#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 1.65 0.23 -1.33 5.41 -1.26 -2.81 119.36 121.25 2nln n ILE 2 Ca 0.00 -0.56 0.13 0.00 1.00 0.00 0.00 62.75 63.31 2nln n ILE 2 Cb 0.00 -1.65 0.67 0.00 -0.71 0.00 0.00 39.64 37.95 2nln n ILE 2 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2nln h THR 3 N -0.10 0.00 -0.75 1.39 1.35 -1.94 -2.41 112.91 110.45 2nln h THR 3 Ca -0.49 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 65.49 2nln h THR 3 Cb 1.91 0.55 -0.13 0.00 -1.73 0.00 0.00 68.15 68.74 2nln h THR 3 CO -0.03 0.00 -0.35 0.44 -0.25 0.00 0.00 175.52 175.33 2nln h ASP 4 N 0.00 -1.25 -2.52 5.36 5.19 -1.95 -3.32 116.42 117.93 2nln h ASP 4 Ca 0.00 0.26 -0.52 0.00 -0.62 0.00 0.00 57.03 56.15 2nln h ASP 4 Cb 0.35 0.64 -0.38 0.00 0.18 0.00 0.00 39.33 40.12 2nln h ASP 4 CO 0.00 -0.30 -0.80 -0.63 -3.12 0.00 0.00 179.24 174.40 2nln s ILE 5 N -5.99 -0.02 -0.07 0.35 1.01 -0.91 -5.12 121.20 110.46 2nln s ILE 5 Ca -0.14 -1.29 -0.32 0.00 0.00 0.00 0.00 60.65 58.90 2nln s ILE 5 Cb 0.18 -1.01 0.12 0.00 0.01 0.00 0.00 42.46 41.76 2nln s ILE 5 CO 0.70 -0.84 1.22 -0.76 0.00 0.00 0.00 174.94 175.27 2nln s LEU 6 N 1.46 -0.11 -0.31 2.97 1.02 -1.25 -4.89 118.68 117.59 2nln s LEU 6 Ca 0.15 -0.10 -0.27 0.00 0.02 0.00 0.00 54.13 53.94 2nln s LEU 6 Cb -0.20 1.46 0.01 0.00 0.02 0.00 0.00 46.19 47.48 2nln s LEU 6 CO -0.11 -0.33 0.95 -0.55 0.02 0.00 0.00 176.35 176.33 2nln s SER 7 N -2.66 6.83 0.27 2.29 0.15 -1.26 -4.92 113.70 114.40 2nln s SER 7 Ca 0.12 0.92 -0.01 0.00 0.70 0.00 0.00 55.95 57.67 2nln s SER 7 Cb 0.02 -2.49 0.47 0.00 -1.71 0.00 0.00 66.02 62.31 2nln s SER 7 CO -0.04 -0.75 1.85 0.00 1.20 0.00 0.00 173.24 175.50 2nln h ALA 8 N 8.05 1.41 0.18 5.45 0.00 -1.98 -0.58 119.26 131.78 2nln h ALA 8 Ca -0.22 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2nln h ALA 8 Cb 1.08 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2nln h ALA 8 CO 0.97 0.30 -0.08 0.93 0.00 0.00 0.00 179.25 181.36 2nln h GLU 9 N 1.04 -0.23 -0.81 0.00 5.08 -2.00 -2.79 114.58 114.88 2nln h GLU 9 Ca 0.45 0.02 0.22 0.00 -1.00 0.00 0.00 59.36 59.05 2nln h GLU 9 Cb 0.33 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2nln h GLU 9 CO -0.22 0.15 0.57 -0.44 -1.00 0.00 0.00 179.01 178.06 2nln h ASP 10 N -0.66 0.10 -0.22 1.42 3.32 -1.84 0.15 116.42 118.69 2nln h ASP 10 Ca -0.02 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.96 2nln h ASP 10 Cb 0.48 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 2nln h ASP 10 CO 0.04 0.04 -0.16 0.40 -1.72 0.00 0.00 179.24 177.84 2nln h ILE 11 N 0.10 1.32 0.10 0.35 2.04 -0.99 0.71 117.51 121.14 2nln h ILE 11 Ca 0.39 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2nln h ILE 11 Cb 1.41 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 2nln h ILE 11 CO -0.05 0.40 -0.08 0.00 0.00 0.00 0.00 178.15 178.42 2nln h ALA 12 N 0.68 -0.17 0.21 1.87 0.00 -0.49 1.21 119.26 122.57 2nln h ALA 12 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2nln h ALA 12 Cb 0.69 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2nln h ALA 12 CO 0.04 -0.60 -0.10 0.00 0.00 0.00 0.00 179.25 178.59 2nln h ALA 13 N 0.70 -0.29 -0.71 0.00 0.00 -1.22 1.55 119.26 119.29 2nln h ALA 13 Ca -0.00 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 54.93 2nln h ALA 13 Cb 0.17 0.11 -0.11 0.00 0.00 0.00 0.00 17.79 17.96 2nln h ALA 13 CO -0.01 -0.56 0.13 0.00 0.00 0.00 0.00 179.25 178.81 2nln h ALA 14 N 0.26 0.88 0.17 0.00 0.00 0.64 1.24 119.26 122.45 2nln h ALA 14 Ca -0.03 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2nln h ALA 14 Cb 0.36 