#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oqm n HIS -7 N 0.00 -0.71 -0.18 0.00 -0.00 -1.26 -4.89 115.22 108.19 2oqm n HIS -7 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 2oqm n HIS -7 Cb 0.00 -3.66 0.32 0.00 -0.00 0.00 0.00 29.99 26.65 2oqm n HIS -7 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2oqm h GLU -6 N 0.00 0.81 -0.94 -0.41 4.11 -2.04 -0.89 114.58 115.23 2oqm h GLU -6 Ca -0.45 -0.05 0.10 0.00 0.07 0.00 0.00 59.36 59.04 2oqm h GLU -6 Cb 1.32 -0.18 -0.08 0.00 0.50 0.00 0.00 28.75 30.31 2oqm h GLU -6 CO 0.55 0.54 0.58 -0.91 0.07 0.00 0.00 179.01 179.84 2oqm h ASN -5 N 0.83 0.85 -0.56 3.06 -0.26 -1.91 0.62 115.58 118.22 2oqm h ASN -5 Ca 0.28 0.04 -0.06 0.00 -0.56 0.00 0.00 56.30 56.00 2oqm h ASN -5 Cb 0.09 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.20 2oqm h ASN -5 CO -0.08 0.48 0.11 0.25 -1.06 0.00 0.00 177.43 177.13 2oqm h LEU -4 N 0.95 0.88 -0.14 1.61 5.85 -1.54 -0.97 115.31 121.95 2oqm h LEU -4 Ca 0.45 -0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 2oqm h LEU -4 Cb 0.40 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2oqm h LEU -4 CO -0.25 0.90 -0.36 1.88 -0.34 0.00 0.00 178.44 180.28 2oqm h TYR -3 N 0.82 0.63 -0.54 1.25 -1.99 -1.20 -2.12 116.97 113.80 2oqm h TYR -3 Ca 0.17 -0.24 -0.05 0.00 2.00 0.00 0.00 58.73 60.61 2oqm h TYR -3 Cb 0.39 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 38.98 2oqm h TYR -3 CO 0.03 0.98 0.15 0.74 -0.00 0.00 0.00 178.16 180.05 2oqm h PHE -2 N 0.10 0.90 -0.42 4.88 0.04 -0.85 -3.03 116.94 118.55 2oqm h PHE -2 Ca -0.00 -0.10 -0.15 0.00 2.80 0.00 0.00 57.97 60.52 2oqm h PHE -2 Cb 0.97 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 2oqm h PHE -2 CO 0.10 0.78 -0.31 -0.56 -0.60 0.00 0.00 178.31 177.72 2oqm h GLN -1 N 0.76 0.96 -0.24 1.51 3.07 -1.19 -1.77 115.11 118.21 2oqm h GLN -1 Ca 0.17 -0.47 0.00 0.00 0.09 0.00 0.00 58.65 58.45 2oqm h GLN -1 Cb 0.32 -0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.87 2oqm h GLN -1 CO -0.00 1.13 0.00 0.41 0.09 0.00 0.00 178.83 180.46 2oqm n GLY 0 N 0.04 0.25 0.00 0.06 0.00 -0.80 -1.56 105.19 103.18 2oqm n GLY 0 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2oqm n GLY 0 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oqm n LEU 2 N 0.44 0.00 -0.02 0.99 4.77 -0.66 -1.20 117.00 121.31 2oqm n LEU 2 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 2oqm n LEU 2 Cb 0.04 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 2oqm n LEU 2 CO 0.00 0.00 0.86 0.22 -1.33 0.00 0.00 177.39 177.14 2oqm h TYR 3 N 0.00 -0.02 -0.48 -1.77 3.20 -1.53 -2.49 116.97 113.88 2oqm h TYR 3 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 2oqm h TYR 3 Cb 0.00 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2oqm h TYR 3 CO 0.00 -0.03 0.03 -0.44 -1.64 0.00 0.00 178.16 176.08 2oqm h ASP 4 N 0.04 0.74 0.70 -2.11 3.32 -1.41 -1.09 116.42 116.61 2oqm h ASP 4 Ca 0.07 -0.17 -0.12 0.00 0.02 0.00 0.00 57.03 56.83 2oqm h ASP 4 Cb 0.09 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2oqm h ASP 4 CO -0.12 0.80 -0.56 -0.07 -1.72 0.00 0.00 179.24 177.56 2oqm h LEU 5 N 0.74 0.00 0.00 1.55 3.38 -1.80 -1.61 115.31 117.57 2oqm h LEU 5 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2oqm h LEU 5 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2oqm h LEU 5 CO 0.01 0.56 0.00 0.35 0.09 0.00 0.00 178.44 179.45 2oqm n THR 6 N -3.71 0.00 -0.08 0.22 -2.24 -0.95 -4.05 114.28 103.47 2oqm n THR 6 Ca -0.01 0.07 -0.07 0.00 -2.27 0.00 0.00 64.05 61.78 2oqm n THR 6 Cb 0.60 -0.89 -0.00 0.00 -2.10 0.00 0.00 70.33 67.93 2oqm n THR 6 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2oqm h VAL 7 N 0.00 0.50 0.10 2.28 2.07 -1.42 0.15 116.25 119.94 2oqm h VAL 7 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2oqm h VAL 7 Cb 0.00 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2oqm h VAL 7 CO 0.00 0.00 -0.05 0.58 0.02 0.00 0.00 177.57 178.12 2oqm h VAL 8 N -0.13 0.69 -0.16 2.57 2.07 -1.50 -2.62 116.25 117.16 2oqm h VAL 8 Ca 0.16 -1.29 -0.13 0.00 0.82 0.00 0.00 66.70 66.26 2oqm h VAL 8 Cb 0.37 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2oqm h VAL 8 CO -0.39 0.21 -0.47 -0.61 0.02 0.00 0.00 177.57 176.33 2oqm h GLN 9 N -0.97 0.40 -0.35 1.57 5.75 -1.29 -1.91 115.11 118.32 2oqm h GLN 9 Ca -0.01 -0.22 -0.11 0.00 -0.15 0.00 0.00 58.65 58.15 2oqm h GLN 9 Cb 0.45 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 2oqm h GLN 9 CO 0.02 0.79 -0.23 0.74 -2.65 0.00 0.00 178.83 177.50 2oqm h PHE 10 N 0.32 0.78 -0.48 3.99 0.04 -0.82 -2.87 116.94 117.91 2oqm h PHE 10 Ca 0.02 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.61 2oqm h PHE 10 Cb 0.95 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 2oqm h PHE 10 CO 0.03 0.86 0.28 0.77 -0.60 0.00 0.00 178.31 179.65 2oqm h SER 11 N 0.61 0.59 0.00 2.17 0.02 -1.19 -0.96 113.55 114.79 2oqm h SER 11 Ca 0.08 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2oqm h SER 11 Cb 0.72 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.11 2oqm h SER 11 CO 0.06 0.49 0.00 1.17 -1.14 0.00 0.00 176.83 177.40 2oqm n LYS 12 N -4.69 0.00 0.00 3.45 4.81 -0.74 -1.41 118.16 119.58 2oqm n LYS 12 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2oqm n LYS 12 Cb 0.07 -0.89 0.00 0.00 0.02 0.00 0.00 35.03 34.23 2oqm