#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bmo s MET 2 N 0.00 1.38 -0.17 0.03 1.00 -1.26 -4.60 119.30 115.68 2bmo s MET 2 Ca 0.00 -1.56 -0.07 0.00 0.00 0.00 0.00 55.69 54.06 2bmo s MET 2 Cb 0.00 -1.31 -0.04 0.00 0.00 0.00 0.00 34.83 33.47 2bmo s MET 2 CO 0.00 0.24 0.07 0.42 0.00 0.00 0.00 175.02 175.75 2bmo s ILE 3 N -2.57 4.90 -0.58 2.53 1.01 -1.26 -5.06 121.20 120.17 2bmo s ILE 3 Ca 0.22 -0.00 -0.21 0.00 0.00 0.00 0.00 60.65 60.65 2bmo s ILE 3 Cb -0.03 -3.19 0.07 0.00 0.01 0.00 0.00 42.46 39.32 2bmo s ILE 3 CO 0.08 0.49 0.81 0.21 0.00 0.00 0.00 174.94 176.53 2bmo s ASN 4 N 0.07 6.23 0.22 3.58 3.84 -1.26 -4.92 114.94 122.69 2bmo s ASN 4 Ca 0.06 -0.92 0.24 0.00 0.21 0.00 0.00 52.86 52.45 2bmo s ASN 4 Cb -0.12 -2.36 0.92 0.00 -0.55 0.00 0.00 41.25 39.14 2bmo s ASN 4 CO 0.00 -1.17 1.72 0.35 -2.79 0.00 0.00 177.10 175.21 2bmo n THR 5 N 5.82 0.75 -0.10 -5.21 -2.24 -1.26 -0.60 114.28 111.44 2bmo n THR 5 Ca -0.05 0.09 -0.13 0.00 -2.27 0.00 0.00 64.05 61.69 2bmo n THR 5 Cb 0.45 -0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 67.67 2bmo n THR 5 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2bmo h GLN 6 N 0.00 0.76 0.16 -0.78 4.15 -1.95 -3.32 115.11 114.14 2bmo h GLN 6 Ca 0.00 -0.41 -0.32 0.00 0.77 0.00 0.00 58.65 58.69 2bmo h GLN 6 Cb 0.46 0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.17 2bmo h GLN 6 CO 0.00 1.03 -1.58 1.05 -1.93 0.00 0.00 178.83 177.40 2bmo h GLU 7 N 0.52 0.35 -4.82 1.69 4.11 -1.90 -3.40 114.58 111.13 2bmo h GLU 7 Ca 0.05 -0.59 -0.73 0.00 0.07 0.00 0.00 59.36 58.16 2bmo h GLU 7 Cb 0.90 0.22 -0.18 0.00 0.50 0.00 0.00 28.75 30.20 2bmo h GLU 7 CO 0.08 1.24 1.23 -0.51 0.07 0.00 0.00 179.01 181.12 2bmo s ASP 8 N -7.19 6.97 0.53 3.06 -0.00 0.23 -4.86 116.67 115.41 2bmo s ASP 8 Ca -0.11 -2.77 0.34 0.00 -0.00 0.00 0.00 52.55 50.01 2bmo s ASP 8 Cb 0.06 -2.40 1.53 0.00 -0.00 0.00 0.00 42.92 42.11 2bmo s ASP 8 CO 0.87 -0.82 2.02 0.11 -0.00 0.00 0.00 175.17 177.35 2bmo h LYS 9 N 7.55 0.00 -0.01 8.23 1.57 -1.78 -2.45 116.57 129.68 2bmo h LYS 9 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2bmo h LYS 9 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2bmo h LYS 9 CO 1.21 0.00 -0.47 1.28 -0.57 0.00 0.00 179.45 180.90 2bmo n LEU 10 N -2.94 1.05 -4.69 2.94 4.77 -1.26 -4.92 117.00 111.94 2bmo n LEU 10 Ca -0.00 -0.31 -0.37 0.00 -0.03 0.00 0.00 56.01 55.30 2bmo n LEU 10 Cb 0.24 -0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 2bmo n LEU 10 CO 0.24 0.21 0.06 -0.69 -1.33 0.00 0.00 177.39 175.88 2bmo s VAL 11 N -2.71 5.24 0.57 4.08 1.01 -0.92 -5.07 120.40 122.59 2bmo s VAL 11 Ca 0.17 0.66 -0.17 0.00 0.00 0.00 0.00 61.98 62.64 2bmo s VAL 11 Cb 0.18 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2bmo s VAL 11 CO 0.63 0.30 1.05 -0.94 0.00 0.00 0.00 175.10 176.15 2bmo s SER 12 N 0.83 5.94 0.22 3.32 1.04 -1.26 -4.90 113.70 118.90 2bmo s SER 12 Ca 0.18 1.83 -0.07 0.00 0.48 0.00 0.00 55.95 58.37 2bmo s SER 12 Cb -0.14 -2.54 0.30 0.00 0.10 0.00 0.00 66.02 63.74 2bmo s SER 12 CO 0.07 -1.06 1.81 0.00 0.98 0.00 0.00 173.24 175.03 2bmo h ALA 13 N 0.69 0.99 -0.09 5.32 0.00 -1.98 -0.56 119.26 123.62 2bmo h ALA 13 Ca -0.47 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.49 2bmo h ALA 13 Cb 1.22 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2bmo h ALA 13 CO 0.58 0.07 -0.10 1.25 0.00 0.00 0.00 179.25 181.05 2bmo h HIS 14 N 0.72 -0.24 -0.39 0.00 -0.00 -2.00 -1.87 115.15 111.38 2bmo h HIS 14 Ca 0.33 0.01 -0.10 0.00 -0.00 0.00 0.00 60.37 60.62 2bmo h HIS 14 Cb 0.25 0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.77 2bmo h HIS 14 CO -0.08 -0.15 -0.17 -0.44 -0.00 0.00 0.00 177.93 177.09 2bmo h ASP 15 N -0.12 0.73 -0.39 3.26 3.45 -1.83 -1.98 116.42 119.53 2bmo h ASP 15 Ca 0.07 -0.24 0.00 0.00 0.43 0.00 0.00 57.03 57.29 2bmo h ASP 15 Cb 0.22 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 2bmo h ASP 15 CO -0.17 0.90 0.25 0.00 -1.57 0.00 0.00 179.24 178.66 2bmo h ALA 16 N 1.16 0.50 -0.69 3.45 0.00 -0.91 -0.90 119.26 121.86 2bmo h ALA 16 Ca 0.10 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2bmo h ALA 16 Cb 0.65 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2bmo h ALA 16 CO 0.05 -0.03 0.18 0.93 0.00 0.00 0.00 179.25 180.37 2bmo h GLU 17 N 0.52 1.10 0.00 0.00 3.07 -1.19 -2.33 114.58 115.75 2bmo h GLU 17 Ca 0.14 -0.26 -0.09 0.00 -0.50 0.00 0.00 59.36 58.66 2bmo h GLU 17 Cb -0.03 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.72 2bmo h GLU 17 CO -0.03 0.97 -0.41 1.49 -1.40 0.00 0.00 179.01 179.64 2bmo h GLU 18 N 1.04 0.00 -0.17 2.33 4.57 -1.13 -1.03 114.58 120.19 2bmo h GLU 18 Ca 0.22 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.36 2bmo h GLU 18 Cb 0.36 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 2bmo h GLU 18 CO 0.00 0.41 -0.06 0.35 -1.18 0.00 0.00 179.01 178.53 2bmo h PHE 19 N 0.00 0.38 -0.69 0.92 3.57 -0.98 -2.93 116.94 117.22 2bmo h PHE 19 Ca -0.00 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.41 2bmo h PHE 19 Cb 0.79 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 2bmo h PHE 19 CO 0.00 0.62 0.42 1.25 -2.23 0.00 0.00 178.31 178.38 2bmo h HIS 20 N 0.03 0.90 -0.44 0.41 2.76 -1.06 -0.87 115.15 116.88 2bmo h HIS 20 Ca 0.04 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.29 2bmo h HIS 20 Cb 0.51 -0.30 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 2bmo h HIS 20 CO 0.06 0.60 0.07 -0.09 -1.30 0.00 0.00 177.93 177.27 2bmo h ARG 21 N 0.94 0.19 0.00 5.26 2.43 -1.21 -1.45 114.38 120.54 2bmo h ARG 21 Ca 0.25 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 2bmo h ARG 21 Cb -0.05 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 2bmo h ARG 21 CO -0.05 0.13 -0.41 0.74 -1.51 0.00 0.00 179.97 178.87 2bmo h PHE 22 N 0.20 0.00 0.49 2.20 0.04 -1.31 -2.00 116.94 116.56 2bmo h PHE 22 Ca 0.22 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.96 2bmo h PHE 22 Cb 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.44 2bmo h PHE 22 CO -0.22 0.41 -0.24 0.35 -0.60 0.00 0.00 178.31 178.01 2bmo h PHE 23 N 0.00 -0.61 0.00 -0.55 3.57 -0.59 -3.25 116.94 115.51 2bmo h PHE 23 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 2bmo h PHE 23 Cb 1.17 0.20 -0.00 0.00 2.79 0.00 0.00 35.95 40.11 2bmo h PHE 23 CO 0.00 -0.29 -0.01 -0.39 -2.23 0.00 0.00 178.31 175.39 2bmo h VAL 24 N -1.01 0.03 -0.02 1.41 -1.51 -1.35 -3.10 116.25 110.70 2bmo h VAL 24 Ca -0.07 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2bmo h VAL 24 Cb 0.60 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2bmo h VAL 24 CO 0.11 0.01 0.00 0.61 -1.23 0.00 0.00 177.57 177.07 2bmo n GLY 25 N 0.42 -0.52 3.67 5.19 0.00 -0.75 -4.92 105.19 108.28 2bmo n GLY 25 Ca 0.02 -0.31 -0.46 0.00 0.00 0.00 0.00 46.02 45.28 2bmo n GLY 25 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2bmo n HIS 