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2nln h ALA 14 CO 0.05 -0.36 -0.08 1.25 0.00 0.00 0.00 179.25 180.11 2nln h LEU 15 N 0.23 -0.20 0.00 0.00 5.85 0.17 -3.34 115.31 118.02 2nln h LEU 15 Ca 0.40 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.12 2nln h LEU 15 Cb 0.68 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2nln h LEU 15 CO -0.52 0.12 0.00 0.00 -0.34 0.00 0.00 178.44 177.70 2nln n GLN 16 N -4.08 0.22 0.00 1.25 1.13 0.53 -2.86 117.38 113.57 2nln n GLN 16 Ca -0.03 0.11 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 2nln n GLN 16 Cb 0.09 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.94 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 -1.16 0.00 -0.04 -1.09 2.13 0.42 -4.41 120.64 116.50 2nln n GLU 17 Ca 0.06 0.15 0.06 0.00 0.66 0.00 0.00 57.16 58.09 2nln n GLU 17 Cb 0.06 -1.07 0.07 0.00 0.27 0.00 0.00 31.44 30.77 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 0.65 0.46 0.00 0.00 7.27 -1.14 -4.74 117.38 119.88 2nln n GLN 19 Ca 0.08 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.32 2nln n GLN 19 Cb 0.33 -1.38 0.00 0.00 2.41 0.00 0.00 30.24 31.60 2nln n GLN 19 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2nln n ASP 20 N 1.56 0.00 -3.60 1.69 -0.08 -1.26 -4.95 116.55 109.92 2nln n ASP 20 Ca 0.12 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.98 2nln n ASP 20 Cb 0.37 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.71 2nln n ASP 20 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2nln n PRO 21 N -0.56 0.01 0.00 -0.67 -0.04 -1.26 -0.75 135.00 131.73 2nln n PRO 21 Ca 0.00 -1.06 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 2nln n PRO 21 Cb 0.00 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 30.84 2nln n PRO 21 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2nln n ASP 22 N 9.93 0.00 -1.56 3.54 8.00 -1.26 -4.42 116.55 130.77 2nln n ASP 22 Ca 0.46 0.00 0.08 0.00 0.71 0.00 0.00 54.79 56.04 2nln n ASP 22 Cb 0.42 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 41.88 2nln n ASP 22 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2nln n THR 23 N 0.00 2.47 -2.54 -3.53 5.66 0.07 -4.96 114.28 111.46 2nln n THR 23 Ca 0.00 -1.49 0.00 0.00 -3.05 0.00 0.00 64.05 59.51 2nln n THR 23 Cb 0.00 -0.19 0.00 0.00 -1.55 0.00 0.00 70.33 68.59 2nln n THR 23 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 2nln n PHE 24 N 0.40 0.00 0.02 1.09 -1.74 -1.25 -4.80 117.46 111.18 2nln n PHE 24 Ca 0.26 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 57.05 2nln n PHE 24 Cb 1.06 -0.79 -0.13 0.00 1.52 0.00 0.00 39.48 41.13 2nln n PHE 24 CO 0.00 0.00 0.00 1.05 -0.56 0.00 0.00 176.76 177.25 2nln h GLU 25 N 3.80 0.05 0.34 3.97 9.09 -1.90 -3.37 114.58 126.55 2nln h GLU 25 Ca 0.00 -0.08 -0.02 0.00 0.05 0.00 0.00 59.36 59.31 2nln h GLU 25 Cb 0.37 0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 2nln h GLU 25 CO 0.00 0.77 -0.16 -1.00 0.05 0.00 0.00 179.01 178.66 2nln h PRO 26 N 0.01 -0.44 -0.40 1.06 0.13 -1.95 0.32 132.00 130.73 2nln h PRO 26 Ca -0.20 0.03 0.07 0.00 -0.87 0.00 0.00 66.00 65.03 2nln h PRO 26 Cb 1.94 0.10 -0.06 0.00 0.13 0.00 0.00 31.00 33.11 2nln h PRO 26 CO 0.11 -0.18 0.04 1.96 -0.23 0.00 0.00 178.00 179.70 2nln h GLN 27 N -0.66 0.16 -0.65 0.86 4.20 -1.91 0.36 115.11 117.47 2nln h GLN 27 Ca -0.05 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 2nln h GLN 27 Cb 0.47 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 2nln h GLN 27 CO 0.08 0.10 0.19 0.87 -0.67 0.00 0.00 178.83 179.40 2nln h LYS 28 N 0.16 1.02 -0.28 1.46 1.57 -1.71 