n LYS 12 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2oqm n LEU 14 N 0.39 0.00 -0.35 3.14 4.77 -0.36 -0.92 117.00 123.67 2oqm n LEU 14 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 2oqm n LEU 14 Cb 0.00 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.20 2oqm n LEU 14 CO 0.00 0.00 1.26 0.11 -1.33 0.00 0.00 177.39 177.43 2oqm h LYS 15 N 0.00 1.20 -0.73 3.23 1.57 -1.50 -1.60 116.57 118.75 2oqm h LYS 15 Ca 0.00 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2oqm h LYS 15 Cb 0.00 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.01 2oqm h LYS 15 CO 0.00 0.79 0.34 -0.91 -0.57 0.00 0.00 179.45 179.10 2oqm h ASN 16 N 1.24 0.94 -0.62 0.86 2.35 -1.28 -1.65 115.58 117.41 2oqm h ASN 16 Ca 0.35 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2oqm h ASN 16 Cb -0.10 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.00 2oqm h ASN 16 CO -0.09 0.80 0.28 0.25 -1.65 0.00 0.00 177.43 177.03 2oqm h LEU 17 N 1.03 0.85 -0.76 1.61 5.85 -1.69 0.05 115.31 122.26 2oqm h LEU 17 Ca 0.25 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2oqm h LEU 17 Cb 0.12 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2oqm h LEU 17 CO -0.03 0.75 0.35 -1.13 -0.34 0.00 0.00 178.44 178.04 2oqm h ASN 18 N 0.93 1.00 -0.68 1.25 -1.24 -0.65 -2.33 115.58 113.86 2oqm h ASN 18 Ca 0.22 -0.14 -0.05 0.00 0.71 0.00 0.00 56.30 57.04 2oqm h ASN 18 Cb 0.14 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.90 2oqm h ASN 18 CO -0.02 0.86 0.22 0.00 -1.29 0.00 0.00 177.43 177.20 2oqm h ALA 19 N 1.18 1.08 -0.97 1.57 0.00 -0.43 -1.98 119.26 119.71 2oqm h ALA 19 Ca 0.26 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 55.06 2oqm h ALA 19 Cb 0.14 -0.27 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 2oqm h ALA 19 CO -0.03 0.63 0.60 0.82 0.00 0.00 0.00 179.25 181.27 2oqm h ILE 20 N 1.03 0.94 0.00 0.00 2.04 -0.81 -2.67 117.51 118.04 2oqm h ILE 20 Ca 0.23 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 2oqm h ILE 20 Cb 0.28 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.23 2oqm h ILE 20 CO -0.01 0.18 -0.43 -0.26 0.00 0.00 0.00 178.15 177.63 2oqm h PHE 21 N 0.98 0.00 -0.79 1.37 0.04 -0.84 -2.02 116.94 115.68 2oqm h PHE 21 Ca 0.47 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.23 2oqm h PHE 21 Cb 0.42 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.53 2oqm h PHE 21 CO -0.02 0.43 0.45 -0.44 -0.60 0.00 0.00 178.31 178.14 2oqm h ASP 22 N 0.00 0.96 -0.62 2.17 3.32 -1.05 -0.46 116.42 120.74 2oqm h ASP 22 Ca -0.00 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 56.89 2oqm h ASP 22 Cb 1.09 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.37 2oqm h ASP 22 CO 0.06 0.76 0.10 0.11 -1.72 0.00 0.00 179.24 178.55 2oqm h LYS 23 N 1.08 1.05 -0.80 3.56 1.57 -1.21 -1.93 116.57 119.90 2oqm h LYS 23 Ca 0.28 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2oqm h LYS 23 Cb -0.00 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 2oqm h LYS 23 CO -0.05 0.97 0.53 0.00 -0.57 0.00 0.00 179.45 180.33 2oqm h ALA 24 N 1.11 1.01 -0.62 3.86 0.00 -1.01 -0.08 119.26 123.52 2oqm h ALA 24 Ca 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2oqm h ALA 24 Cb 0.43 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2oqm h ALA 24 CO 0.01 0.42 0.31 0.93 0.00 0.00 0.00 179.25 180.92 2oqm h GLU 25 N 1.08 0.89 -0.24 0.00 5.08 -0.97 -1.28 114.58 119.14 2oqm h GLU 25 Ca 0.29 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 2oqm h GLU 25 Cb -0.12 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 28.94 2oqm h GLU 25 CO -0.06 0.71 0.11 0.00 -1.00 0.00 0.00 179.01 178.77 2oqm h ALA 26 N 1.14 0.28 -0.49 3.43 0.00 -0.84 -1.06 119.26 121.71 2oqm h ALA 26 Ca 0.22 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2oqm h ALA 26 Cb 0.10 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2oqm h ALA 26 CO -0.03 -0.30 0.19 0.35 0.00 0.00 0.00 179.25 179.47 2oqm h PHE 27 N 0.24 0.34 -0.68 0.00 3.57 -0.85 -0.33 116.94 119.22 2oqm h PHE 27 Ca 0.10 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2oqm h PHE 27 Cb 0.04 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 2oqm h PHE 27 CO -0.10 0.13 0.15 0.00 -2.23 0.00 0.00 178.31 176.26 2oqm h ALA 28 N 1.32 0.90 0.02 2.41 0.00 -1.03 0.21 119.26 123.09 2oqm h ALA 28 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oqm h ALA 28 Cb 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2oqm h ALA 28 CO -0.22 0.64 -0.01 1.49 0.00 0.00 0.00 179.25 181.15 2oqm h GLU 29 N 1.04 -0.02 -0.63 0.00 4.57 -0.83 0.31 114.58 119.01 2oqm h GLU 29 Ca 0.21 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2oqm h GLU 29 Cb 0.39 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 2oqm h GLU 29 CO 0.01 0.36 0.32 1.25 -1.18 0.00 0.00 179.01 179.77 2oqm h LEU 30 N -0.42 0.82 -1.23 1.64 5.85 -0.90 -2.76 115.31 118.30 2oqm h LEU 30 Ca -0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2oqm h LEU 30 Cb 0.40 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2oqm h LEU 30 CO 0.00 0.71 0.00 0.29 -0.34 0.00 0.00 178.44 179.10 2oqm n LYS 31 N -4.51 1.84 -3.95 1.25 4.76 0.72 -4.94 118.16 113.32 2oqm n LYS 31 Ca 0.04 -1.23 -0.26 0.00 -2.87 0.00 0.00 58.31 53.99 2oqm n LYS 31 Cb 0.11 -1.46 -0.01 0.00 -1.84 0.00 0.00 35.03 31.84 2oqm n LYS 31 