26 N -0.43 2.33 -3.68 1.61 -0.00 -1.17 -4.50 115.22 109.37 2bmo n HIS 26 Ca 0.21 0.25 -0.14 0.00 -0.00 0.00 0.00 57.72 58.04 2bmo n HIS 26 Cb 0.22 -2.56 -0.13 0.00 -0.00 0.00 0.00 29.99 27.52 2bmo n HIS 26 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2bmo s ASP 27 N 0.93 0.25 0.25 0.26 -1.08 -1.26 -5.07 116.67 110.95 2bmo s ASP 27 Ca 0.78 0.54 -0.04 0.00 -0.52 0.00 0.00 52.55 53.31 2bmo s ASP 27 Cb -0.66 0.57 0.29 0.00 -1.46 0.00 0.00 42.92 41.66 2bmo s ASP 27 CO 0.37 -0.22 1.82 0.77 0.52 0.00 0.00 175.17 178.43 2bmo h SER 28 N 8.02 0.95 -0.48 -0.34 4.64 -1.99 -0.18 113.55 124.17 2bmo h SER 28 Ca -0.21 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 60.94 2bmo h SER 28 Cb 1.12 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.95 2bmo h SER 28 CO 0.20 0.86 0.21 0.44 -0.87 0.00 0.00 176.83 177.67 2bmo h ASP 29 N 1.01 0.65 -0.73 4.97 3.32 -2.00 -2.47 116.42 121.16 2bmo h ASP 29 Ca 0.23 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 2bmo h ASP 29 Cb 0.22 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 2bmo h ASP 29 CO -0.02 0.62 0.23 0.25 -1.72 0.00 0.00 179.24 178.60 2bmo h LEU 30 N 0.63 1.07 -0.46 1.55 5.85 -1.85 -1.64 115.31 120.45 2bmo h LEU 30 Ca 0.16 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.73 2bmo h LEU 30 Cb 0.16 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 2bmo h LEU 30 CO -0.02 0.99 0.21 1.56 -0.34 0.00 0.00 178.44 180.85 2bmo h GLN 31 N 1.09 0.41 -0.31 1.25 1.08 -0.86 0.33 115.11 118.10 2bmo h GLN 31 Ca 0.24 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.39 2bmo h GLN 31 Cb 0.31 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2bmo h GLN 31 CO -0.01 0.27 0.10 1.96 -0.95 0.00 0.00 178.83 180.20 2bmo h GLN 32 N 0.42 0.48 -0.46 1.46 4.20 -1.17 -1.12 115.11 118.92 2bmo h GLN 32 Ca 0.21 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2bmo h GLN 32 Cb 0.15 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2bmo h GLN 32 CO -0.17 0.52 0.26 1.49 -0.67 0.00 0.00 178.83 180.27 2bmo h GLU 33 N 0.34 0.64 -0.06 1.46 4.81 -0.91 -1.80 114.58 119.07 2bmo h GLU 33 Ca 0.10 -0.07 -0.18 0.00 -0.13 0.00 0.00 59.36 59.08 2bmo h GLU 33 Cb 0.24 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2bmo h GLU 33 CO -0.00 0.49 -0.75 0.28 -0.73 0.00 0.00 179.01 178.30 2bmo h VAL 34 N 0.61 1.40 -0.58 0.32 2.07 -0.91 -1.67 116.25 117.50 2bmo h VAL 34 Ca 0.16 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.47 2bmo h VAL 34 Cb 0.03 2.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 2bmo h VAL 34 CO -0.03 0.66 0.36 0.74 0.02 0.00 0.00 177.57 179.32 2bmo h THR 35 N 0.22 1.16 -0.38 2.57 2.02 -1.01 -0.73 112.91 116.77 2bmo h THR 35 Ca -0.03 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 2bmo h THR 35 Cb 1.32 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 2bmo h THR 35 CO 0.12 0.16 0.20 0.74 0.37 0.00 0.00 175.52 177.12 2bmo h THR 36 N 0.78 1.15 -0.28 3.16 2.02 -1.16 -1.13 112.91 117.45 2bmo h THR 36 Ca 0.21 -0.39 0.06 0.00 0.77 0.00 0.00 66.41 67.05 2bmo h THR 36 Cb -0.05 0.72 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 2bmo h THR 36 CO -0.04 0.15 -0.07 0.25 0.37 0.00 0.00 175.52 176.18 2bmo h LEU 37 N 0.48 -0.26 -0.81 2.58 5.85 -0.96 -0.41 115.31 121.78 2bmo h LEU 37 Ca 0.13 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 2bmo h LEU 37 Cb 0.06 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2bmo h LEU 37 CO -0.02 -0.09 -0.57 -0.07 -0.34 0.00 0.00 178.44 177.35 2bmo h LEU 38 N 0.00 0.09 -0.32 2.25 3.38 -0.96 -0.97 115.31 118.79 2bmo h LEU 38 Ca 0.13 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 2bmo h LEU 38 Cb 0.20 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2bmo h LEU 38 CO -0.28 0.64 -0.11 0.74 0.09 0.00 0.00 178.44 179.52 2bmo h THR 39 N 0.06 1.28 -0.54 0.22 2.02 -0.85 -1.36 112.91 113.75 2bmo h THR 39 Ca -0.00 -1.18 -0.00 0.00 0.77 0.00 0.00 66.41 66.00 2bmo h THR 39 Cb 1.02 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.80 2bmo h THR 39 CO 0.08 0.38 0.33 0.03 0.37 0.00 0.00 175.52 176.71 2bmo h ARG 40 N 0.40 0.74 -0.31 6.66 3.08 -0.89 -1.06 114.38 123.00 2bmo h ARG 40 Ca 0.08 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2bmo h ARG 40 Cb 0.61 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 2bmo h ARG 40 CO 0.04 0.54 0.19 1.49 -1.07 0.00 0.00 179.97 181.16 2bmo h GLU 41 N 0.73 0.42 -0.56 0.04 4.81 -1.07 -1.36 114.58 117.59 2bmo h GLU 41 Ca 0.20 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.32 2bmo h GLU 41 Cb -0.01 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2bmo h GLU 41 CO -0.04 0.32 0.07 0.00 -0.73 0.00 0.00 179.01 178.63 2bmo h ALA 42 N 1.08 1.07 -0.28 2.92 0.00 -1.07 -1.47 119.26 121.51 2bmo h ALA 42 Ca 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2bmo h ALA 42 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2bmo h ALA 42 CO -0.02 0.60 0.12 1.25 0.00 0.00 0.00 179.25 181.20 2bmo h HIS 43 N 0.86 0.41 -0.63 0.00 -0.00 -0.90 0.11 115.15 115.00 2bmo h HIS 43 Ca 0.17 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.54 2bmo h HIS 43 Cb 0.41 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 2bmo h HIS 43 CO 0.03 0.39 0.40 1.25 -0.00 0.00 0.00 177.93 180.00 2bmo h LEU 44 N 0.31 0.67 -0.67 0.26 5.85 -0.98 -2.04 115.31 118.72 2bmo h LEU 44 Ca 0.09 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 2bmo h LEU 44 Cb 0.14 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2bmo h LEU 44 CO -0.01 0.48 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.40 2bmo h LEU 45 N 0.80 0.93 -1.32 2.25 3.38 -1.13 -1.47 115.31 118.76 2bmo h LEU 45 Ca 0.24 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2bmo h LEU 45 Cb -0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2bmo h LEU 45 CO -0.08 1.04 0.10 0.44 0.09 0.00 0.00 178.44 180.04 2bmo h ASP 46 N 0.84 0.52 -0.20 -0.43 3.32 -0.43 -0.70 116.42 119.34 2bmo h ASP 46 Ca 0.14 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2bmo h ASP 46 Cb 0.63 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.05 2bmo h ASP 46 CO 0.04 0.52 0.00 2.30 -1.72 0.00 0.00 179.24 180.38 2bmo n ILE 47 N -4.34 0.26 -2.39 0.35 -5.35 -0.82 -4.37 119.36 102.70 2bmo n ILE 47 Ca 0.02 -0.35 -0.12 0.00 -0.27 0.00 0.00 62.75 62.04 2bmo n ILE 47 Cb 0.18 0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 2bmo n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bmo n GLN 48 N 0.28 -1.62 -1.84 6.28 6.02 -0.27 -4.92 117.38 121.32 2bmo n GLN 48 Ca 0.14 0.55 -0.41 0.00 -0.01 0.00 0.00 57.00 57.28 2bmo n GLN 48 Cb 0.29 -4.66 -0.01 0.00 1.02 0.00 0.00 30.24 26.89 2bmo n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bmo n ALA 49 N -2.02 6.54 0.08 -1.58 0.00 -0.57 -4.73 120.51 118.22 2bmo n ALA 49 Ca -0.11 -3.95 -0.01 0.00 0.00 0.00 0.00 53.44 49.37 2bmo n