0.68 116.57 119.47 2nln h LYS 28 Ca 0.20 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.81 2nln h LYS 28 Cb 0.26 -0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 2nln h LYS 28 CO -0.29 0.90 -0.12 0.35 -0.57 0.00 0.00 179.45 179.72 2nln h PHE 29 N 0.95 -0.30 0.38 -1.35 3.04 0.98 -1.43 116.94 119.21 2nln h PHE 29 Ca 0.21 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.17 2nln h PHE 29 Cb 0.32 0.17 0.00 0.00 2.56 0.00 0.00 35.95 39.01 2nln h PHE 29 CO 0.02 -0.19 -0.18 0.74 -2.02 0.00 0.00 178.31 176.68 2nln h PHE 30 N -0.08 -0.47 0.26 0.41 0.04 0.19 -3.20 116.94 114.09 2nln h PHE 30 Ca 0.14 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 2nln h PHE 30 Cb 0.30 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 2nln h PHE 30 CO -0.32 -0.15 -0.22 0.37 -0.60 0.00 0.00 178.31 177.39 2nln h GLN 31 N -0.99 -0.45 -0.46 1.51 5.75 0.39 1.95 115.11 122.81 2nln h GLN 31 Ca -0.05 0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.54 2nln h GLN 31 Cb 0.52 0.10 -0.09 0.00 1.07 0.00 0.00 27.48 29.09 2nln h GLN 31 CO 0.08 -0.30 -0.52 1.15 -2.65 0.00 0.00 178.83 176.60 2nln h THR 32 N -0.47 0.03 0.07 2.39 2.02 -1.44 1.20 112.91 116.71 2nln h THR 32 Ca -0.03 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2nln h THR 32 Cb 0.40 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2nln h THR 32 CO -0.01 0.00 -0.03 0.77 0.37 0.00 0.00 175.52 176.62 2nln h SER 33 N -0.35 -0.08 0.00 4.18 4.64 -1.54 -3.42 113.55 116.99 2nln h SER 33 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2nln h SER 33 Cb 0.58 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2nln h SER 33 CO -0.62 0.40 -0.18 0.61 -0.87 0.00 0.00 176.83 176.16 2nln n GLY 34 N 1.56 -0.52 0.46 -0.77 0.00 0.44 -4.51 105.19 101.84 2nln n GLY 34 Ca -0.01 -0.06 0.27 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.20 0.00 -0.54 0.99 4.07 0.24 -3.12 115.31 116.75 2nln h LEU 35 Ca 0.00 0.00 0.10 0.00 0.08 0.00 0.00 57.88 58.07 2nln h LEU 35 Cb 0.18 -0.00 -0.10 0.00 1.08 0.00 0.00 40.66 41.82 2nln h LEU 35 CO 0.00 0.00 -0.15 -0.24 -1.08 0.00 0.00 178.44 176.97 2nln n SER 36 N -4.28 -0.22 -2.72 -0.43 2.88 0.41 -3.09 113.62 106.17 2nln n SER 36 Ca 0.17 0.94 -0.04 0.00 -1.33 0.00 0.00 58.87 58.61 2nln n SER 36 Cb 0.92 -0.27 0.08 0.00 -0.75 0.00 0.00 64.21 64.19 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 -4.87 1.37 -4.07 -1.46 4.76 -1.18 -5.07 118.16 107.64 2nln n LYS 37 Ca 0.08 -2.44 -0.23 0.00 -2.87 0.00 0.00 58.31 52.85 2nln n LYS 37 Cb 0.26 -0.61 -0.06 0.00 -1.84 0.00 0.00 35.03 32.78 2nln n LYS 37 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2nln s MET 38 N -1.65 2.35 0.85 1.97 -1.94 -1.18 -5.13 119.30 114.57 2nln s MET 38 Ca 0.21 -1.61 -0.12 0.00 -1.71 0.00 0.00 55.69 52.46 2nln s MET 38 Cb 0.41 -2.15 0.10 0.00 2.01 0.00 0.00 34.83 35.20 2nln s MET 38 CO -0.06 0.05 1.13 -1.12 -0.01 0.00 0.00 175.02 175.01 2nln s SER 39 N -3.87 4.06 0.20 3.03 0.01 -1.26 -4.98 113.70 110.89 2nln s SER 39 Ca 0.39 1.04 -0.09 0.00 1.31 0.00 0.00 55.95 58.60 2nln s SER 39 Cb -0.01 -1.66 0.14 0.00 0.21 0.00 0.00 66.02 64.70 2nln s SER 39 CO 0.23 -2.22 1.80 0.00 0.41 0.00 0.00 173.24 173.46 2nln h ALA 40 N -1.26 0.98 -0.12 1.44 0.00 -1.99 -3.23 119.26 115.07 2nln h ALA 40 Ca -0.49 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.30 2nln h ALA 40 Cb 1.31 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 2nln h ALA 40 CO 0.62 0.54 -0.54 0.77 0.00 0.00 0.00 179.25 180.64 2nln h SER 41 N 1.06 -1.70 0.17 0.00 0.02 -2.02 -0.69 113.55 110.40 2nln h SER 41 Ca 0.26 