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2oqm n LYS 32 N 0.47 -3.60 -3.84 1.97 4.76 -0.26 -4.97 118.16 112.69 2oqm n LYS 32 Ca 0.18 0.44 -0.37 0.00 -2.87 0.00 0.00 58.31 55.68 2oqm n LYS 32 Cb 0.40 -4.72 -0.06 0.00 -1.84 0.00 0.00 35.03 28.81 2oqm n LYS 32 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2oqm s VAL 33 N -3.82 5.46 0.00 -0.18 1.01 -0.07 -5.03 120.40 117.78 2oqm s VAL 33 Ca 0.12 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.36 2oqm s VAL 33 Cb -0.06 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.89 2oqm s VAL 33 CO 0.88 0.61 0.00 -0.67 0.00 0.00 0.00 175.10 175.92 2oqm n ASP 34 N 1.95 0.00 0.00 3.32 2.03 -1.26 -4.56 116.55 118.03 2oqm n ASP 34 Ca -0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.12 2oqm n ASP 34 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 2oqm n ASP 34 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2oqm n ASP 36 N 0.00 0.00 -0.08 1.67 8.00 -1.26 -3.50 116.55 121.38 2oqm n ASP 36 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 2oqm n ASP 36 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2oqm n ASP 36 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2oqm h VAL 37 N 0.00 1.20 -0.16 2.53 2.07 -1.97 -1.48 116.25 118.45 2oqm h VAL 37 Ca 0.00 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 2oqm h VAL 37 Cb 0.00 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2oqm h VAL 37 CO 0.00 0.21 0.08 -0.07 0.02 0.00 0.00 177.57 177.81 2oqm h LEU 38 N 0.23 0.20 -1.93 2.57 3.38 -1.97 -2.58 115.31 115.21 2oqm h LEU 38 Ca 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2oqm h LEU 38 Cb 0.25 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2oqm h LEU 38 CO -0.00 0.25 -0.03 -0.07 0.09 0.00 0.00 178.44 178.68 2oqm h LEU 39 N 0.14 0.01 -2.08 1.67 3.38 -1.86 -2.06 115.31 114.50 2oqm h LEU 39 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2oqm h LEU 39 Cb 0.10 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2oqm h LEU 39 CO -0.01 0.04 0.00 0.59 0.09 0.00 0.00 178.44 179.15 2oqm n ASN 40 N -4.50 3.08 -4.89 -0.43 3.02 -0.57 -2.31 115.26 108.66 2oqm n ASN 40 Ca -0.03 -1.95 -0.29 0.00 -0.03 0.00 0.00 54.58 52.28 2oqm n ASN 40 Cb 0.12 -0.28 0.03 0.00 -0.61 0.00 0.00 39.78 39.03 2oqm n ASN 40 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2oqm s SER 41 N -1.32 5.71 0.19 6.41 0.01 -0.78 -4.75 113.70 119.17 2oqm s SER 41 Ca 0.38 1.05 -0.21 0.00 1.31 0.00 0.00 55.95 58.48 2oqm s SER 41 Cb 0.21 -2.00 0.05 0.00 0.21 0.00 0.00 66.02 64.50 2oqm s SER 41 CO 0.29 -1.10 0.59 0.00 0.41 0.00 0.00 173.24 173.43 2oqm s ARG 42 N -5.16 1.38 0.10 12.44 1.70 -1.26 -1.44 118.95 126.71 2oqm s ARG 42 Ca 0.55 -0.68 0.24 0.00 -0.47 0.00 0.00 55.73 55.37 2oqm s ARG 42 Cb -0.11 0.57 0.24 0.00 -0.57 0.00 0.00 34.95 35.08 2oqm s ARG 42 CO 0.50 -0.60 1.22 1.28 -1.08 0.00 0.00 175.30 176.61 2oqm n LEU 43 N -0.37 0.68 -3.59 -1.89 4.77 -1.26 -4.92 117.00 110.41 2oqm n LEU 43 Ca -0.13 0.16 -0.16 0.00 -0.03 0.00 0.00 56.01 55.85 2oqm n LEU 43 Cb 0.63 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 2oqm n LEU 43 CO 0.14 -0.03 0.31 0.00 -1.33 0.00 0.00 177.39 176.47 2oqm s ALA 44 N -3.19 -1.44 0.47 -1.18 0.00 -1.26 -5.04 121.76 110.12 2oqm s ALA 44 Ca 0.05 0.95 0.13 0.00 0.00 0.00 0.00 51.96 53.10 2oqm s ALA 44 Cb 0.13 0.08 1.09 0.00 0.00 0.00 0.00 23.12 24.42 2oqm s ALA 44 CO 0.75 -0.36 2.08 0.00 0.00 0.00 0.00 175.76 178.23 2oqm h ALA 45 N 3.20 1.84 -0.48 0.00 0.00 -2.01 -1.14 119.26 120.66 2oqm h ALA 45 Ca -0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2oqm h ALA 45 Cb 1.16 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2oqm h ALA 45 CO 0.40 0.13 0.01 -0.40 0.00 0.00 0.00 179.25 179.38 2oqm n ASP 46 N -4.46 5.17 -4.64 0.00 5.75 -1.26 -4.94 116.55 112.17 2oqm n ASP 46 Ca -0.02 -2.98 -0.33 0.00 -0.01 0.00 0.00 54.79 51.46 2oqm n ASP 46 Cb 0.13 -0.65 -0.10 0.00 -1.03 0.00 0.00 41.12 39.48 2oqm n ASP 46 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2oqm s GLN 47 N -2.80 2.75 0.37 0.11 0.74 -0.43 -5.10 119.66 115.30 2oqm s GLN 47 Ca 0.51 -0.59 -0.26 0.00 0.05 0.00 0.00 55.36 55.07 2oqm s GLN 47 Cb 0.40 -2.63 -0.11 0.00 1.10 0.00 0.00 33.01 31.76 2oqm s GLN 47 CO 0.14 0.64 1.15 1.19 -0.55 0.00 0.00 175.29 177.86 2oqm n PHE 48 N 1.75 1.74 -1.72 1.67 3.72 -1.26 -4.74 117.46 118.63 2oqm n PHE 48 Ca -0.16 0.57 -0.24 0.00 -0.05 0.00 0.00 57.45 57.57 2oqm n PHE 48 Cb 0.53 -2.32 0.17 0.00 -0.94 0.00 0.00 39.48 36.92 2oqm n PHE 48 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2oqm n ASN 49 N 0.64 -0.02 -0.22 4.37 0.23 -1.26 -4.71 115.26 114.29 2oqm n ASN 49 Ca 0.07 -1.38 -0.07 0.00 -0.53 0.00 0.00 54.58 52.68 2oqm n ASN 49 Cb 0.37 -0.84 0.04 0.00 -2.08 0.00 0.00 39.78 37.27 2oqm n ASN 49 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2oqm h LEU 50 N 0.00 0.81 -0.62 -4.53 5.85 -1.17 -0.78 115.31 114.88 2oqm h LEU 50 Ca -0.35 -0.13 0.09 0.00 0.84 0.00 0.00 57.88 58.33 2oqm h LEU 50 Cb 0.98 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.73 2oqm h LEU 50 CO 0.25 0.71 0.26 0.40 -0.34 0.00 0.00 178.44 179.72 2oqm h ILE 51 N 0.86 0.81 -0.47 4.05 2.04 -1.77 -2.17 117.51 120.87 2oqm h ILE 51 Ca 0.22 -0.16 -0.14 0.00 1.00 0.00 0.00 64.86 65.78 2oqm h ILE 51 Cb 0.11 