0.83 -1.23 0.00 0.00 174.94 172.78 2nln s GLY 98 N 1.29 1.98 0.18 6.18 0.00 -1.26 -2.77 107.32 112.92 2nln s GLY 98 Ca 0.11 -1.78 -0.14 0.00 0.00 0.00 0.00 44.72 42.91 2nln s GLY 98 CO -0.18 -1.64 1.70 0.00 0.00 0.00 0.00 173.10 172.98 2nln h ALA 99 N 1.11 0.49 0.05 3.20 0.00 -1.94 1.33 119.26 123.50 2nln h ALA 99 Ca -0.43 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2nln h ALA 99 Cb 1.26 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2nln h ALA 99 CO 0.57 -0.36 -0.02 0.22 0.00 0.00 0.00 179.25 179.66 2nln h ASP 100 N 0.16 -0.06 0.15 0.00 3.58 -1.97 0.76 116.42 119.05 2nln h ASP 100 Ca 0.24 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 2nln h ASP 100 Cb 0.35 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2nln h ASP 100 CO -0.37 -0.02 -0.07 -0.33 -2.88 0.00 0.00 179.24 175.57 2nln h GLU 101 N -0.09 -0.20 0.14 0.28 3.07 -1.73 0.27 114.58 116.32 2nln h GLU 101 Ca -0.01 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.88 2nln h GLU 101 Cb 0.07 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.99 2nln h GLU 101 CO 0.01 -0.12 -0.27 0.35 -1.40 0.00 0.00 179.01 177.58 2nln h PHE 102 N -0.21 -0.72 0.00 4.33 3.04 0.18 -2.09 116.94 121.48 2nln h PHE 102 Ca -0.02 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2nln h PHE 102 Cb 0.16 0.30 -0.00 0.00 2.56 0.00 0.00 35.95 38.97 2nln h PHE 102 CO -0.07 -0.37 -0.05 -0.56 -2.02 0.00 0.00 178.31 175.24 2nln h GLN 103 N -0.49 0.00 -0.47 1.11 3.07 0.72 -1.42 115.11 117.64 2nln h GLN 103 Ca 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.74 2nln h GLN 103 Cb 0.51 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.04 2nln h GLN 103 CO -0.14 0.05 0.18 0.93 0.09 0.00 0.00 178.83 179.94 2nln h GLU 104 N 0.00 0.67 0.55 0.06 4.39 0.24 -0.90 114.58 119.59 2nln h GLU 104 Ca -0.00 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 2nln h GLU 104 Cb 0.09 -0.12 0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2nln h GLU 104 CO 0.01 0.56 -0.27 1.98 -1.16 0.00 0.00 179.01 180.13 2nln h MET 105 N 0.67 -0.72 -0.09 2.33 4.05 -1.03 0.68 114.93 120.82 2nln h MET 105 Ca 0.16 0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.60 2nln h MET 105 Cb 0.14 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 2nln h MET 105 CO -0.02 -0.44 -0.10 -0.24 0.23 0.00 0.00 176.91 176.34 2nln h VAL 106 N -0.84 1.13 0.03 -5.77 3.04 -1.55 -2.56 116.25 109.73 2nln h VAL 106 Ca -0.08 -0.58 -0.23 0.00 -1.01 0.00 0.00 66.70 64.81 2nln h VAL 106 Cb 0.61 1.18 -0.02 0.00 -2.01 0.00 0.00 31.29 31.04 2nln h VAL 106 CO 0.12 0.18 -1.06 -0.74 -1.01 0.00 0.00 177.57 175.06 2nln h HIS 107 N 0.14 0.11 0.00 3.17 6.17 -0.96 -3.49 115.15 120.29 2nln h HIS 107 Ca 0.03 -0.08 0.00 0.00 0.71 0.00 0.00 60.37 61.03 2nln h HIS 107 Cb 0.27 -0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.20 2nln h HIS 107 CO 0.00 1.07 0.00 -1.13 0.71 0.00 0.00 177.93 178.58