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.39 2nln h SER 41 Cb 0.12 0.66 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 2nln h SER 41 CO -0.03 -0.49 -0.08 0.06 -1.14 0.00 0.00 176.83 175.14 2nln h GLN 42 N -0.59 0.00 -0.11 3.45 3.07 -1.97 0.24 115.11 119.20 2nln h GLN 42 Ca 0.03 0.00 0.03 0.00 0.09 0.00 0.00 58.65 58.80 2nln h GLN 42 Cb 0.69 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.24 2nln h GLN 42 CO -0.43 0.08 0.08 0.28 0.09 0.00 0.00 178.83 178.94 2nln h VAL 43 N 0.00 0.85 -0.18 1.86 2.07 -1.14 0.99 116.25 120.69 2nln h VAL 43 Ca -0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2nln h VAL 43 Cb 0.19 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2nln h VAL 43 CO 0.01 0.00 0.03 0.11 0.02 0.00 0.00 177.57 177.74 2nln h LYS 44 N 0.00 0.10 -0.46 1.57 1.57 -0.71 0.65 116.57 119.29 2nln h LYS 44 Ca 0.05 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2nln h LYS 44 Cb 0.22 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2nln h LYS 44 CO -0.00 0.06 0.10 -0.44 -0.57 0.00 0.00 179.45 178.60 2nln h ASP 45 N 0.10 0.70 0.12 0.86 3.32 -1.00 -2.91 116.42 117.61 2nln h ASP 45 Ca 0.08 -0.24 0.02 0.00 0.02 0.00 0.00 57.03 56.91 2nln h ASP 45 Cb 0.08 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 2nln h ASP 45 CO -0.11 0.76 -0.27 0.40 -1.72 0.00 0.00 179.24 178.30 2nln h ILE 46 N 0.61 0.41 -0.91 0.35 5.03 -0.41 -1.69 117.51 120.90 2nln h ILE 46 Ca 0.14 0.00 0.36 0.00 -0.12 0.00 0.00 64.86 65.24 2nln h ILE 46 Cb 0.34 0.41 -0.16 0.00 -3.03 0.00 0.00 36.82 34.38 2nln h ILE 46 CO 0.00 0.00 0.42 0.33 -0.68 0.00 0.00 178.15 178.22 2nln n PHE 47 N -5.38 0.99 0.29 1.37 7.35 0.22 0.14 117.46 122.44 2nln n PHE 47 Ca -0.07 1.07 0.16 0.00 -0.76 0.00 0.00 57.45 57.86 2nln n PHE 47 Cb 0.30 -1.43 0.81 0.00 0.35 0.00 0.00 39.48 39.50 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 0.00 0.19 -4.13 2.47 -1.17 -2.40 114.38 109.34 2nln h ARG 48 Ca 0.74 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.46 2nln h ARG 48 Cb 1.90 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 30.19 2nln h ARG 48 CO -0.72 0.00 -0.42 0.35 0.56 0.00 0.00 179.97 179.74 2nln h PHE 49 N 0.00 -1.21 -0.00 3.04 3.57 0.11 -3.41 116.94 119.04 2nln h PHE 49 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2nln h PHE 49 Cb 0.74 0.50 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2nln h PHE 49 CO 0.00 -0.50 0.00 0.44 -2.23 0.00 0.00 178.31 176.02 2nln n ILE 50 N -4.88 0.00 -1.79 1.41 -5.35 -0.91 -4.54 119.36 103.30 2nln n ILE 50 Ca -0.08 0.00 -0.40 0.00 -0.27 0.00 0.00 62.75 62.00 2nln n ILE 50 Cb 0.35 -0.00 0.02 0.00 -1.74 0.00 0.00 39.64 38.26 2nln n ILE 50 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2nln s ASP 51 N -1.99 5.91 0.00 7.28 1.11 -1.26 -4.78 116.67 122.94 2nln s ASP 51 Ca 0.00 2.95 0.00 0.00 0.18 0.00 0.00 52.55 55.68 2nln s ASP 51 Cb 0.00 -2.66 0.00 0.00 1.07 0.00 0.00 42.92 41.33 2nln s ASP 51 CO 0.00 -1.16 0.00 -3.20 1.18 0.00 0.00 175.17 171.99 2nln n ASN 52 N -0.14 3.78 -3.41 0.27 5.15 -1.26 -4.79 115.26 114.87 2nln n ASN 52 Ca 0.05 -0.05 -0.40 0.00 -0.60 0.00 0.00 54.58 53.58 2nln n ASN 52 Cb 0.41 0.86 -0.02 0.00 -0.53 0.00 0.00 39.78 40.50 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 -1.23 7.88 -3.74 1.20 2.03 -1.26 -4.80 116.55 116.63 2nln n ASP 53 Ca 0.00 -2.69 -0.09 0.00 0.52 0.00 0.00 54.79 52.53 2nln n ASP 53 Cb 0.00 -1.55 -0.02 0.00 -0.72 0.00 0.00 41.12 38.83 2nln n ASP 53 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2nln s GLN 54 N 1.89 1.59 -1.23 -0.67 -0.21 -1.26 -5.08 119.66 114.70 2nln s GLN 54 Ca 0.64 -0.85 -0.07 0.00 0.02 0.00 0.00 55.36 55.10 2nln s GLN 54 Cb 0.17 0.59 0.20 0.00 1.00 0.00 0.00 33.01 34.97 2nln s GLN 54 CO -0.07 -0.71 1.84 0.43 -2.12 0.00 0.00 175.29 174.66 2nln n SER 55 N -0.42 5.87 -0.32 5.90 7.64 -1.26 -4.53 113.62 126.50 2nln n SER 55 Ca -0.08 -3.22 -0.04 0.00 1.01 0.00 0.00 58.87 56.54 2nln n SER 55 Cb 0.61 -1.40 -0.02 0.00 -1.01 0.00 0.00 64.21 62.40 2nln n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nln n GLY 56 N 2.17 0.63 3.46 0.23 0.00 -1.26 -5.01 105.19 105.42 2nln n GLY 56 Ca 0.39 -0.87 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.15 -0.42 0.08 1.61 -0.85 -1.26 -3.80 117.35 110.55 2nln s TYR 57 Ca 0.00 0.16 -0.03 0.00 -0.52 0.00 0.00 57.07 56.68 2nln s TYR 57 Cb 0.00 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.83 2nln s TYR 57 CO 0.00 -0.88 0.04 -0.51 -1.52 0.00 0.00 175.55 172.68 2nln s LEU 58 N -2.79 2.08 0.01 -3.49 1.43 -0.81 -4.55 118.68 110.56 2nln s LEU 58 Ca 0.03 -0.98 -0.08 0.00 -1.03 0.00 0.00 54.13 52.07 2nln s LEU 58 Cb -0.01 0.41 0.00 0.00 0.03 0.00 0.00 46.19 46.62 2nln s LEU 58 CO -0.10 -0.66 0.15 -0.62 0.23 0.00 0.00 176.35 175.35 2nln s ASP 59 N -2.94 0.02 0.51 2.29 -1.08 -1.26 -0.42 116.67 113.79 2nln s ASP 59 Ca 0.11 -0.23 0.45 0.00 -0.52 0.00 0.00 52.55 52.36 2nln s ASP 59 Cb 0.07 0.22 1.62 0.00 -1.46 0.00 0.00 42.92 43.37 2nln s ASP 59 CO -0.07 -0.41 1.50 0.61 0.52 0.00 0.00 175.17 177.32 2nln n GLY 60 N 1.30 -0.92 0.07 2.66 0.00 -1.21 0.13 105.19 107.22 2nln n GLY 60 Ca -0.22 0.68 -0.13 0.00 0.00 0.00 0.00 46.02 46.35 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 0.08 1.11 1.61 3.32 -1.95 -3.30 116.42 117.29 2nln h ASP 61 Ca 0.89 -0.57 -0.15 0.00 0.02 0.00 0.00 57.03 57.22 2nln h ASP 61 Cb 3.44 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 42.95 2nln h ASP 61 CO -0.11 0.64 -0.71 -0.33 -1.72 0.00 0.00 179.24 177.01 2nln h GLU 62 N -0.47 0.00 -0.75 3.56 4.39 0.74 -3.36 114.58 118.69 2nln h GLU 62 Ca 0.00 0.00 0.16 0.00 0.34 0.00 0.00 59.36 59.86 2nln h GLU 62 Cb 0.63 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.14 2nln h GLU 62 CO 0.01 0.71 -0.07 -0.07 -1.16 0.00 0.00 179.01 178.43 2nln h LEU 63 N 0.00 -0.49 -2.75 1.33 3.38 0.46 0.89 115.31 118.13 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 1.46 0.40 -0.00 0.00 0.09 0.00 0.00 40.66 42.61 2nln h LEU 63 CO 0.09 -0.21 0.03 0.07 0.09 0.00 0.00 178.44 178.51 2nln h LYS 64 N 0.05 0.00 0.00 1.13 2.10 -1.73 -1.12 116.57 117.00 2nln h LYS 64 Ca 0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.04 2nln h LYS 64 Cb 0.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2nln h LYS 64 CO -0.71 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.40 2nln n TYR 65 N -3.34 0.44 -0.21 0.07 4.01 0.31 -3.20 117.16 115.24 2nln n TYR 65 Ca -0.03 0.14 -0.06 0.00 -0.16 0.00 0.00 57.90 57.80 2nln n TYR 65 Cb 0.10 -0.73 -0.00 0.00 -0.31 0.00 0.00 39.34 38.40 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 -0.89 -0.72 3.57 -1.29 1.48 116.94 118.10 2nln h PHE 66 Ca 0.00 0.07 0.08 0.00 3.53 0.00 0.00 57.97 61.66 2nln h PHE 66 Cb 0.51 0.52 -0.06 0.00 2.79 0.00 0.00 35.95 39.71 2nln h PHE 66 CO 0.00 -0.39 0.58 -0.07 -2.23 0.00 0.00 178.31 176.20 2nln h LEU 67 N -0.17 0.83 -0.38 0.59 3.38 -1.81 0.22 115.31 117.97 2nln h LEU 67 Ca 0.23 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 2nln h LEU 67 Cb 0.55 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2nln h LEU 67 CO -0.69 0.51 -0.22 1.56 0.09 0.00 0.00 178.44 179.69 2nln h GLN 68 N 0.93 0.83 