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 2oqm h ILE 51 CO -0.03 0.08 -0.24 0.03 0.00 0.00 0.00 178.15 177.99 2oqm h ARG 52 N 0.46 1.00 -0.75 2.37 2.47 -1.67 -1.59 114.38 116.66 2oqm h ARG 52 Ca 0.31 -0.44 0.06 0.00 -1.26 0.00 0.00 59.98 58.64 2oqm h ARG 52 Cb 0.34 -0.02 -0.06 0.00 -1.65 0.00 0.00 29.97 28.58 2oqm h ARG 52 CO -0.28 1.12 0.44 1.96 0.56 0.00 0.00 179.97 183.78 2oqm h GLN 53 N 0.85 0.79 -0.33 0.04 1.08 -0.75 0.45 115.11 117.24 2oqm h GLN 53 Ca 0.10 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.21 2oqm h GLN 53 Cb 0.83 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 28.07 2oqm h GLN 53 CO 0.07 0.52 0.01 0.28 -0.95 0.00 0.00 178.83 178.76 2oqm h VAL 54 N 0.81 1.25 -0.73 -0.54 2.07 -1.04 0.15 116.25 118.23 2oqm h VAL 54 Ca 0.33 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.92 2oqm h VAL 54 Cb 0.19 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 2oqm h VAL 54 CO -0.18 0.31 0.46 1.56 0.02 0.00 0.00 177.57 179.73 2oqm h GLN 55 N 0.37 0.97 -0.29 1.57 4.20 -0.84 -0.37 115.11 120.72 2oqm h GLN 55 Ca 0.09 -0.07 -0.18 0.00 0.06 0.00 0.00 58.65 58.55 2oqm h GLN 55 Cb 0.43 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 2oqm h GLN 55 CO 0.01 0.67 -0.52 0.82 -0.67 0.00 0.00 178.83 179.15 2oqm h ILE 56 N 0.99 1.28 -0.45 2.54 2.04 -0.77 -0.83 117.51 122.31 2oqm h ILE 56 Ca 0.26 -1.71 0.04 0.00 1.00 0.00 0.00 64.86 64.45 2oqm h ILE 56 Cb -0.07 1.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 2oqm h ILE 56 CO -0.05 0.56 0.23 0.00 0.00 0.00 0.00 178.15 178.88 2oqm h ALA 57 N 0.75 0.57 -0.51 1.87 0.00 -0.66 0.93 119.26 122.21 2oqm h ALA 57 Ca 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2oqm h ALA 57 Cb 1.11 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2oqm h ALA 57 CO 0.11 -0.12 0.19 0.00 0.00 0.00 0.00 179.25 179.42 2oqm h ASP 59 N 0.69 0.76 -0.24 0.00 3.32 -0.90 -0.44 116.42 119.60 2oqm h ASP 59 Ca 0.17 -0.20 0.02 0.00 0.02 0.00 0.00 57.03 57.04 2oqm h ASP 59 Cb 0.23 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2oqm h ASP 59 CO -0.01 0.85 0.09 0.74 -1.72 0.00 0.00 179.24 179.20 2oqm h THR 60 N 0.72 0.96 0.20 0.35 2.02 -0.52 0.17 112.91 116.81 2oqm h THR 60 Ca 0.13 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 2oqm h THR 60 Cb 0.50 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2oqm h THR 60 CO 0.03 0.04 -0.10 0.00 0.37 0.00 0.00 175.52 175.86 2oqm h ALA 61 N 1.14 -0.27 0.42 6.16 0.00 -1.28 -0.79 119.26 124.64 2oqm h ALA 61 Ca 0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2oqm h ALA 61 Cb 0.06 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2oqm h ALA 61 CO -0.10 -0.60 -0.20 -0.22 0.00 0.00 0.00 179.25 178.13 2oqm h LYS 62 N -0.36 -0.54 -0.21 0.00 3.64 -0.81 -1.93 116.57 116.36 2oqm h LYS 62 Ca -0.03 0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 2oqm h LYS 62 Cb 0.28 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2oqm h LYS 62 CO 0.04 -0.26 -0.44 0.28 -2.27 0.00 0.00 179.45 176.80 2oqm h VAL 63 N -0.77 1.31 -0.05 2.00 2.07 -0.80 -1.35 116.25 118.65 2oqm h VAL 63 Ca -0.06 -1.63 0.03 0.00 0.82 0.00 0.00 66.70 65.86 2oqm h VAL 63 Cb 0.53 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2oqm h VAL 63 CO 0.09 0.51 -0.10 1.23 0.02 0.00 0.00 177.57 179.32 2oqm h GLY 64 N 1.08 -0.07 0.89 2.17 0.00 -1.12 0.69 103.07 106.71 2oqm h GLY 64 Ca 0.03 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 2oqm h GLY 64 CO 0.08 -0.11 0.08 -2.08 0.00 0.00 0.00 176.54 174.51 2oqm h VAL 65 N -0.15 1.20 -0.53 4.60 2.07 -1.23 -1.34 116.25 120.86 2oqm h VAL 65 Ca 0.06 -0.65 0.09 0.00 0.82 0.00 0.00 66.70 67.02 2oqm h VAL 65 Cb 0.23 1.12 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 2oqm h VAL 65 CO -0.15 0.21 0.12 0.00 0.02 0.00 0.00 177.57 177.78 2oqm h ALA 66 N 0.91 0.62 -0.32 1.67 0.00 -1.08 -1.53 119.26 119.53 2oqm h ALA 66 Ca 0.09 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2oqm h ALA 66 Cb 0.25 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2oqm h ALA 66 CO -0.00 -0.29 0.11 0.00 0.00 0.00 0.00 179.25 179.07 2oqm h ARG 67 N 0.26 0.49 -0.17 0.00 3.08 -0.68 0.25 114.38 117.61 2oqm h ARG 67 Ca 0.27 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 2oqm h ARG 67 Cb 0.37 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2oqm h ARG 67 CO -0.34 0.51 -0.11 -0.07 -1.07 0.00 0.00 179.97 178.89 2oqm h LEU 68 N 0.36 0.25 -1.93 3.04 3.38 -0.89 -2.66 115.31 116.85 2oqm h LEU 68 Ca 0.10 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2oqm h LEU 68 Cb 0.21 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2oqm h LEU 68 CO -0.01 0.39 0.00 0.35 0.09 0.00 0.00 178.44 179.27 2oqm n THR 69 N -4.28 0.55 -2.26 0.22 -2.24 -0.61 -4.07 114.28 101.59 2oqm n THR 69 Ca -0.00 -0.66 -0.21 0.00 -2.27 0.00 0.00 64.05 60.91 2oqm n THR 69 Cb 0.26 0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 2oqm n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oqm n GLY 70 N 1.37 -0.06 0.92 3.38 0.00 -0.88 -4.91 105.19 105.01 2oqm n GLY 70 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2oqm n GLY 70 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2oqm n GLN 71 N -2.88 1.81 -0.20 1.61 6.02 0.82 -4.77 117.38 119.79 2oqm n GLN 71 Ca -0.24 -3.16 0.03 0.00 -0.01 0.00 0.00 57.00 53.62 2oqm