ALA 49 Cb 0.59 -3.10 0.28 0.00 0.00 0.00 0.00 19.45 17.22 2bmo n ALA 49 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2bmo h TYR 50 N 5.16 0.34 -0.21 0.00 0.99 -1.91 -1.16 116.97 120.18 2bmo h TYR 50 Ca 0.67 -0.06 -0.07 0.00 2.00 0.00 0.00 58.73 61.26 2bmo h TYR 50 Cb 0.42 -0.09 -0.00 0.00 1.00 0.00 0.00 36.73 38.05 2bmo h TYR 50 CO 1.59 0.54 -0.14 -0.22 -0.00 0.00 0.00 178.16 179.93 2bmo h LYS 51 N 0.28 0.47 -0.95 4.88 3.11 -1.94 -1.01 116.57 121.41 2bmo h LYS 51 Ca 0.04 -0.22 -0.00 0.00 -2.81 0.00 0.00 60.65 57.66 2bmo h LYS 51 Cb 0.60 -0.01 -0.05 0.00 -1.00 0.00 0.00 32.23 31.78 2bmo h LYS 51 CO 0.04 0.77 0.59 0.00 -2.81 0.00 0.00 179.45 178.04 2bmo h ALA 52 N 0.69 1.21 0.16 5.00 0.00 -1.91 -0.29 119.26 124.12 2bmo h ALA 52 Ca 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2bmo h ALA 52 Cb 0.65 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2bmo h ALA 52 CO 0.04 0.65 -0.08 2.35 0.00 0.00 0.00 179.25 182.21 2bmo h TRP 53 N 1.31 -0.20 -0.63 0.00 7.01 -1.10 0.22 115.95 122.55 2bmo h TRP 53 Ca 0.34 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.28 2bmo h TRP 53 Cb -0.08 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 2bmo h TRP 53 CO 0.00 -0.07 0.14 1.25 -2.79 0.00 0.00 178.44 176.97 2bmo h LEU 54 N -0.29 0.93 -0.02 0.65 5.85 -0.92 0.53 115.31 122.05 2bmo h LEU 54 Ca -0.02 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.39 2bmo h LEU 54 Cb 0.22 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.02 2bmo h LEU 54 CO 0.04 0.91 -0.45 -0.08 -0.34 0.00 0.00 178.44 178.52 2bmo h GLU 55 N 0.94 0.34 0.00 1.25 4.81 -0.99 -3.28 114.58 117.66 2bmo h GLU 55 Ca 0.20 -0.34 -0.15 0.00 -0.13 0.00 0.00 59.36 58.94 2bmo h GLU 55 Cb 0.35 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 2bmo h GLU 55 CO 0.00 1.02 -2.09 0.72 -0.73 0.00 0.00 179.01 177.92 2bmo n HIS 56 N -4.33 0.08 0.59 0.92 8.25 0.06 -4.50 115.22 116.29 2bmo n HIS 56 Ca -0.10 0.03 0.06 0.00 -0.26 0.00 0.00 57.72 57.45 2bmo n HIS 56 Cb 0.59 -0.74 -0.06 0.00 1.12 0.00 0.00 29.99 30.91 2bmo n HIS 56 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2bmo n PHE 57 N -2.49 0.00 -4.96 4.41 3.01 0.16 -4.76 117.46 112.83 2bmo n PHE 57 Ca -0.15 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.00 2bmo n PHE 57 Cb 0.81 0.00 -0.17 0.00 -0.01 0.00 0.00 39.48 40.11 2bmo n PHE 57 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2bmo s VAL 58 N -2.09 1.87 0.48 -4.37 1.01 -1.11 -0.16 120.40 116.04 2bmo s VAL 58 Ca 0.06 -0.90 -0.19 0.00 0.00 0.00 0.00 61.98 60.95 2bmo s VAL 58 Cb 0.10 -1.64 -0.09 0.00 0.00 0.00 0.00 36.38 34.75 2bmo s VAL 58 CO 0.48 0.52 0.99 0.00 0.00 0.00 0.00 175.10 177.09 2bmo s ALA 59 N 0.53 2.99 0.42 5.51 0.00 0.04 -4.72 121.76 126.53 2bmo s ALA 59 Ca -0.15 0.38 0.19 0.00 0.00 0.00 0.00 51.96 52.38 2bmo s ALA 59 Cb -0.17 -3.17 1.11 0.00 0.00 0.00 0.00 23.12 20.89 2bmo s ALA 59 CO 0.05 -0.14 1.83 -1.35 0.00 0.00 0.00 175.76 176.16 2bmo h PRO 60 N 1.45 0.37 -0.30 0.00 0.11 -1.94 -1.36 132.00 130.33 2bmo h PRO 60 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2bmo h PRO 60 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2bmo h PRO 60 CO 0.60 0.25 0.00 -0.85 -0.21 0.00 0.00 178.00 177.79 2bmo n GLU 61 N -4.52 1.62 -1.54 1.05 0.00 -1.26 -4.33 120.64 111.66 2bmo n GLU 61 Ca 0.21 -0.86 -0.48 0.00 0.00 0.00 0.00 57.16 56.02 2bmo n GLU 61 Cb 0.76 -1.24 -0.04 0.00 0.00 0.00 0.00 31.44 30.93 2bmo n GLU 61 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 2bmo n ILE 62 N 0.19 1.33 -4.08 3.84 0.13 -0.51 -4.90 119.36 115.36 2bmo n ILE 62 Ca 0.08 -0.33 -0.32 0.00 -1.10 0.00 0.00 62.75 61.08 2bmo n ILE 62 Cb 0.24 -0.63 -0.16 0.00 -0.84 0.00 0.00 39.64 38.25 2bmo n ILE 62 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 2bmo s LYS 63 N -0.78 2.51 -0.38 9.51 2.20 -0.71 -4.16 119.74 127.94 2bmo s LYS 63 Ca 0.69 -1.02 -0.04 0.00 -0.36 0.00 0.00 55.97 55.24 2bmo s LYS 63 Cb -0.87 -2.65 0.08 0.00 -1.51 0.00 0.00 37.83 32.89 2bmo s LYS 63 CO 0.55 -0.39 0.15 -0.47 -0.36 0.00 0.00 175.35 174.84 2bmo s TYR 64 N 1.24 3.44 -0.07 4.03 5.04 -0.32 -1.68 117.35 129.03 2bmo s TYR 64 Ca -0.01 -2.06 0.02 0.00 -2.44 0.00 0.00 57.07 52.58 2bmo s TYR 64 Cb -0.16 -2.83 0.01 0.00 0.35 0.00 0.00 41.96 39.33 2bmo s TYR 64 CO -0.09 -0.89 -0.14 -1.14 -1.34 0.00 0.00 175.55 171.95 2bmo s GLN 65 N 1.23 1.89 -0.09 4.97 0.74 0.28 -0.67 119.66 128.01 2bmo s GLN 65 Ca 0.03 -0.47 -0.00 0.00 0.05 0.00 0.00 55.36 54.97 2bmo s GLN 65 Cb -0.22 -1.54 0.02 0.00 1.10 0.00 0.00 33.01 32.38 2bmo s GLN 65 CO -0.02 0.04 -0.07 0.08 -0.55 0.00 0.00 175.29 174.77 2bmo s VAL 66 N 0.65 0.90 0.19 1.34 1.01 -0.41 -1.26 120.40 122.83 2bmo s VAL 66 Ca -0.15 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 61.67 2bmo s VAL 66 Cb -0.16 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 2bmo s VAL 66 CO 0.04 0.34 0.03 0.27 0.00 0.00 0.00 175.10 175.78 2bmo s ILE 67 N 1.52 3.83 -0.20 2.22 -4.36 0.06 -0.40 121.20 123.86 2bmo s ILE 67 Ca 0.01 -1.45 -0.01 0.00 -0.26 0.00 0.00 60.65 58.94 2bmo s ILE 67 Cb -0.13 -2.95 0.01 0.00 1.25 0.00 0.00 42.46 40.63 2bmo s ILE 67 CO -0.05 -0.16 -0.14 -0.55 0.24 0.00 0.00 174.94 174.27 2bmo s SER 68 N -3.13 3.56 -0.22 4.36 0.15 -0.29 -1.27 113.70 116.87 2bmo s SER 68 Ca 0.29 -0.56 -0.16 0.00 0.70 0.00 0.00 55.95 56.22 2bmo s SER 68 Cb -0.09 -1.57 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 2bmo s SER 68 CO 0.20 -0.01 0.40 -0.60 1.20 0.00 0.00 173.24 174.43 2bmo s ARG 69 N 1.36 4.14 0.37 5.44 3.52 -1.26 -1.52 118.95 130.99 2bmo s ARG 69 Ca 0.05 0.19 -0.28 0.00 -0.13 0.00 0.00 55.73 55.56 2bmo s ARG 69 Cb -0.13 -3.56 -0.11 0.00 -1.56 0.00 0.00 34.95 29.58 2bmo s ARG 69 CO -0.09 -0.09 1.51 -2.00 -0.81 0.00 0.00 175.30 173.81 2bmo s GLU 70 N 1.49 4.10 -0.30 5.12 2.12 0.54 -4.89 118.70 126.88 2bmo s GLU 70 Ca 0.19 2.59 -0.27 0.00 0.36 0.00 0.00 54.97 57.84 2bmo s GLU 70 Cb -0.15 -2.97 0.01 0.00 0.26 0.00 0.00 34.13 31.28 2bmo s GLU 70 CO 0.08 -0.56 0.94 -0.51 -0.54 0.00 0.00 175.26 174.67 2bmo s LEU 71 N -1.89 4.03 0.22 2.70 1.43 -1.26 -4.97 118.68 118.94 2bmo s LEU 71 Ca 0.54 0.95 0.10 0.00 -1.03 0.00 0.00 54.13 54.70 2bmo s LEU 71 Cb -0.47 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 2bmo s LEU 71 CO 0.62 -0.73 -0.14 -0.13 0.23 0.00 0.00 176.35 176.20 2bmo s ARG 72 N 3.27 1.89 0.28 1.70 1.81 -1.26 -5.10 118.95 121.53 2bmo s ARG 72 Ca 0.40 -1.46 -0.29 0.00 -1.72 0.00 0.00 55.73 52.65 2bmo s ARG 72 Cb -0.14 -2.00 -0.10 0.00 -0.45 0.00 0.00 34.95 32.27 2bmo s ARG 72 CO 0.12 0.39 1.30 0.45 -0.68 0.00 0.00 175.30 176.89 2bmo s SER 73 N -3.07 6.84 0.36 0.23 0.15 -1.26 -4.91 113.70 112.04 2bmo s SER 73 Ca 0.26 2.56 0.10 0.00 0.70 0.00 0.00 55.95 59.57 2bmo s SER 73 Cb -0.07 -2.63 0.68 0.00 -1.71 0.00 0.00 66.02 62.29 2bmo s SER 73 CO 0.15 -0.51 