0.56 1.13 4.20 -0.04 0.75 115.11 123.47 2nln h GLN 68 Ca 0.40 -0.38 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2nln h GLN 68 Cb 0.32 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2nln h GLN 68 CO -0.16 1.01 -0.44 0.87 -0.67 0.00 0.00 178.83 179.44 2nln h LYS 69 N 0.63 -0.93 -0.36 1.46 1.79 0.44 1.69 116.57 121.29 2nln h LYS 69 Ca 0.08 0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 2nln h LYS 69 Cb 0.78 0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.63 2nln h LYS 69 CO 0.06 -0.62 0.13 0.35 -1.08 0.00 0.00 179.45 178.29 2nln h PHE 70 N -0.97 0.56 0.00 -1.35 3.57 -0.75 -3.37 116.94 114.64 2nln h PHE 70 Ca -0.07 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2nln h PHE 70 Cb 0.80 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.38 2nln h PHE 70 CO -0.16 0.53 -0.01 0.37 -2.23 0.00 0.00 178.31 176.81 2nln h GLN 71 N 0.43 0.00 0.00 1.11 4.15 0.56 -3.49 115.11 117.87 2nln h GLN 71 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2nln h GLN 71 Cb 0.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.91 2nln h GLN 71 CO -0.01 0.00 0.00 0.45 -1.93 0.00 0.00 178.83 177.34 2nln n SER 72 N -2.23 0.00 -0.32 -0.69 2.88 0.57 -4.93 113.62 108.90 2nln n SER 72 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2nln n SER 72 Cb 0.01 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2nln n SER 72 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2nln n ASP 73 N 0.00 0.00 -2.72 -3.46 9.92 -1.26 -5.01 116.55 114.02 2nln n ASP 73 Ca 0.00 -1.05 0.00 0.00 -0.53 0.00 0.00 54.79 53.21 2nln n ASP 73 Cb 0.00 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 2nln n ASP 73 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2nln n ALA 74 N 0.00 0.00 -1.98 2.24 0.00 -1.26 -4.99 120.51 114.51 2nln n ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nln n ALA 74 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.88 0.00 -2.68 0.00 1.85 -1.26 -4.83 116.66 108.85 2nln n ARG 75 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.79 2nln n ARG 75 Cb 0.00 0.00 0.07 0.00 -1.05 0.00 0.00 32.46 31.48 2nln n ARG 75 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2nln n GLU 76 N 0.00 0.72 -2.12 2.89 1.02 -1.25 -4.81 120.64 117.09 2nln n GLU 76 Ca 0.00 -1.32 -0.03 0.00 -0.02 0.00 0.00 57.16 55.78 2nln n GLU 76 Cb 0.00 -0.14 -0.01 0.00 -0.02 0.00 0.00 31.44 31.27 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 -0.37 -0.06 0.00 -4.62 4.77 -1.19 -4.53 117.00 110.99 2nln n LEU 77 Ca -0.11 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2nln n LEU 77 Cb 0.75 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2nln n LEU 77 CO -0.08 0.01 0.00 0.35 -1.33 0.00 0.00 177.39 176.34 2nln n THR 78 N -1.92 0.00 0.04 -5.08 -2.24 -1.26 -0.90 114.28 102.92 2nln n THR 78 Ca 0.01 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 2nln n THR 78 Cb 0.35 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.50 2nln n THR 78 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2nln h GLU 79 N 0.00 -0.10 -0.09 -0.78 4.81 -1.95 -3.31 114.58 113.15 2nln h GLU 79 Ca 0.00 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2nln h GLU 79 Cb 0.00 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2nln h GLU 79 CO 0.00 0.23 -0.09 0.66 -0.73 0.00 0.00 179.01 179.08 2nln h SER 80 N -0.45 0.24 -0.84 1.04 4.64 -1.85 -3.34 113.55 112.99 2nln h SER 80 Ca -0.01 -0.48 0.07 0.00 -0.47 0.00 0.00 61.79 60.90 2nln h SER 80 Cb 0.38 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 62.34 2nln h SER 80 CO 0.02 0.67 0.51 -0.08 -0.87 0.00 0.00 176.83 177.07 2nln h GLU 81 N -0.19 0.87 -0.02 4.77 4.22 -1.42 0.21 114.58 123.03 2nln h GLU 81 Ca 0.02 -0.05 0.01 0.00 0.08 0.00 0.00 59.36 59.41 2nln h GLU 81 Cb 0.60 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2nln h GLU 81 CO 0.02 0.58 0.13 1.79 -2.18 0.00 0.00 179.01 179.35 2nln h THR 82 N 0.90 0.07 -0.60 0.32 1.35 -1.11 0.46 112.91 114.30 2nln h THR 82 Ca 0.38 0.00 0.05 0.00 -0.55 0.00 0.00 66.41 66.29 2nln h THR 82 Cb 0.24 0.88 -0.03 0.00 -1.73 0.00 0.00 68.15 67.50 2nln h THR 82 CO -0.20 0.00 0.40 0.50 -0.25 0.00 0.00 175.52 175.97 2nln h LYS 83 N 0.00 0.59 0.43 4.72 3.64 -0.71 0.20 116.57 125.44 2nln h LYS 83 Ca 0.01 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2nln h LYS 83 Cb 0.27 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2nln h LYS 83 CO -0.00 0.39 -0.36 1.03 -2.27 0.00 0.00 179.45 178.24 2nln h SER 84 N 0.61 -0.95 -0.94 4.20 0.87 -0.16 1.17 113.55 118.35 2nln h SER 84 Ca 0.25 0.07 0.04 0.00 -1.23 0.00 0.00 61.79 60.92 2nln h SER 84 Cb 0.23 0.31 -0.05 0.00 -0.44 0.00 0.00 62.40 62.44 2nln h SER 84 CO -0.07 -0.52 0.62 -0.07 -0.53 0.00 0.00 176.83 176.26 2nln h LEU 85 N -0.79 1.02 0.17 2.23 3.38 -1.41 1.10 115.31 121.02 2nln h LEU 85 Ca -0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2nln h LEU 85 Cb 0.68 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2nln h LEU 85 CO -0.02 0.70 -0.08 0.24 0.09 0.00 0.00 178.44 179.37 2nln h MET 86 N 1.19 -0.22 0.00 1.13 2.86 -0.01 -2.07 114.93 117.81 2nln h MET 86 Ca 0.37 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 58.03 2nln h MET 86 Cb 0.01 0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.72 2nln h MET 86 CO -0.11 -0.10 0.00 -0.25 1.06 0.00 0.00 176.91 177.50 2nln n ASP 87 N -5.16 0.00 0.24 1.22 9.92 0.40 -3.09 116.55 120.07 2nln n ASP 87 Ca -0.09 -0.22 0.16 0.00 -0.53 0.00 0.00 54.79 54.11 2nln n ASP 87 Cb 0.14 -0.22 0.56 0.00 -0.64 0.00 0.00 41.12 40.96 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 3.20 1.00 -3.00 2.24 0.00 0.20 -3.46 119.26 119.44 2nln h ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nln h ALA 88 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2nln h ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2nln n ALA 89 N -2.04 0.00 -2.59 0.00 0.00 -1.23 -4.63 120.51 110.02 2nln n ALA 89 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 2nln n ALA 89 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 -0.14 4.95 -0.10 0.00 -0.08 -1.09 -4.54 116.55 115.55 2nln n ASP 90 Ca 0.00 -2.96 -0.15 0.00 -1.51 0.00 0.00 54.79 50.17 2nln n ASP 90 Cb 0.00 -1.63 -0.09 0.00 2.34 0.00 0.00 41.12 41.74 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 6.39 2.32 -1.43 1.67 0.23 -1.18 0.48 115.26 123.75 2nln n ASN 91 Ca 0.43 -0.08 -0.05 0.00 -0.53 0.00 0.00 54.58 54.35 2nln n ASN 91 Cb 0.42 -0.35 0.23 0.00 -2.08 0.00 0.00 39.78 38.00 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 -3.18 3.36 0.00 0.53 9.92 -1.26 -4.53 116.55 121.39 2nln n ASP 92 Ca -0.37 -3.51 0.00 0.00 -0.53 0.00 0.00 54.79 50.38 2nln n ASP 92 Cb 0.88 -0.67 0.00 0.00 -0.64 0.00 0.00 41.12 40.69 2nln n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2nln n GLY 93 N -0.85 1.00 0.07 0.44 0.00 -1.26 -5.06 105.19 99.52 2nln n GLY 93 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 -0.03 0.00 1.61 -0.08 -1.26 -5.02 116.55 111.77 2nln n ASP 94 Ca 0.00 0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.37 2nln n ASP 94 Cb 0.24 0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.82 2nln n ASP 94 