n GLN 71 Cb 0.68 -1.75 0.29 0.00 1.02 0.00 0.00 30.24 30.49 2oqm n GLN 71 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2oqm h LEU 72 N 1.00 0.78 -1.72 1.08 5.85 -1.88 -1.30 115.31 119.11 2oqm h LEU 72 Ca 0.13 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2oqm h LEU 72 Cb 1.43 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 2oqm h LEU 72 CO 0.25 0.54 -0.15 -0.33 -0.34 0.00 0.00 178.44 178.41 2oqm h GLU 73 N 0.91 0.00 -0.00 1.25 4.39 -1.92 -2.17 114.58 117.04 2oqm h GLU 73 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 2oqm h GLU 73 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2oqm h GLU 73 CO -0.08 0.15 -0.23 0.25 -1.16 0.00 0.00 179.01 177.94 2oqm n THR 74 N -3.61 0.00 -2.09 1.13 -2.24 -0.51 -4.97 114.28 101.98 2oqm n THR 74 Ca -0.01 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2oqm n THR 74 Cb 0.29 0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.67 2oqm n THR 74 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oqm s ALA 75 N -2.59 3.56 0.35 6.98 0.00 -0.82 -4.99 121.76 124.26 2oqm s ALA 75 Ca 0.23 1.26 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 2oqm s ALA 75 Cb 0.19 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.68 2oqm s ALA 75 CO 0.53 -0.66 1.48 -0.35 0.00 0.00 0.00 175.76 176.76 2oqm n PRO 76 N 1.94 2.60 -3.92 0.00 -0.04 -1.26 -5.01 135.00 129.30 2oqm n PRO 76 Ca 0.05 0.91 -0.37 0.00 -0.04 0.00 0.00 63.50 64.05 2oqm n PRO 76 Cb 0.41 -2.64 -0.06 0.00 -0.04 0.00 0.00 33.50 31.17 2oqm n PRO 76 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2oqm s LYS 77 N -1.69 3.44 -0.09 0.54 2.47 -1.26 -5.06 119.74 118.10 2oqm s LYS 77 Ca 0.56 -0.16 0.02 0.00 -1.56 0.00 0.00 55.97 54.83 2oqm s LYS 77 Cb -0.50 -3.17 0.01 0.00 -1.46 0.00 0.00 37.83 32.72 2oqm s LYS 77 CO 0.60 0.74 -0.14 -1.01 0.16 0.00 0.00 175.35 175.70 2oqm s HIS 78 N -0.93 1.78 -1.94 4.03 3.76 -1.26 -5.03 115.29 115.70 2oqm s HIS 78 Ca 0.14 -0.75 0.32 0.00 -0.15 0.00 0.00 55.06 54.62 2oqm s HIS 78 Cb -0.12 -1.29 1.86 0.00 1.11 0.00 0.00 32.58 34.14 2oqm s HIS 78 CO 0.03 -0.38 2.21 -0.40 -0.85 0.00 0.00 174.74 175.35 2oqm n ASP 79 N 3.99 0.01 -2.83 1.40 5.75 -1.26 -4.93 116.55 118.68 2oqm n ASP 79 Ca -0.20 -0.91 -0.20 0.00 -0.01 0.00 0.00 54.79 53.47 2oqm n ASP 79 Cb 0.52 -0.03 0.04 0.00 -1.03 0.00 0.00 41.12 40.62 2oqm n ASP 79 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2oqm n ASP 80 N -1.02 -5.69 -0.28 -1.12 8.00 -1.26 -4.91 116.55 110.27 2oqm n ASP 80 Ca 0.23 -0.31 0.14 0.00 0.71 0.00 0.00 54.79 55.56 2oqm n ASP 80 Cb 0.13 -4.46 0.58 0.00 -0.02 0.00 0.00 41.12 37.34 2oqm n ASP 80 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2oqm n SER 81 N -2.14 0.96 -4.76 -2.24 3.41 -1.26 -4.95 113.62 102.65 2oqm n SER 81 Ca -0.07 -1.11 -0.41 0.00 -0.26 0.00 0.00 58.87 57.02 2oqm n SER 81 Cb 0.59 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 2oqm n SER 81 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2oqm s GLU 82 N -2.20 4.25 0.00 4.33 8.01 -1.26 -4.91 118.70 126.92 2oqm s GLU 82 Ca 0.35 2.36 0.00 0.00 0.01 0.00 0.00 54.97 57.69 2oqm s GLU 82 Cb 0.21 -3.07 0.00 0.00 -4.31 0.00 0.00 34.13 26.96 2oqm s GLU 82 CO 0.41 -0.41 0.02 0.25 0.01 0.00 0.00 175.26 175.54 2oqm n THR 83 N 1.66 0.00 -4.40 3.63 -2.24 -1.26 -5.03 114.28 106.65 2oqm n THR 83 Ca 0.04 -0.30 -0.21 0.00 -2.27 0.00 0.00 64.05 61.32 2oqm n THR 83 Cb 0.40 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.56 2oqm n THR 83 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2oqm s THR 84 N -0.56 2.01 0.29 4.28 -4.23 -1.26 -4.98 115.64 111.18 2oqm s THR 84 Ca 0.00 -2.28 -0.03 0.00 -1.18 0.00 0.00 61.69 58.20 2oqm s THR 84 Cb 0.00 -2.16 0.26 0.00 1.34 0.00 0.00 72.50 71.94 2oqm s THR 84 CO 0.00 -0.51 1.96 0.25 -0.54 0.00 0.00 174.62 175.78 2oqm h LEU 85 N 2.44 0.99 -0.74 4.79 5.85 -1.99 -2.16 115.31 124.49 2oqm h LEU 85 Ca -0.39 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.32 2oqm h LEU 85 Cb 1.24 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.98 2oqm h LEU 85 CO 0.62 0.72 0.49 0.00 -0.34 0.00 0.00 178.44 179.92 2oqm h ALA 86 N 1.46 0.93 -0.47 1.25 0.00 -1.99 0.43 119.26 120.87 2oqm h ALA 86 Ca 0.32 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 2oqm h ALA 86 Cb -0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 2oqm h ALA 86 CO -0.07 0.35 -0.13 0.93 0.00 0.00 0.00 179.25 180.32 2oqm h GLU 87 N 0.99 0.87 -0.52 0.00 5.08 -1.88 -0.94 114.58 118.17 2oqm h GLU 87 Ca 0.27 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 2oqm h GLU 87 Cb -0.11 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2oqm h GLU 87 CO -0.06 0.95 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.75 2oqm h LEU 88 N 0.77 0.97 -1.29 1.33 3.38 -0.76 -1.71 115.31 118.00 2oqm h LEU 88 Ca 0.12 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 2oqm h LEU 88 Cb 0.65 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 2oqm h LEU 88 CO 0.05 1.08 0.36 0.03 0.09 0.00 0.00 178.44 180.05 2oqm h ARG 89 N 0.84 0.85 -0.69 1.13 2.47 -0.54 -1.37 114.38 117.07 2oqm h ARG 89 Ca 0.14 -0.08 -0.05 0.00 -1.26 0.00 0.00 59.98 58.73 2oqm h ARG 89 Cb 0.63 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 28.75 2oqm h ARG 89 CO 0.04 0.61 0.23 0.37 0.56 0.00 0.00 179.97 181.78 