1.83 0.71 1.20 0.00 0.00 173.24 176.61 2bmo h THR 74 N 3.31 1.24 0.00 6.45 1.35 -2.04 -3.31 112.91 119.91 2bmo h THR 74 Ca -0.47 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 2bmo h THR 74 Cb 1.22 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 2bmo h THR 74 CO 0.71 0.33 -1.28 -1.54 -0.25 0.00 0.00 175.52 173.48 2bmo n SER 75 N -4.16 0.57 -2.28 5.36 3.41 -1.26 -4.96 113.62 110.30 2bmo n SER 75 Ca -0.01 0.15 -0.03 0.00 -0.26 0.00 0.00 58.87 58.71 2bmo n SER 75 Cb 0.36 0.94 0.02 0.00 -0.26 0.00 0.00 64.21 65.27 2bmo n SER 75 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2bmo n GLU 76 N -2.44 0.16 0.00 4.33 1.02 -1.25 -5.03 120.64 117.43 2bmo n GLU 76 Ca -0.01 -0.31 0.00 0.00 -0.02 0.00 0.00 57.16 56.83 2bmo n GLU 76 Cb 0.54 -0.13 0.00 0.00 -0.02 0.00 0.00 31.44 31.82 2bmo n GLU 76 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2bmo n ARG 77 N -1.31 0.00 -0.21 3.49 1.85 -1.26 -4.86 116.66 114.36 2bmo n ARG 77 Ca 0.02 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.88 2bmo n ARG 77 Cb 0.08 -0.07 0.12 0.00 -1.05 0.00 0.00 32.46 31.53 2bmo n ARG 77 CO 0.00 0.00 0.00 0.07 -0.01 0.00 0.00 177.63 177.69 2bmo h ARG 78 N 0.00 0.34 -6.27 2.89 0.11 -2.00 -3.41 114.38 106.04 2bmo h ARG 78 Ca 0.00 -0.02 -0.58 0.00 0.10 0.00 0.00 59.98 59.48 2bmo h ARG 78 Cb 0.00 -0.08 -0.03 0.00 1.11 0.00 0.00 29.97 30.98 2bmo h ARG 78 CO 0.00 0.22 1.25 -0.47 0.10 0.00 0.00 179.97 181.08 2bmo s TYR 79 N -6.09 1.83 -1.75 4.08 5.04 -1.26 -4.86 117.35 114.34 2bmo s TYR 79 Ca -0.13 0.58 0.15 0.00 -2.44 0.00 0.00 57.07 55.22 2bmo s TYR 79 Cb 0.18 -4.10 0.15 0.00 0.35 0.00 0.00 41.96 38.54 2bmo s TYR 79 CO 0.74 -3.06 1.01 1.04 -1.34 0.00 0.00 175.55 173.95 2bmo n GLN 80 N 8.27 1.27 -1.78 4.97 1.13 -1.26 -5.02 117.38 124.96 2bmo n GLN 80 Ca 0.22 -1.49 -0.35 0.00 -1.94 0.00 0.00 57.00 53.45 2bmo n GLN 80 Cb 0.46 -1.29 0.05 0.00 0.11 0.00 0.00 30.24 29.57 2bmo n GLN 80 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2bmo s LEU 81 N -1.19 3.49 -0.30 1.08 1.43 -1.26 -4.81 118.68 117.12 2bmo s LEU 81 Ca 0.19 2.26 -0.43 0.00 -1.03 0.00 0.00 54.13 55.12 2bmo s LEU 81 Cb 0.13 -4.58 -0.19 0.00 0.03 0.00 0.00 46.19 41.57 2bmo s LEU 81 CO 0.19 -1.78 1.35 -3.20 0.23 0.00 0.00 176.35 173.14 2bmo n ASN 82 N -2.14 0.73 -1.16 2.29 4.05 -1.26 -4.88 115.26 112.88 2bmo n ASN 82 Ca 0.12 1.14 0.12 0.00 0.45 0.00 0.00 54.58 56.41 2bmo n ASN 82 Cb 0.51 -0.86 0.23 0.00 1.23 0.00 0.00 39.78 40.88 2bmo n ASN 82 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2bmo n ASP 83 N 2.95 3.52 -3.95 1.20 5.75 -1.26 -4.94 116.55 119.82 2bmo n ASP 83 Ca 0.26 -1.98 -0.19 0.00 -0.01 0.00 0.00 54.79 52.86 2bmo n ASP 83 Cb -0.01 -0.29 -0.16 0.00 -1.03 0.00 0.00 41.12 39.64 2bmo n ASP 83 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bmo s ALA 84 N -1.38 0.70 -0.09 2.12 0.00 -1.26 -0.34 121.76 121.51 2bmo s ALA 84 Ca 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 51.96 52.15 2bmo s ALA 84 Cb 0.23 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 2bmo s ALA 84 CO 0.31 0.07 -0.02 0.54 0.00 0.00 0.00 175.76 176.66 2bmo s VAL 85 N 0.45 4.13 -0.62 0.00 0.11 -0.58 -4.95 120.40 118.94 2bmo s VAL 85 Ca -0.06 -0.31 -0.26 0.00 -2.93 0.00 0.00 61.98 58.42 2bmo s VAL 85 Cb -0.10 -2.74 0.04 0.00 -1.53 0.00 0.00 36.38 32.05 2bmo s VAL 85 CO 0.00 0.59 1.09 0.20 -3.33 0.00 0.00 175.10 173.65 2bmo s ASN 86 N -0.71 6.30 0.18 3.54 0.01 -1.26 -1.13 114.94 121.87 2bmo s ASN 86 Ca 0.11 -0.36 -0.06 0.00 -0.71 0.00 0.00 52.86 51.84 2bmo s ASN 86 Cb -0.12 -2.49 0.09 0.00 0.41 0.00 0.00 41.25 39.14 2bmo s ASN 86 CO 0.02 -1.48 1.54 -0.07 -1.51 0.00 0.00 177.10 175.61 2bmo h LEU 87 N 11.77 0.81 -8.26 0.60 3.38 -1.07 -3.43 115.31 119.12 2bmo h LEU 87 Ca -0.27 -0.36 -0.46 0.00 0.09 0.00 0.00 57.88 56.89 2bmo h LEU 87 Cb 1.06 -0.23 -0.27 0.00 0.09 0.00 0.00 40.66 41.32 2bmo h LEU 87 CO 1.18 1.09 -0.80 -0.31 0.09 0.00 0.00 178.44 179.69 2bmo s TYR 88 N -4.36 1.22 -0.49 1.13 1.51 -0.88 -4.94 117.35 110.54 2bmo s TYR 88 Ca -0.09 -0.29 0.06 0.00 -1.01 0.00 0.00 57.07 55.74 2bmo s TYR 88 Cb 0.12 -0.76 0.20 0.00 -0.11 0.00 0.00 41.96 41.42 2bmo s TYR 88 CO 0.85 0.01 0.70 -1.71 -1.11 0.00 0.00 175.55 174.30 2bmo n ASN 89 N 2.30 -2.65 -4.53 2.29 5.15 -1.18 -1.29 115.26 115.35 2bmo n ASN 89 Ca -0.16 -2.93 -0.34 0.00 -0.60 0.00 0.00 54.58 50.55 2bmo n ASN 89 Cb 0.55 1.29 -0.12 0.00 -0.53 0.00 0.00 39.78 40.97 2bmo n ASN 89 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2bmo s GLU 90 N 0.57 2.83 0.45 1.20 0.41 0.16 -4.88 118.70 119.44 2bmo s GLU 90 Ca 0.31 -0.59 -0.01 0.00 -0.41 0.00 0.00 54.97 54.27 2bmo s GLU 90 Cb 0.08 -2.58 0.09 0.00 -1.78 0.00 0.00 34.13 29.94 2bmo s GLU 90 CO -0.13 0.58 0.62 0.27 -0.49 0.00 0.00 175.26 176.11 2bmo n ASN 91 N 2.47 0.70 -0.16 -0.19 0.23 -1.26 -1.18 115.26 115.87 2bmo n ASN 91 Ca -0.18 -1.62 -0.08 0.00 -0.53 0.00 0.00 54.58 52.16 2bmo n ASN 91 Cb 0.53 -0.41 0.01 0.00 -2.08 0.00 0.00 39.78 37.82 2bmo n ASN 91 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2bmo h TYR 92 N -0.64 0.72 -0.83 -2.53 3.20 -1.75 -0.69 116.97 114.43 2bmo h TYR 92 Ca -0.20 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.58 2bmo h TYR 92 Cb 0.72 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 2bmo h TYR 92 CO 0.00 0.61 0.40 0.37 -1.64 0.00 0.00 178.16 177.90 2bmo h GLN 93 N 0.62 1.20 -0.56 1.82 5.75 -1.95 0.31 115.11 122.30 2bmo h GLN 93 Ca 0.16 -0.17 -0.09 0.00 -0.15 0.00 0.00 58.65 58.40 2bmo h GLN 93 Cb 0.19 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 2bmo h GLN 93 CO -0.01 0.92 -0.00 1.96 -2.65 0.00 0.00 178.83 179.04 2bmo h GLN 94 N 1.18 0.96 -0.71 1.69 4.20 -1.84 -0.89 115.11 119.70 2bmo h GLN 94 Ca 0.29 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 2bmo h GLN 94 Cb 0.11 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2bmo h GLN 94 CO -0.04 0.95 0.22 -0.07 -0.67 0.00 0.00 178.83 179.22 2bmo h LEU 95 N 0.88 1.03 -0.59 1.46 3.38 -0.75 -2.28 115.31 118.45 2bmo h LEU 95 Ca 0.16 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.97 2bmo h LEU 95 Cb 0.52 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2bmo h LEU 95 CO 0.03 0.96 0.32 0.50 0.09 0.00 0.00 178.44 180.34 2bmo h LYS 96 N 1.04 0.59 -0.37 1.13 3.64 -0.37 0.70 116.57 122.94 2bmo h LYS 96 Ca 0.23 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 2bmo h LYS 96 Cb 0.30 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2bmo h LYS 96 CO -0.01 0.39 0.20 0.28 -2.27 0.00 0.00 179.45 178.05 2bmo h VAL 97 N 0.61 1.01 -0.79 2.00 2.07 -1.02 -0.49 116.25 119.64 2bmo h VAL 97 Ca 0.26 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 2bmo h VAL 97 Cb 0.14 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2bmo h VAL 97 CO -0.16 0.08 0.37 0.03 0.02 0.00 0.00 177.57 177.91 2bmo h ARG 98 N 