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2nln n GLY 95 N -1.41 0.78 3.75 0.27 0.00 0.18 -4.96 105.19 103.79 2nln n GLY 95 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 2.69 -0.35 1.61 2.36 -1.14 -3.33 119.74 121.58 2nln s LYS 96 Ca 0.00 -1.04 0.02 0.00 -2.55 0.00 0.00 55.97 52.40 2nln s LYS 96 Cb 0.00 -2.49 0.11 0.00 -1.05 0.00 0.00 37.83 34.39 2nln s LYS 96 CO 0.00 0.45 0.10 0.42 1.55 0.00 0.00 175.35 177.87 2nln s ILE 97 N -1.88 1.54 0.43 5.43 -1.09 0.44 -2.66 121.20 123.42 2nln s ILE 97 Ca 0.30 -1.98 0.07 0.00 -2.23 0.00 0.00 60.65 56.82 2nln s ILE 97 Cb -0.09 -2.14 -0.03 0.00 -1.58 0.00 0.00 42.46 38.62 2nln s ILE 97 CO 0.22 -0.68 0.28 -0.83 -1.23 0.00 0.00 174.94 172.70 2nln s GLY 98 N 1.11 2.28 0.18 6.18 0.00 -1.26 -1.93 107.32 113.88 2nln s GLY 98 Ca 0.11 -1.92 -0.14 0.00 0.00 0.00 0.00 44.72 42.78 2nln s GLY 98 CO -0.15 -1.84 1.70 0.00 0.00 0.00 0.00 173.10 172.81 2nln h ALA 99 N 1.20 0.46 0.17 3.20 0.00 -1.95 1.60 119.26 123.94 2nln h ALA 99 Ca -0.42 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2nln h ALA 99 Cb 1.26 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2nln h ALA 99 CO 0.64 -0.36 -0.08 -0.44 0.00 0.00 0.00 179.25 179.01 2nln h ASP 100 N 0.16 -0.20 0.25 0.00 3.32 -1.96 0.44 116.42 118.43 2nln h ASP 100 Ca 0.23 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 2nln h ASP 100 Cb 0.32 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 2nln h ASP 100 CO -0.35 -0.08 -0.15 -0.33 -1.72 0.00 0.00 179.24 176.61 2nln h GLU 101 N -0.30 -0.36 -0.76 3.56 3.07 -1.78 -1.81 114.58 116.20 2nln h GLU 101 Ca -0.02 0.02 0.13 0.00 -0.50 0.00 0.00 59.36 58.99 2nln h GLU 101 Cb 0.23 0.08 -0.09 0.00 -0.84 0.00 0.00 28.75 28.14 2nln h GLU 101 CO 0.04 -0.24 0.34 0.35 -1.40 0.00 0.00 179.01 178.10 2nln h PHE 102 N -0.38 0.60 -0.13 4.33 3.04 0.24 0.25 116.94 124.90 2nln h PHE 102 Ca -0.03 0.03 0.04 0.00 3.98 0.00 0.00 57.97 61.99 2nln h PHE 102 Cb 0.31 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.66 2nln h PHE 102 CO -0.08 0.14 0.10 1.96 -2.02 0.00 0.00 178.31 178.42 2nln h GLN 103 N 0.53 0.00 -0.76 1.11 1.08 0.51 -1.83 115.11 115.74 2nln h GLN 103 Ca 0.40 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.55 2nln h GLN 103 Cb 0.54 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.94 2nln h GLN 103 CO -0.35 0.00 0.26 0.93 -0.95 0.00 0.00 178.83 178.72 2nln h GLU 104 N 0.00 1.17 0.30 1.46 4.39 0.32 -1.88 114.58 120.33 2nln h GLU 104 Ca 0.06 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 2nln h GLU 104 Cb 0.27 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2nln h GLU 104 CO -0.00 0.97 -0.14 1.98 -1.16 0.00 0.00 179.01 180.66 2nln h MET 105 N 1.12 -0.38 -0.34 2.33 4.05 -1.27 0.79 114.93 121.24 2nln h MET 105 Ca 0.25 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.68 2nln h MET 105 Cb 0.28 0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.14 2nln h MET 105 CO -0.01 -0.25 0.15 -0.24 0.23 0.00 0.00 176.91 176.79 2nln h VAL 106 N -0.41 1.13 0.00 -5.77 3.04 -1.54 -0.84 116.25 111.86 2nln h VAL 106 Ca -0.04 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 2nln h VAL 106 Cb 0.31 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 30.30 2nln h VAL 106 CO 0.07 0.15 0.00 0.45 -1.01 0.00 0.00 177.57 177.22 2nln h HIS 107 N 0.47 0.00 0.00 3.17 -0.00 -0.96 -3.50 115.15 114.34 2nln h HIS 107 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2nln h HIS 107 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.49 2nln h HIS 107 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.93 178.38