2oqm h GLN 90 N 0.86 1.06 -0.30 0.04 5.75 -0.95 -1.29 115.11 120.29 2oqm h GLN 90 Ca 0.22 -0.22 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2oqm h GLN 90 Cb -0.01 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.37 2oqm h GLN 90 CO -0.04 0.91 0.18 -0.09 -2.65 0.00 0.00 178.83 177.14 2oqm h ARG 91 N 1.00 0.40 -0.41 1.69 9.65 -0.49 -0.80 114.38 125.42 2oqm h ARG 91 Ca 0.22 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.07 2oqm h ARG 91 Cb 0.28 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 2oqm h ARG 91 CO -0.01 0.30 0.27 0.82 2.80 0.00 0.00 179.97 184.15 2oqm h ILE 92 N 0.38 1.11 -0.96 1.20 2.04 -1.20 -1.98 117.51 118.10 2oqm h ILE 92 Ca 0.11 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.79 2oqm h ILE 92 Cb -0.00 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 2oqm h ILE 92 CO -0.02 0.10 0.64 0.00 0.00 0.00 0.00 178.15 178.87 2oqm h ALA 93 N 1.15 1.25 -0.36 1.87 0.00 -0.77 -0.76 119.26 121.63 2oqm h ALA 93 Ca 0.15 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2oqm h ALA 93 Cb -0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 2oqm h ALA 93 CO -0.03 0.57 -0.18 0.77 0.00 0.00 0.00 179.25 180.38 2oqm h SER 94 N 1.27 0.79 -0.73 0.00 0.02 -0.87 -0.59 113.55 113.43 2oqm h SER 94 Ca 0.37 -0.41 -0.06 0.00 -0.84 0.00 0.00 61.79 60.85 2oqm h SER 94 Cb -0.09 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.20 2oqm h SER 94 CO -0.10 1.02 0.24 0.58 -1.14 0.00 0.00 176.83 177.44 2oqm h VAL 95 N 0.55 1.26 -0.67 2.27 2.07 -0.98 -0.08 116.25 120.68 2oqm h VAL 95 Ca 0.08 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 2oqm h VAL 95 Cb 0.73 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 2oqm h VAL 95 CO 0.05 0.35 0.36 -0.07 0.02 0.00 0.00 177.57 178.28 2oqm h LEU 96 N 1.09 0.84 -0.55 2.57 3.38 -0.89 -0.66 115.31 121.11 2oqm h LEU 96 Ca 0.24 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2oqm h LEU 96 Cb 0.28 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2oqm h LEU 96 CO -0.01 0.71 0.20 0.74 0.09 0.00 0.00 178.44 180.17 2oqm h THR 97 N 0.91 1.23 -0.33 0.22 2.02 -0.77 -1.97 112.91 114.23 2oqm h THR 97 Ca 0.23 -0.73 0.04 0.00 0.77 0.00 0.00 66.41 66.72 2oqm h THR 97 Cb 0.06 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 2oqm h THR 97 CO -0.04 0.28 0.11 0.22 0.37 0.00 0.00 175.52 176.46 2oqm h TYR 98 N 0.75 0.19 -0.30 3.16 3.20 -0.69 -2.72 116.97 120.56 2oqm h TYR 98 Ca 0.18 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 2oqm h TYR 98 Cb 0.23 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2oqm h TYR 98 CO 0.01 0.08 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.44 2oqm h LEU 99 N 0.24 0.48 -2.34 2.82 3.38 -0.92 -1.67 115.31 117.29 2oqm h LEU 99 Ca 0.15 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2oqm h LEU 99 Cb 0.13 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2oqm h LEU 99 CO -0.16 0.61 0.19 -0.33 0.09 0.00 0.00 178.44 178.84 2oqm h GLU 100 N 0.47 0.00 0.00 1.13 5.08 -1.03 -2.67 114.58 117.55 2oqm h GLU 100 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2oqm h GLU 100 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2oqm h GLU 100 CO 0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 2oqm n GLY 101 N -1.30 -1.40 3.93 -3.84 0.00 -0.63 -4.86 105.19 97.10 2oqm n GLY 101 Ca -0.00 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2oqm n GLY 101 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oqm s PHE 102 N -3.03 3.49 0.31 1.61 0.40 -1.01 -5.13 117.98 114.63 2oqm s PHE 102 Ca 0.12 0.39 0.03 0.00 -0.60 0.00 0.00 56.93 56.86 2oqm s PHE 102 Cb 0.16 -1.91 -0.05 0.00 0.51 0.00 0.00 43.02 41.72 2oqm s PHE 102 CO 0.47 0.20 0.09 -1.54 0.70 0.00 0.00 175.22 175.15 2oqm s SER 103 N -3.67 1.92 0.27 1.36 1.04 -1.26 -5.05 113.70 108.31 2oqm s SER 103 Ca 0.40 -1.44 0.01 0.00 0.48 0.00 0.00 55.95 55.40 2oqm s SER 103 Cb -0.10 0.14 0.60 0.00 0.10 0.00 0.00 66.02 66.76 2oqm s SER 103 CO 0.33 -0.73 1.75 -0.33 0.98 0.00 0.00 173.24 175.24 2oqm h GLU 104 N 2.17 0.57 -0.04 4.02 3.07 -1.97 -1.05 114.58 121.35 2oqm h GLU 104 Ca -0.38 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.44 2oqm h GLU 104 Cb 1.25 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 29.03 2oqm h GLU 104 CO 0.63 0.38 -0.00 0.00 -1.40 0.00 0.00 179.01 178.61 2oqm h ALA 105 N 1.60 1.92 0.00 3.43 0.00 -1.97 -0.15 119.26 124.10 2oqm h ALA 105 Ca 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2oqm h ALA 105 Cb 0.78 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2oqm h ALA 105 CO -0.40 0.06 0.00 -0.44 0.00 0.00 0.00 179.25 178.47 2oqm h ASP 106 N 0.06 0.00 -0.63 0.00 3.32 -1.59 -2.39 116.42 115.17 2oqm h ASP 106 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2oqm h ASP 106 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2oqm h ASP 106 CO 0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2oqm n PHE 107 N -2.98 1.57 -0.35 4.55 3.01 -0.07 -4.62 117.46 118.57 2oqm n PHE 107 Ca -0.02 -0.61 0.10 0.00 1.01 0.00 0.00 57.45 57.92 2oqm n PHE 107 Cb 0.09 -0.28 0.28 0.00 -0.01 0.00 0.00 39.48 39.55 2oqm n PHE 107 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2oqm h ALA 108 N 4.13 1.57 -0.18 4.37 0.00 -1.53 -1.60 119.26 126.01 2oqm h ALA 108 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2oqm