0.41 1.14 -0.29 1.57 3.08 -0.81 -1.52 114.38 117.96 2bmo h ARG 98 Ca 0.15 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2bmo h ARG 98 Cb 0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 2bmo h ARG 98 CO -0.08 0.89 0.13 0.28 -1.07 0.00 0.00 179.97 180.12 2bmo h VAL 99 N 1.12 1.17 -0.04 2.04 2.07 -0.53 -1.29 116.25 120.79 2bmo h VAL 99 Ca 0.27 -0.49 0.03 0.00 0.82 0.00 0.00 66.70 67.33 2bmo h VAL 99 Cb 0.13 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2bmo h VAL 99 CO -0.03 0.17 -0.19 -0.33 0.02 0.00 0.00 177.57 177.21 2bmo h GLU 100 N 0.33 -0.27 -0.92 1.57 4.39 -0.91 -2.21 114.58 116.57 2bmo h GLU 100 Ca 0.10 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.91 2bmo h GLU 100 Cb 0.15 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 28.79 2bmo h GLU 100 CO -0.01 -0.18 0.57 1.25 -1.16 0.00 0.00 179.01 179.47 2bmo h HIS 101 N -0.28 1.04 -0.87 4.33 2.76 -1.09 -0.98 115.15 120.04 2bmo h HIS 101 Ca 0.07 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.28 2bmo h HIS 101 Cb 0.38 -0.33 -0.04 0.00 1.55 0.00 0.00 27.41 28.96 2bmo h HIS 101 CO -0.25 0.46 0.58 1.96 -1.30 0.00 0.00 177.93 179.38 2bmo h GLN 102 N 0.96 1.15 0.00 5.26 1.08 -0.76 -3.14 115.11 119.67 2bmo h GLN 102 Ca 0.43 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 2bmo h GLN 102 Cb 0.32 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2bmo h GLN 102 CO -0.22 0.76 -0.69 -1.33 -0.95 0.00 0.00 178.83 176.41 2bmo n MET 103 N -4.40 0.11 -1.95 1.46 2.81 -0.57 -4.93 117.12 109.65 2bmo n MET 103 Ca 0.10 0.01 -0.42 0.00 -1.81 0.00 0.00 57.70 55.59 2bmo n MET 103 Cb 0.02 -1.55 -0.03 0.00 -0.71 0.00 0.00 33.22 30.96 2bmo n MET 103 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2bmo s ASP 104 N -3.41 6.59 0.27 7.83 2.15 -0.48 -4.88 116.67 124.75 2bmo s ASP 104 Ca 0.08 2.67 0.20 0.00 0.43 0.00 0.00 52.55 55.93 2bmo s ASP 104 Cb 0.16 -2.61 1.00 0.00 -0.30 0.00 0.00 42.92 41.17 2bmo s ASP 104 CO 0.74 -0.78 1.60 -0.81 -0.17 0.00 0.00 175.17 175.75 2bmo n PRO 105 N 3.13 0.13 -0.60 4.34 -0.04 -1.26 -1.30 135.00 139.40 2bmo n PRO 105 Ca 0.10 0.57 0.09 0.00 -0.04 0.00 0.00 63.50 64.22 2bmo n PRO 105 Cb 0.39 -1.88 0.34 0.00 -0.04 0.00 0.00 33.50 32.30 2bmo n PRO 105 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2bmo n GLN 106 N -2.16 3.74 -2.38 0.54 6.02 -1.26 -4.79 117.38 117.09 2bmo n GLN 106 Ca -0.00 -2.86 -0.39 0.00 -0.01 0.00 0.00 57.00 53.73 2bmo n GLN 106 Cb 0.08 -1.89 -0.03 0.00 1.02 0.00 0.00 30.24 29.42 2bmo n GLN 106 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2bmo s ASN 107 N -1.03 5.91 0.38 1.08 3.84 -0.42 -4.86 114.94 119.84 2bmo s ASN 107 Ca 0.48 -0.43 0.09 0.00 0.21 0.00 0.00 52.86 53.21 2bmo s ASN 107 Cb 0.33 -2.55 0.77 0.00 -0.55 0.00 0.00 41.25 39.24 2bmo s ASN 107 CO 0.21 -2.00 1.92 -0.50 -2.79 0.00 0.00 177.10 173.94 2bmo h TRP 108 N 11.34 0.30 0.00 0.43 4.06 -1.88 -2.20 115.95 128.00 2bmo h TRP 108 Ca -0.17 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.74 2bmo h TRP 108 Cb 1.07 -0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 29.14 2bmo h TRP 108 CO 1.14 0.39 -0.06 0.00 -3.56 0.00 0.00 178.44 176.34 2bmo h ALA 109 N 1.63 1.15 -0.52 1.49 0.00 -1.98 -2.92 119.26 118.10 2bmo h ALA 109 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bmo h ALA 109 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2bmo h ALA 109 CO 0.02 0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.44 2bmo n ASN 110 N -3.37 4.09 -3.97 0.00 3.02 -0.83 -4.79 115.26 109.42 2bmo n ASN 110 Ca -0.01 -2.42 -0.28 0.00 -0.03 0.00 0.00 54.58 51.84 2bmo n ASN 110 Cb 0.22 -0.54 -0.17 0.00 -0.61 0.00 0.00 39.78 38.68 2bmo n ASN 110 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2bmo s ASN 111 N -0.79 2.41 0.87 6.41 2.47 -1.11 -3.18 114.94 122.03 2bmo s ASN 111 Ca 0.42 -0.39 -0.11 0.00 0.42 0.00 0.00 52.86 53.20 2bmo s ASN 111 Cb 0.28 -1.00 0.12 0.00 -1.45 0.00 0.00 41.25 39.19 2bmo s ASN 111 CO 0.19 -0.08 1.11 -2.84 -3.72 0.00 0.00 177.10 171.76 2bmo s PRO 112 N 1.56 1.44 0.17 0.43 0.02 -1.26 -5.02 135.00 132.34 2bmo s PRO 112 Ca 0.04 1.25 -0.33 0.00 0.02 0.00 0.00 61.00 61.98 2bmo s PRO 112 Cb -0.13 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.45 2bmo s PRO 112 CO -0.09 -2.24 1.50 1.17 -0.33 0.00 0.00 177.00 177.01 2bmo n LYS 113 N -3.94 1.99 -1.72 5.54 4.81 -1.19 -4.89 118.16 118.76 2bmo n LYS 113 Ca 0.09 0.72 -0.33 0.00 -0.87 0.00 0.00 58.31 57.92 2bmo n LYS 113 Cb 0.53 -2.44 0.05 0.00 0.02 0.00 0.00 35.03 33.19 2bmo n LYS 113 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2bmo s ILE 114 N 0.58 3.20 -0.15 3.15 -1.09 -1.26 -4.95 121.20 120.68 2bmo s ILE 114 Ca 0.76 0.55 0.01 0.00 -2.23 0.00 0.00 60.65 59.75 2bmo s ILE 114 Cb -0.70 -3.07 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2bmo s ILE 114 CO 0.42 -0.35 -0.19 -0.13 -1.23 0.00 0.00 174.94 173.46 2bmo s ARG 115 N -4.12 3.11 -0.04 2.79 1.81 -0.43 -5.01 118.95 117.06 2bmo s ARG 115 Ca 0.67 -0.80 0.05 0.00 -1.72 0.00 0.00 55.73 53.92 2bmo s ARG 115 Cb -0.21 -2.54 -0.02 0.00 -0.45 0.00 0.00 34.95 31.73 2bmo s ARG 115 CO 0.42 -0.02 -0.18 -0.06 -0.68 0.00 0.00 175.30 174.78 2bmo s PHE 116 N 0.87 2.60 -0.04 -0.53 0.40 -1.26 -0.92 117.98 119.10 2bmo s PHE 116 Ca -0.05 -0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.02 2bmo s PHE 116 Cb -0.15 -1.60 0.03 0.00 0.51 0.00 0.00 43.02 41.81 2bmo s PHE 116 CO -0.02 0.11 0.02 0.99 0.70 0.00 0.00 175.22 177.02 2bmo s THR 117 N -0.67 0.08 -0.06 0.64 2.01 -0.27 -4.80 115.64 112.57 2bmo s THR 117 Ca 0.10 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.36 2bmo s THR 117 Cb -0.11 -0.24 -0.02 0.00 0.01 0.00 0.00 72.50 72.14 2bmo s THR 117 CO 0.00 0.17 -0.17 -0.13 -0.69 0.00 0.00 174.62 173.80 2bmo s ARG 118 N 1.55 2.63 -0.23 4.92 0.52 -1.26 -0.57 118.95 126.51 2bmo s ARG 118 Ca -0.03 -0.75 0.02 0.00 -0.52 0.00 0.00 55.73 54.45 2bmo s ARG 118 Cb -0.13 -2.36 0.05 0.00 0.52 0.00 0.00 34.95 33.04 2bmo s ARG 118 CO -0.03 0.50 -0.10 -0.06 0.02 0.00 0.00 175.30 175.63 2bmo s PHE 119 N -0.43 2.80 -0.18 -0.53 0.08 0.42 -5.00 117.98 115.13 2bmo s PHE 119 Ca 0.05 -1.94 -0.06 0.00 0.12 0.00 0.00 56.93 55.10 2bmo s PHE 119 Cb -0.12 -1.77 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 2bmo s PHE 119 CO 0.02 -0.81 0.02 0.08 -0.10 0.00 0.00 175.22 174.42 2bmo s VAL 120 N 1.26 4.25 0.21 -0.44 1.01 -1.26 -1.00 120.40 124.43 2bmo s VAL 120 Ca -0.05 -0.22 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 2bmo s VAL 120 Cb -0.18 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2bmo s VAL 120 CO -0.07 0.45 0.14 0.42 0.00 0.00 0.00 175.10 176.04 2bmo s THR 121 N 0.63 0.00 -1.34 3.92 -4.23 -0.02 -4.94 115.64 109.67 2bmo s THR 121 Ca 0.00 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.44 2bmo s THR 121 Cb -0.14 