h ALA 108 Cb 1.52 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.17 2oqm h ALA 108 CO 0.27 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.68 2oqm n ASN 109 N -4.71 2.85 -0.26 0.00 3.02 -1.26 -4.74 115.26 110.16 2oqm n ASN 109 Ca 0.21 -2.44 0.07 0.00 -0.03 0.00 0.00 54.58 52.39 2oqm n ASN 109 Cb 0.46 -0.29 0.31 0.00 -0.61 0.00 0.00 39.78 39.66 2oqm n ASN 109 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oqm h ALA 110 N 1.13 1.67 -0.42 5.41 0.00 -1.43 -1.84 119.26 123.78 2oqm h ALA 110 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2oqm h ALA 110 Cb 0.90 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2oqm h ALA 110 CO 0.06 0.17 0.11 0.00 0.00 0.00 0.00 179.25 179.58 2oqm h ALA 111 N 1.57 1.41 -0.01 0.00 0.00 -1.85 -3.14 119.26 117.24 2oqm h ALA 111 Ca 0.39 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2oqm h ALA 111 Cb 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2oqm h ALA 111 CO -0.16 0.43 -0.37 0.25 0.00 0.00 0.00 179.25 179.40 2oqm n THR 112 N -4.32 0.00 -1.68 0.00 -2.24 -1.01 -2.30 114.28 102.72 2oqm n THR 112 Ca 0.03 -0.31 -0.40 0.00 -2.27 0.00 0.00 64.05 61.09 2oqm n THR 112 Cb 0.19 1.13 0.02 0.00 -2.10 0.00 0.00 70.33 69.58 2oqm n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oqm n ILE 113 N -0.40 2.91 -3.26 2.28 3.06 -0.72 -4.61 119.36 118.61 2oqm n ILE 113 Ca 0.05 -0.50 -0.41 0.00 -2.50 0.00 0.00 62.75 59.39 2oqm n ILE 113 Cb 0.28 -1.46 -0.08 0.00 0.54 0.00 0.00 39.64 38.93 2oqm n ILE 113 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 2oqm s GLN 114 N -2.36 3.73 -0.23 9.51 -0.21 -1.26 -0.91 119.66 127.93 2oqm s GLN 114 Ca 0.65 -0.07 -0.08 0.00 0.02 0.00 0.00 55.36 55.88 2oqm s GLN 114 Cb -0.49 -3.77 -0.04 0.00 1.00 0.00 0.00 33.01 29.72 2oqm s GLN 114 CO 0.55 -0.55 0.09 0.42 -2.12 0.00 0.00 175.29 173.67 2oqm s ILE 115 N 2.33 4.67 -0.16 1.08 -1.09 -0.10 -4.95 121.20 122.98 2oqm s ILE 115 Ca 0.18 -0.06 -0.03 0.00 -2.23 0.00 0.00 60.65 58.51 2oqm s ILE 115 Cb -0.16 -3.16 0.05 0.00 -1.58 0.00 0.00 42.46 37.62 2oqm s ILE 115 CO 0.12 0.36 0.04 -0.55 -1.23 0.00 0.00 174.94 173.69 2oqm s SER 116 N 1.20 2.49 0.66 3.58 0.15 -1.26 -1.19 113.70 119.32 2oqm s SER 116 Ca 0.05 -0.62 -0.11 0.00 0.70 0.00 0.00 55.95 55.98 2oqm s SER 116 Cb -0.14 -0.47 -0.02 0.00 -1.71 0.00 0.00 66.02 63.68 2oqm s SER 116 CO 0.04 -0.30 1.04 -1.10 1.20 0.00 0.00 173.24 174.13 2oqm s GLN 117 N 1.96 3.29 0.57 5.44 -0.21 -1.26 -4.95 119.66 124.49 2oqm s GLN 117 Ca 0.01 0.84 0.26 0.00 0.02 0.00 0.00 55.36 56.49 2oqm s GLN 117 Cb -0.16 -2.04 1.57 0.00 1.00 0.00 0.00 33.01 33.38 2oqm s GLN 117 CO -0.08 -0.82 2.11 -1.35 -2.12 0.00 0.00 175.29 173.03 2oqm h PRO 118 N -0.51 0.00 -0.58 2.91 0.11 -2.01 -1.99 132.00 129.93 2oqm h PRO 118 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2oqm h PRO 118 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2oqm h PRO 118 CO 0.60 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.93 2oqm n ARG 119 N -4.02 2.51 -0.30 1.05 1.74 -1.26 -4.30 116.66 112.07 2oqm n ARG 119 Ca 0.02 -2.08 0.12 0.00 -0.77 0.00 0.00 57.85 55.14 2oqm n ARG 119 Cb 0.31 -1.52 0.28 0.00 -1.02 0.00 0.00 32.46 30.52 2oqm n ARG 119 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2oqm n TRP 120 N 1.08 0.78 -3.96 -1.55 8.01 -0.75 -4.96 117.44 116.09 2oqm n TRP 120 Ca 0.19 -0.39 -0.31 0.00 -1.31 0.00 0.00 57.50 55.68 2oqm n TRP 120 Cb 0.54 0.00 0.01 0.00 -2.01 0.00 0.00 31.31 29.85 2oqm n TRP 120 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 2oqm n GLN 121 N 1.54 -4.82 -0.27 -0.99 3.00 -1.26 -1.29 117.38 113.30 2oqm n GLN 121 Ca 0.22 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.75 2oqm n GLN 121 Cb 0.60 -5.39 0.00 0.00 0.00 0.00 0.00 30.24 25.46 2oqm n GLN 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2oqm n GLY 122 N -1.59 1.53 3.81 1.08 0.00 -1.26 -5.03 105.19 103.73 2oqm n GLY 122 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2oqm n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqm s LYS 123 N -0.34 3.56 0.14 1.61 1.02 -0.41 -4.98 119.74 120.35 2oqm s LYS 123 Ca 0.00 1.22 0.03 0.00 0.02 0.00 0.00 55.97 57.24 2oqm s LYS 123 Cb 0.00 -2.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 2oqm s LYS 123 CO 0.00 -0.61 -0.07 1.52 -0.92 0.00 0.00 175.35 175.27 2oqm s TYR 124 N -2.33 1.17 0.17 3.18 1.13 -1.26 -4.40 117.35 115.01 2oqm s TYR 124 Ca 0.64 -0.85 0.11 0.00 -1.41 0.00 0.00 57.07 55.56 2oqm s TYR 124 Cb -0.15 -0.63 -0.04 0.00 -1.10 0.00 0.00 41.96 40.03 2oqm s TYR 124 CO 0.31 -0.03 -0.22 -0.51 -2.51 0.00 0.00 175.55 172.58 2oqm s LEU 125 N -3.14 2.50 0.82 -3.49 1.43 -0.33 -4.94 118.68 111.52 2oqm s LEU 125 Ca 0.17 -0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 2oqm s LEU 125 Cb 0.04 -1.28 0.08 0.00 0.03 0.00 0.00 46.19 45.06 2oqm s LEU 125 CO 0.00 0.14 1.09 0.42 0.23 0.00 0.00 176.35 178.23 2oqm s THR 126 N -1.46 3.08 0.39 5.49 -4.23 -1.26 -0.92 115.64 116.72 2oqm s THR 126 Ca 0.19 0.35 0.07 0.00 -1.18 0.00 0.00 61.69 61.12 2oqm s THR 126 Cb -0.09 -2.97 0.21 0.00 1.34 0.00 0.00 72.50 71.00 2oqm s THR 126 CO 0.09 -0.46 1.98 1.23 -0.54 0.00 0.00 174.62 176.93 2oqm h GLY 127 N -1.21 0.48 0.67 3.99 0.00 -0.86 0.12 103.07 106.26 2oqm h GLY 127 Ca -0.47 