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 71.22 2bmo s THR 121 CO 0.02 0.00 1.10 0.59 -0.54 0.00 0.00 174.62 175.79 2bmo n ASN 122 N -0.35 -5.02 -4.72 3.99 3.02 -1.26 -0.91 115.26 110.00 2bmo n ASN 122 Ca 0.02 -0.60 -0.42 0.00 -0.03 0.00 0.00 54.58 53.56 2bmo n ASN 122 Cb 0.66 -4.90 -0.03 0.00 -0.61 0.00 0.00 39.78 34.90 2bmo n ASN 122 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bmo s VAL 123 N -3.34 3.83 -0.03 2.41 1.01 -1.26 -4.36 120.40 118.66 2bmo s VAL 123 Ca 0.44 1.37 -0.01 0.00 0.00 0.00 0.00 61.98 63.78 2bmo s VAL 123 Cb -0.20 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.33 2bmo s VAL 123 CO 0.74 0.14 0.03 -0.89 0.00 0.00 0.00 175.10 175.12 2bmo s THR 124 N 0.76 -0.03 0.10 3.92 2.01 0.01 -5.01 115.64 117.40 2bmo s THR 124 Ca 0.58 0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.89 2bmo s THR 124 Cb -0.31 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.03 2bmo s THR 124 CO 0.31 0.13 -0.15 0.00 -0.69 0.00 0.00 174.62 174.22 2bmo s ALA 125 N 1.38 1.41 -0.17 7.40 0.00 -1.26 -0.51 121.76 130.01 2bmo s ALA 125 Ca -0.05 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 50.65 2bmo s ALA 125 Cb -0.13 -0.11 0.06 0.00 0.00 0.00 0.00 23.12 22.94 2bmo s ALA 125 CO -0.03 0.16 0.41 0.00 0.00 0.00 0.00 175.76 176.30 2bmo s ALA 126 N -1.65 -1.05 0.28 0.00 0.00 0.00 -4.30 121.76 115.04 2bmo s ALA 126 Ca 0.04 1.52 -0.30 0.00 0.00 0.00 0.00 51.96 53.23 2bmo s ALA 126 Cb -0.08 -0.92 -0.10 0.00 0.00 0.00 0.00 23.12 22.02 2bmo s ALA 126 CO 0.03 -0.26 1.40 0.21 0.00 0.00 0.00 175.76 177.13 2bmo s LYS 127 N 1.38 4.29 0.36 0.00 2.20 -1.26 -0.50 119.74 126.20 2bmo s LYS 127 Ca -0.09 2.28 -0.28 0.00 -0.36 0.00 0.00 55.97 57.52 2bmo s LYS 127 Cb -0.08 -3.09 -0.11 0.00 -1.51 0.00 0.00 37.83 33.03 2bmo s LYS 127 CO -0.13 -0.35 1.46 0.34 -0.36 0.00 0.00 175.35 176.31 2bmo s ASP 128 N 0.10 6.44 0.33 1.43 2.15 0.03 -4.87 116.67 122.28 2bmo s ASP 128 Ca 0.56 2.96 0.26 0.00 0.43 0.00 0.00 52.55 56.76 2bmo s ASP 128 Cb -0.41 -2.66 0.89 0.00 -0.30 0.00 0.00 42.92 40.43 2bmo s ASP 128 CO 0.47 -0.81 1.77 0.11 -0.17 0.00 0.00 175.17 176.54 2bmo h LYS 129 N 3.30 0.00 0.00 4.34 1.79 -1.93 -3.32 116.57 120.75 2bmo h LYS 129 Ca -0.50 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 57.72 2bmo h LYS 129 Cb 1.23 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.84 2bmo h LYS 129 CO 0.66 0.00 -1.94 0.43 -1.08 0.00 0.00 179.45 177.53 2bmo n SER 130 N -2.56 2.64 -4.05 0.86 7.64 -1.26 -4.85 113.62 112.04 2bmo n SER 130 Ca 0.03 -0.07 -0.34 0.00 1.01 0.00 0.00 58.87 59.50 2bmo n SER 130 Cb 0.36 -0.27 -0.11 0.00 -1.01 0.00 0.00 64.21 63.17 2bmo n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bmo s ALA 131 N -2.33 3.44 0.32 -0.43 0.00 -1.25 -4.97 121.76 116.54 2bmo s ALA 131 Ca -0.22 -3.19 0.37 0.00 0.00 0.00 0.00 51.96 48.92 2bmo s ALA 131 Cb 0.06 -2.45 1.91 0.00 0.00 0.00 0.00 23.12 22.64 2bmo s ALA 131 CO 0.37 -2.04 2.13 -1.00 0.00 0.00 0.00 175.76 175.22 2bmo h PRO 132 N 6.95 0.00 0.00 0.00 0.13 -1.89 -0.41 132.00 136.78 2bmo h PRO 132 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2bmo h PRO 132 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2bmo h PRO 132 CO 0.70 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.86 2bmo n GLU 133 N -2.87 0.04 -3.51 0.86 1.02 -1.26 -4.68 120.64 110.24 2bmo n GLU 133 Ca -0.02 0.14 -0.37 0.00 -0.02 0.00 0.00 57.16 56.89 2bmo n GLU 133 Cb 0.12 -1.56 -0.07 0.00 -0.02 0.00 0.00 31.44 29.90 2bmo n GLU 133 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2bmo s ILE 134 N -3.04 5.29 -0.22 -3.67 -1.09 -0.16 -0.84 121.20 117.47 2bmo s ILE 134 Ca 0.11 0.55 -0.04 0.00 -2.23 0.00 0.00 60.65 59.04 2bmo s ILE 134 Cb 0.14 -3.64 -0.01 0.00 -1.58 0.00 0.00 42.46 37.38 2bmo s ILE 134 CO 0.44 0.35 -0.05 -0.76 -1.23 0.00 0.00 174.94 173.69 2bmo s LEU 135 N 0.71 2.84 0.06 2.97 1.43 0.67 -0.79 118.68 126.57 2bmo s LEU 135 Ca 0.16 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.56 2bmo s LEU 135 Cb -0.13 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.32 2bmo s LEU 135 CO 0.05 -0.02 0.94 -1.00 0.23 0.00 0.00 176.35 176.55 2bmo s HIS 136 N 1.46 3.75 -0.01 0.29 3.76 0.35 -0.75 115.29 124.13 2bmo s HIS 136 Ca 0.06 1.72 0.01 0.00 -0.15 0.00 0.00 55.06 56.70 2bmo s HIS 136 Cb -0.14 -3.05 0.01 0.00 1.11 0.00 0.00 32.58 30.51 2bmo s HIS 136 CO -0.04 0.14 -0.04 0.08 -0.85 0.00 0.00 174.74 174.03 2bmo s VAL 137 N 0.36 0.36 -0.05 -0.90 1.01 -0.29 -0.82 120.40 120.07 2bmo s VAL 137 Ca 0.47 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2bmo s VAL 137 Cb -0.22 -0.34 0.01 0.00 0.00 0.00 0.00 36.38 35.83 2bmo s VAL 137 CO 0.28 0.13 -0.11 -0.60 0.00 0.00 0.00 175.10 174.80 2bmo s ARG 138 N 0.22 1.43 -0.01 2.72 3.52 0.33 -0.28 118.95 126.88 2bmo s ARG 138 Ca -0.02 -0.37 -0.16 0.00 -0.13 0.00 0.00 55.73 55.05 2bmo s ARG 138 Cb -0.06 -1.23 0.03 0.00 -1.56 0.00 0.00 34.95 32.13 2bmo s ARG 138 CO -0.00 0.05 0.33 -1.54 -0.81 0.00 0.00 175.30 173.33 2bmo s SER 139 N 0.53 -0.22 -0.07 -2.12 1.04 -0.88 -0.81 113.70 111.17 2bmo s SER 139 Ca -0.11 0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.39 2bmo s SER 139 Cb -0.14 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 2bmo s SER 139 CO 0.02 -0.47 0.11 0.20 0.98 0.00 0.00 173.24 174.09 2bmo s ASN 140 N -1.37 6.04 -0.05 7.02 0.01 -0.09 -0.49 114.94 126.01 2bmo s ASN 140 Ca -0.13 0.32 0.03 0.00 -0.71 0.00 0.00 52.86 52.37 2bmo s ASN 140 Cb -0.05 -1.86 0.01 0.00 0.41 0.00 0.00 41.25 39.76 2bmo s ASN 140 CO 0.04 0.35 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.62 2bmo s LEU 141 N -1.33 1.77 -0.18 0.60 2.96 0.46 -0.84 118.68 122.13 2bmo s LEU 141 Ca 0.19 -0.31 -0.04 0.00 -0.22 0.00 0.00 54.13 53.74 2bmo s LEU 141 Cb -0.12 -0.86 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 2bmo s LEU 141 CO 0.09 0.08 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.55 2bmo s ILE 142 N 0.38 3.90 -0.16 6.68 1.01 -0.17 -1.40 121.20 131.44 2bmo s ILE 142 Ca -0.10 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.22 2bmo s ILE 142 Cb -0.13 -2.74 0.02 0.00 0.01 0.00 0.00 42.46 39.62 2bmo s ILE 142 CO 0.03 0.46 -0.19 -0.22 0.00 0.00 0.00 174.94 175.03 2bmo s LEU 143 N 0.67 1.99 -0.21 2.97 0.20 -0.18 -0.44 118.68 123.69 2bmo s LEU 143 Ca -0.01 -0.59 -0.07 0.00 0.69 0.00 0.00 54.13 54.14 2bmo s LEU 143 Cb -0.14 -1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 44.20 2bmo s LEU 143 CO 0.02 0.00 0.07 -2.28 -0.29 0.00 0.00 176.35 173.87 2bmo s HIS 144 N 1.23 3.19 -0.13 5.38 5.65 0.26 -0.66 115.29 130.21 2bmo s HIS 144 Ca 0.02 -0.07 0.02 0.00 0.25 0.00 0.00 55.06 55.27 2bmo s HIS 144 Cb -0.14 -2.14 0.01 0.00 -1.18 0.00 0.00 32.58 29.14 2bmo s HIS 144 CO -0.10 -0.02 -0.18 0.50 -0.65 0.00 0.00 174.74 174.30 2bmo s ARG 145 N 0.82 2.54 -0.04 2.88 3.52 0.03 -1.11 118.95 127.59 2bmo s ARG 145 Ca 0.04 -0.67 0.05 0.00 -0.13 0.00 0.00 55.73 55.02 2bmo s ARG 145 Cb -0.14 -2.12 -0.01 0.00 -1.56 0.00 0.00 34.95 31.12 2bmo s ARG 145 CO 0.02 -0.07 -0.21 0.00 -0.81 0.00 0.00 175.30 174.24 2bmo s ALA 146 N 0.98 1.81 0.15 6.12 0.00 -0.10 -1.11 121.76 129.60 2bmo s ALA 146 Ca -0.05 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 50.86 2bmo s ALA 146 Cb -0.15 -0.55 0.04 0.00 0.00 0.00 0.00 23.12 22.46 2bmo s ALA 146 CO -0.03 0.36 0.47 -0.98 0.00 0.00 0.00 175.76 175.58 2bmo s ARG 147 N -0.15 1.20 -1.46 0.00 1.70 -0.64 -1.32 118.95 118.28 2bmo s ARG 147 Ca -0.01 -0.72 -0.11 0.00 -0.47 0.00 0.00 55.73 54.42 2bmo s ARG 147 Cb -0.12 0.50 0.05 0.00 -0.57 0.00 0.00 34.95 34.82 2bmo s ARG 147 CO 0.02 -0.49 1.04 0.54 -1.08 0.00 0.00 175.30 175.33 2bmo n ARG 148 N -0.29 -6.45 0.00 3.89 5.12 -1.26 -1.73 116.66 115.94 2bmo n ARG 148 Ca -0.14 0.70 0.00 0.00 -1.93 0.00 0.00 57.85 56.48 2bmo n ARG 148 Cb 0.64 -5.66 0.00 0.00 -1.16 0.00 0.00 32.46 26.28 2bmo n ARG 148 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2bmo n GLU 149 N -4.77 0.00 -0.21 5.56 1.02 -1.26 -4.14 120.64 116.84 2bmo n GLU 149 Ca 0.02 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.18 2bmo n GLU 149 Cb 0.54 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.98 2bmo n GLU 149 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2bmo n ASN 150 N 2.95 0.58 -4.67 1.62 0.23 -1.23 -5.03 115.26 109.71 2bmo n ASN 150 Ca 0.00 -1.82 -0.38 0.00 -0.53 0.00 0.00 54.58 51.85 2bmo n ASN 150 Cb 0.00 -0.14 -0.08 0.00 -2.08 0.00 0.00 39.78 37.48 2bmo n ASN 150 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 2bmo s GLN 151 N -0.53 4.16 -0.06 -3.83 0.74 -0.71 -5.02 119.66 114.41 2bmo s GLN 151 Ca 0.05 0.14 -0.00 0.00 0.05 0.00 0.00 55.36 55.59 2bmo s GLN 151 Cb 0.04 -3.54 0.03 0.00 1.10 0.00 0.00 33.01 30.64 2bmo s GLN 151 CO 0.00 -0.03 -0.02 0.08 -0.55 0.00 0.00 175.29 174.78 2bmo s VAL 152 N 1.29 0.44 -0.05 1.34 1.01 -1.26 -1.63 120.40 121.54 2bmo s VAL 152 Ca 0.17 0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2bmo s VAL 152 Cb -0.15 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2bmo s VAL 152 CO 0.07 0.24 -0.16 -1.81 0.00 0.00 0.00 175.10 173.44 2bmo s ASP 153 N 1.48 2.09 -0.14 3.32 1.01 -0.27 -5.00 116.67 119.16 2bmo s ASP 153 Ca -0.02 -0.35 0.02 0.00 0.71 0.00 0.00 52.55 52.91 2bmo s ASP 153 Cb -0.13 -0.73 0.01 0.00 1.01 0.00 0.00 42.92 43.08 2bmo s ASP 153 CO -0.03 0.11 -0.20 -0.69 0.21 0.00 0.00 175.17 174.58 2bmo s VAL 154 N 0.26 1.91 0.02 -1.27 1.01 -1.26 -0.79 120.40 120.28 2bmo s VAL 154 Ca -0.08 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2bmo s VAL 154 Cb -0.13 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2bmo s VAL 154 CO 0.03 0.52 -0.01 -0.36 0.00 0.00 0.00 175.10 175.28 2bmo s PHE 155 N 0.94 3.04 -0.05 5.22 0.40 0.16 -4.95 117.98 122.73 2bmo s PHE 155 Ca -0.05 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.33 2bmo s PHE 155 Cb -0.15 -1.64 0.02 0.00 0.51 0.00 0.00 43.02 41.76 2bmo s PHE 155 CO -0.03 0.45 -0.05 0.71 0.70 0.00 0.00 175.22 177.00 2bmo s TYR 156 N -1.11 0.84 0.08 0.36 1.51 -1.26 -1.01 117.35 116.76 2bmo s TYR 156 Ca 0.20 -0.26 -0.23 0.00 -1.01 0.00 0.00 57.07 55.77 2bmo s TYR 156 Cb -0.11 -0.74 0.06 0.00 -0.11 0.00 0.00 41.96 41.06 2bmo s TYR 156 CO 0.11 -0.22 0.56 0.00 -1.11 0.00 0.00 175.55 174.89 2bmo s ALA 157 N 0.99 -1.45 -0.21 3.71 0.00 -0.50 -4.47 121.76 119.82 2bmo s ALA 157 Ca -0.10 0.61 -0.04 0.00 0.00 0.00 0.00 51.96 52.43 2bmo s ALA 157 Cb -0.14 0.53 -0.01 0.00 0.00 0.00 0.00 23.12 23.50 2bmo s ALA 157 CO -0.00 -0.59 -0.04 0.99 0.00 0.00 0.00 175.76 176.12 2bmo s THR 158 N -2.84 3.51 -0.23 0.00 2.01 -1.26 -0.40 115.64 116.43 2bmo s THR 158 Ca -0.03 -0.45 -0.15 0.00 0.31 0.00 0.00 61.69 61.37 2bmo s THR 158 Cb -0.00 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 2bmo s THR 158 CO -0.05 0.43 0.34 -0.13 -0.69 0.00 0.00 174.62 174.52 2bmo s ARG 159 N 1.31 4.11 -0.40 4.92 3.00 0.36 -4.40 118.95 127.85 2bmo s ARG 159 Ca 0.04 0.06 -0.08 0.00 0.00 0.00 0.00 55.73 55.75 2bmo s ARG 159 Cb -0.14 -3.57 0.07 0.00 0.00 0.00 0.00 34.95 31.31 2bmo s ARG 159 CO -0.01 -0.09 0.22 -1.21 0.00 0.00 0.00 175.30 174.21 2bmo s GLU 160 N 1.48 2.55 0.16 3.54 2.02 0.06 -2.07 118.70 126.45 2bmo s GLU 160 Ca 0.16 -1.44 0.08 0.00 0.02 0.00 0.00 54.97 53.79 2bmo s GLU 160 Cb -0.15 -3.70 -0.04 0.00 0.10 0.00 0.00 34.13 30.34 2bmo s GLU 160 CO 0.08 -0.91 -0.09 -0.51 0.02 0.00 0.00 175.26 173.85 2bmo s ASP 161 N 1.95 4.30 -0.14 -0.19 1.01 0.61 -0.79 116.67 123.42 2bmo s ASP 161 Ca 0.03 -0.52 0.02 0.00 0.71 0.00 0.00 52.55 52.78 2bmo s ASP 161 Cb -0.22 -0.76 0.00 0.00 1.01 0.00 0.00 42.92 42.95 2bmo s ASP 161 CO 0.02 0.12 -0.20 -0.54 0.21 0.00 0.00 175.17 174.78 2bmo s LYS 162 N -2.67 3.10 0.18 8.23 1.02 0.31 -1.14 119.74 128.77 2bmo s LYS 162 Ca 0.24 -0.82 0.09 0.00 0.02 0.00 0.00 55.97 55.50 2bmo s LYS 162 Cb -0.09 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 2bmo s LYS 162 CO 0.15 0.04 -0.11 -1.58 -0.92 0.00 0.00 175.35 172.92 2bmo s TRP 163 N 0.72 2.60 -0.06 3.18 0.52 0.07 -0.26 118.94 125.71 2bmo s TRP 163 Ca -0.09 -0.23 0.03 0.00 0.02 0.00 0.00 56.10 55.83 2bmo s TRP 163 Cb -0.16 -1.28 0.01 0.00 -1.15 0.00 0.00 33.47 30.89 2bmo s TRP 163 CO 0.01 0.50 -0.13 0.21 0.02 0.00 0.00 176.95 177.56 2bmo s LYS 164 N -2.76 1.69 0.26 4.98 2.20 0.63 -0.24 119.74 126.49 2bmo s LYS 164 Ca 0.24 -0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 55.10 2bmo s LYS 164 Cb -0.09 -1.41 -0.09 0.00 -1.51 0.00 0.00 37.83 34.72 2bmo s LYS 164 CO 0.14 0.08 1.29 1.03 -0.36 0.00 0.00 175.35 177.53 2bmo s ARG 165 N 0.48 4.41 0.03 4.03 0.52 -0.02 -0.94 118.95 127.45 2bmo s ARG 165 Ca -0.11 2.09 0.03 0.00 -0.52 0.00 0.00 55.73 57.21 2bmo s ARG 165 Cb -0.14 -3.15 -0.04 0.00 0.52 0.00 0.00 34.95 32.14 2bmo s ARG 165 CO 0.03 -0.18 -0.01 0.42 0.02 0.00 0.00 175.30 175.59 2bmo s ILE 166 N -0.48 4.03 0.08 1.52 -1.09 0.25 -4.94 121.20 120.58 2bmo s ILE 166 Ca 0.53 -0.77 -0.34 0.00 -2.23 0.00 0.00 60.65 57.84 2bmo s ILE 166 Cb -0.37 -2.84 -0.13 0.00 -1.58 0.00 0.00 42.46 37.54 2bmo s ILE 166 CO 0.44 0.28 1.69 -1.84 -1.23 0.00 0.00 174.94 174.27 2bmo n GLU 167 N 1.10 2.21 0.00 2.79 0.28 -1.26 -1.55 120.64 124.21 2bmo n GLU 167 Ca -0.13 0.80 0.00 0.00 -0.16 0.00 0.00 57.16 57.67 2bmo n GLU 167 Cb 0.52 -2.60 0.00 0.00 1.43 0.00 0.00 31.44 30.79 2bmo n GLU 167 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2bmo n GLY 168 N 3.77 1.94 0.00 -1.84 0.00 -1.26 -4.66 105.19 103.14 2bmo n GLY 168 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2bmo n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bmo n GLY 169 N -1.31 2.03 3.64 -0.02 0.00 -0.60 -5.10 105.19 103.83 2bmo n GLY 169 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2bmo n GLY 169 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bmo s GLY 170 N -2.17 1.58 -0.03 -0.02 0.00 -1.25 -4.79 107.32 100.65 2bmo s GLY 170 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 44.72 44.53 2bmo s GLY 170 CO 0.00 0.42 0.03 -0.42 0.00 0.00 0.00 173.10 173.12 2bmo s ILE 171 N -2.81 -0.01 0.07 0.90 1.01 -1.26 -0.58 121.20 118.52 2bmo s ILE 171 Ca 0.66 0.23 0.07 0.00 0.00 0.00 0.00 60.65 61.61 2bmo s ILE 171 Cb -0.20 -0.15 -0.03 0.00 0.01 0.00 0.00 42.46 42.09 2bmo s ILE 171 CO 0.59 0.12 -0.18 -0.54 0.00 0.00 0.00 174.94 174.94 2bmo s LYS 172 N 1.32 1.07 -0.09 2.79 1.02 -0.12 -4.74 119.74 120.99 2bmo s LYS 172 Ca -0.06 -1.01 -0.30 0.00 0.02 0.00 0.00 55.97 54.62 2bmo s LYS 172 Cb -0.13 -1.21 -0.03 0.00 -0.52 0.00 0.00 37.83 35.94 2bmo s LYS 172 CO -0.03 0.29 1.21 -1.17 -0.92 0.00 0.00 175.35 174.73 2bmo s LEU 173 N -1.61 4.25 -0.21 3.17 2.96 0.78 -0.27 118.68 127.75 2bmo s LEU 173 Ca 0.04 1.77 0.05 0.00 -0.22 0.00 0.00 54.13 55.78 2bmo s LEU 173 Cb -0.09 -3.55 -0.21 0.00 0.50 0.00 0.00 46.19 42.83 2bmo s LEU 173 CO 0.03 -0.63 0.00 0.52 -1.32 0.00 0.00 176.35 174.95 2bmo n VAL 174 N 4.82 1.52 -3.72 1.68 0.31 0.64 -0.78 118.33 122.81 2bmo n VAL 174 Ca 0.12 -0.67 -0.12 0.00 -0.01 0.00 0.00 64.34 63.66 2bmo n VAL 174 Cb 0.46 -1.20 -0.11 0.00 -0.91 0.00 0.00 33.84 32.08 2bmo n VAL 174 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2bmo s GLU 175 N -2.52 0.42 -0.07 5.55 2.12 -0.81 -1.73 118.70 121.64 2bmo s GLU 175 Ca -0.25 0.66 0.03 0.00 0.36 0.00 0.00 54.97 55.77 2bmo s GLU 175 Cb 0.08 0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.57 2bmo s GLU 175 CO 0.70 -0.11 -0.15 0.50 -0.54 0.00 0.00 175.26 175.66 2bmo s ARG 176 N 0.83 2.02 -0.07 4.30 3.52 -0.68 -0.53 118.95 128.35 2bmo s ARG 176 Ca -0.05 -0.54 0.03 0.00 -0.13 0.00 0.00 55.73 55.04 2bmo s ARG 176 Cb -0.06 -1.63 0.01 0.00 -1.56 0.00 0.00 34.95 31.71 2bmo s ARG 176 CO -0.06 0.08 -0.16 0.12 -0.81 0.00 0.00 175.30 174.46 2bmo s PHE 177 N 0.54 1.78 -0.08 5.12 5.36 0.03 -0.55 117.98 130.17 2bmo s PHE 177 Ca -0.15 -0.64 0.01 0.00 -0.96 0.00 0.00 56.93 55.18 2bmo s PHE 177 Cb -0.16 -1.24 0.02 0.00 -0.34 0.00 0.00 43.02 41.30 2bmo s PHE 177 CO 0.05 -0.28 -0.08 0.08 -1.46 0.00 0.00 175.22 173.53 2bmo s VAL 178 N 0.42 0.94 -0.71 3.12 1.01 -0.39 -0.76 120.40 124.03 2bmo s VAL 178 Ca -0.13 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 2bmo s VAL 178 Cb -0.15 -0.93 0.13 0.00 0.00 0.00 0.00 36.38 35.43 2bmo s VAL 178 CO 0.05 0.33 0.81 -0.62 0.00 0.00 0.00 175.10 175.67 2bmo s ASP 179 N 1.27 6.39 0.08 3.32 -1.08 -1.26 -0.76 116.67 124.63 2bmo s ASP 179 Ca -0.04 -1.80 -0.31 0.00 -0.52 0.00 0.00 52.55 49.89 2bmo s ASP 179 Cb -0.14 -2.31 -0.08 0.00 -1.46 0.00 0.00 42.92 38.94 2bmo s ASP 179 CO -0.03 -1.01 1.52 -0.47 0.52 0.00 0.00 175.17 175.70 2bmo s TYR 180 N 2.23 2.81 -0.07 -5.34 5.04 -0.40 -4.80 117.35 116.82 2bmo s TYR 180 Ca 0.17 0.63 0.29 0.00 -2.44 0.00 0.00 57.07 55.73 2bmo s TYR 180 Cb -0.17 -3.82 0.96 0.00 0.35 0.00 0.00 41.96 39.28 2bmo s TYR 180 CO -0.00 -3.11 1.84 -1.00 -1.34 0.00 0.00 175.55 171.93 2bmo h PRO 181 N 7.62 0.00 -4.57 4.97 0.13 -1.90 -3.42 132.00 134.83 2bmo h PRO 181 Ca -0.41 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.01 2bmo h PRO 181 Cb 1.20 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.12 2bmo h PRO 181 CO 0.91 0.04 -0.45 -1.21 -0.23 0.00 0.00 178.00 177.05 2bmo s GLU 182 N -3.50 3.12 0.21 0.86 2.02 -1.26 -4.98 118.70 115.18 2bmo s GLU 182 Ca 0.03 -0.91 -0.09 0.00 0.02 0.00 0.00 54.97 54.02 2bmo s GLU 182 Cb 0.08 -3.91 0.22 0.00 0.10 0.00 0.00 34.13 30.62 2bmo s GLU 182 CO 0.60 -0.65 1.85 -0.09 0.02 0.00 0.00 175.26 176.99 2bmo h ARG 183 N 8.57 0.86 -3.90 1.61 9.65 -1.90 -3.28 114.38 126.00 2bmo h ARG 183 Ca -0.28 -0.05 -0.66 0.00 -1.10 0.00 0.00 59.98 57.88 2bmo h ARG 183 Cb 1.13 -0.19 -0.39 0.00 -1.39 0.00 0.00 29.97 29.13 2bmo h ARG 183 CO 0.70 0.57 -0.59 0.42 2.80 0.00 0.00 179.97 183.86 2bmo s ILE 184 N -6.11 2.80 0.36 1.20 1.01 -1.26 -4.96 121.20 114.24 2bmo s ILE 184 Ca -0.13 -2.85 -0.28 0.00 0.00 0.00 0.00 60.65 57.39 2bmo s ILE 184 Cb 0.16 -2.94 -0.11 0.00 0.01 0.00 0.00 42.46 39.57 2bmo s ILE 184 CO 0.77 -0.75 1.44 -2.65 0.00 0.00 0.00 174.94 173.76 2bmo n PRO 185 N 3.65 2.52 -1.73 2.79 -0.02 -1.24 -4.90 135.00 136.07 2bmo n PRO 185 Ca 0.04 0.89 -0.29 0.00 -2.02 0.00 0.00 63.50 62.12 2bmo n PRO 185 Cb 0.37 -2.58 0.05 0.00 -0.02 0.00 0.00 33.50 31.31 2bmo n PRO 185 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2bmo n GLN 186 N 0.67 3.19 -0.40 -0.52 1.13 -1.26 -4.59 117.38 115.60 2bmo n GLN 186 Ca 0.03 -3.78 0.06 0.00 -1.94 0.00 0.00 57.00 51.37 2bmo n GLN 186 Cb 0.38 -2.28 0.20 0.00 0.11 0.00 0.00 30.24 28.65 2bmo n GLN 186 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2bmo n THR 187 N -0.79 2.20 0.00 5.09 -2.24 -1.26 -4.99 114.28 112.28 2bmo n THR 187 Ca 0.52 -2.32 0.00 0.00 -2.27 0.00 0.00 64.05 59.99 2bmo n THR 187 Cb 0.81 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2bmo n THR 187 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2bmo n HIS 188 N -1.01 0.00 -3.72 4.78 8.25 -1.26 -4.75 115.22 117.51 2bmo n HIS 188 Ca 0.22 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.61 2bmo n HIS 188 Cb 0.81 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.95 2bmo n HIS 188 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2bmo n ASN 189 N 1.27 -1.94 -1.62 0.41 0.23 -1.26 -5.05 115.26 107.31 2bmo n ASN 189 Ca 0.00 -2.29 -0.11 0.00 -0.53 0.00 0.00 54.58 51.65 2bmo n ASN 189 Cb 0.00 3.22 0.08 0.00 -2.08 0.00 0.00 39.78 41.00 2bmo n ASN 189 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2bmo n LEU 190 N 0.00 3.67 -3.32 -4.53 7.94 -1.26 -4.94 117.00 114.55 2bmo n LEU 190 Ca -0.07 -4.16 -0.38 0.00 -1.11 0.00 0.00 56.01 50.29 2bmo n LEU 190 Cb 0.52 -0.30 -0.02 0.00 0.53 0.00 0.00 43.42 44.15 2bmo n LEU 190 CO 0.23 1.69 2.87 -0.11 -1.11 0.00 0.00 177.39 180.96 2bmo n LEU 191 N -0.76 8.30 -4.07 -1.96 7.94 -1.26 -4.83 117.00 120.36 2bmo n LEU 191 Ca 0.30 -4.56 -0.14 0.00 -1.11 0.00 0.00 56.01 50.51 2bmo n LEU 191 Cb 0.88 -1.46 -0.12 0.00 0.53 0.00 0.00 43.42 43.25 2bmo n LEU 191 CO 0.20 2.05 -0.41 0.68 -1.11 0.00 0.00 177.39 178.81 2bmo s VAL 192 N 0.54 0.61 -0.63 1.96 -7.23 -1.26 -5.10 120.40 109.29 2bmo s VAL 192 Ca 0.63 -1.04 -0.24 0.00 -1.81 0.00 0.00 61.98 59.52 2bmo s VAL 192 Cb 0.19 -0.65 0.05 0.00 0.56 0.00 0.00 36.38 36.53 2bmo s VAL 192 CO -0.08 -0.32 1.04 -0.36 -0.31 0.00 0.00 175.10 175.07 2bmo s PHE 193 N -1.26 2.64 -2.00 2.82 2.99 -1.26 -5.17 117.98 116.74 2bmo s PHE 193 Ca -0.08 -0.17 0.25 0.00 0.00 0.00 0.00 56.93 56.93 2bmo s PHE 193 Cb -0.09 -4.29 1.51 0.00 0.00 0.00 0.00 43.02 40.14 2bmo s PHE 193 CO 0.01 -1.61 1.87 1.28 -0.00 0.00 0.00 175.22 176.76