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 2oqm h GLY 127 CO 0.56 0.22 -0.01 -1.82 0.00 0.00 0.00 176.54 175.49 2oqm h TYR 128 N 0.45 0.06 -0.57 5.60 3.20 -1.54 -0.50 116.97 123.67 2oqm h TYR 128 Ca 0.11 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.00 2oqm h TYR 128 Cb 0.14 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.35 2oqm h TYR 128 CO 0.00 0.39 0.32 0.93 -1.64 0.00 0.00 178.16 178.17 2oqm h GLU 129 N -0.28 0.60 -0.50 1.82 5.08 -1.74 -2.20 114.58 117.36 2oqm h GLU 129 Ca 0.01 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2oqm h GLU 129 Cb 0.37 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2oqm h GLU 129 CO 0.00 0.40 0.31 0.35 -1.00 0.00 0.00 179.01 179.07 2oqm h PHE 130 N 0.62 0.65 0.10 4.33 3.57 -0.56 0.24 116.94 125.88 2oqm h PHE 130 Ca 0.24 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.76 2oqm h PHE 130 Cb 0.09 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 2oqm h PHE 130 CO -0.08 0.44 -0.18 0.00 -2.23 0.00 0.00 178.31 176.26 2oqm h ALA 131 N 1.15 -0.30 -0.15 2.41 0.00 -0.94 0.31 119.26 121.75 2oqm h ALA 131 Ca 0.18 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 2oqm h ALA 131 Cb -0.03 0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2oqm h ALA 131 CO -0.03 -0.70 -0.56 0.82 0.00 0.00 0.00 179.25 178.77 2oqm h ILE 132 N -0.35 1.33 0.00 0.00 2.04 -1.20 -0.01 117.51 119.32 2oqm h ILE 132 Ca 0.03 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.07 2oqm h ILE 132 Cb 0.36 2.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2oqm h ILE 132 CO -0.10 0.56 -1.76 -0.62 0.00 0.00 0.00 178.15 176.23 2oqm n GLU 133 N -4.14 0.55 0.00 2.37 1.02 0.05 -4.39 120.64 116.10 2oqm n GLU 133 Ca -0.07 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.91 2oqm n GLU 133 Cb 0.63 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 2oqm n GLU 133 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2oqm n HIS 134 N -2.08 -0.01 0.01 -0.32 -0.00 -0.28 -4.72 115.22 107.81 2oqm n HIS 134 Ca -0.02 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.04 2oqm n HIS 134 Cb 0.51 0.04 -0.06 0.00 -0.12 0.00 0.00 29.99 30.35 2oqm n HIS 134 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2oqm h ALA 135 N 0.00 0.07 0.24 1.57 0.00 -1.07 -1.63 119.26 118.44 2oqm h ALA 135 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2oqm h ALA 135 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2oqm h ALA 135 CO 0.00 -0.41 -0.12 0.82 0.00 0.00 0.00 179.25 179.54 2oqm h ILE 136 N 0.05 0.81 -0.92 0.00 2.04 -1.20 -1.56 117.51 116.73 2oqm h ILE 136 Ca 0.02 -0.35 0.12 0.00 1.00 0.00 0.00 64.86 65.65 2oqm h ILE 136 Cb 0.03 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 37.05 2oqm h ILE 136 CO -0.00 0.08 0.59 -0.65 0.00 0.00 0.00 178.15 178.16 2oqm h PRO 137 N -0.50 0.83 -0.40 2.37 0.11 -1.75 -2.53 132.00 130.12 2oqm h PRO 137 Ca -0.03 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.91 2oqm h PRO 137 Cb 0.37 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 2oqm h PRO 137 CO 0.05 0.55 -0.21 -0.91 -0.21 0.00 0.00 178.00 177.28 2oqm h ASN 138 N 0.86 0.88 -0.21 -2.05 2.35 -1.12 -0.87 115.58 115.41 2oqm h ASN 138 Ca 0.45 -0.41 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 2oqm h ASN 138 Cb 0.53 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2oqm h ASN 138 CO -0.21 1.09 0.10 0.25 -1.65 0.00 0.00 177.43 177.01 2oqm h LEU 139 N 0.66 0.16 -0.71 1.61 7.12 -0.95 -1.65 115.31 121.55 2oqm h LEU 139 Ca 0.09 0.01 -0.12 0.00 0.13 0.00 0.00 57.88 57.98 2oqm h LEU 139 Cb 0.77 -0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.86 2oqm h LEU 139 CO 0.06 0.12 -0.33 1.88 -0.13 0.00 0.00 178.44 180.04 2oqm h TYR 140 N 0.22 0.72 -0.15 1.25 0.05 -1.40 -2.26 116.97 115.40 2oqm h TYR 140 Ca 0.08 -0.19 0.05 0.00 0.05 0.00 0.00 58.73 58.72 2oqm h TYR 140 Cb 0.02 -0.16 -0.06 0.00 1.01 0.00 0.00 36.73 37.54 2oqm h TYR 140 CO -0.09 0.88 -0.20 0.35 -1.05 0.00 0.00 178.16 178.04 2oqm h PHE 141 N 0.53 -0.53 -0.00 4.88 3.04 -0.93 -0.29 116.94 123.63 2oqm h PHE 141 Ca 0.06 0.03 -0.21 0.00 3.98 0.00 0.00 57.97 61.83 2oqm h PHE 141 Cb 0.83 0.26 -0.00 0.00 2.56 0.00 0.00 35.95 39.59 2oqm h PHE 141 CO 0.04 -0.28 -0.89 0.45 -2.02 0.00 0.00 178.31 175.60 2oqm h HIS 142 N -0.24 0.46 -0.39 0.41 3.86 -1.18 -0.81 115.15 117.25 2oqm h HIS 142 Ca 0.11 -0.25 -0.04 0.00 -1.16 0.00 0.00 60.37 59.03 2oqm h HIS 142 Cb 0.40 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 2oqm h HIS 142 CO -0.32 1.05 0.08 0.82 0.86 0.00 0.00 177.93 180.42 2oqm h ILE 143 N 0.18 1.24 -0.78 2.45 2.04 -1.44 -1.07 117.51 120.13 2oqm h ILE 143 Ca -0.06 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 2oqm h ILE 143 Cb 1.52 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 2oqm h ILE 143 CO 0.15 0.28 0.42 0.74 0.00 0.00 0.00 178.15 179.74 2oqm h THR 144 N 0.48 1.23 -0.28 -0.27 2.02 -1.00 -0.38 112.91 114.73 2oqm h THR 144 Ca 0.12 -0.59 -0.16 0.00 0.77 0.00 0.00 66.41 66.54 2oqm h THR 144 Cb 0.34 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 2oqm h THR 144 CO 0.00 0.26 -0.47 0.74 0.37 0.00 0.00 175.52 176.42 2oqm h THR 145 N 1.09 1.29 -0.28 3.16 2.02 -1.04 0.55 112.91 119.71 2oqm h THR 145 Ca 0.28 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 65.79 2oqm h THR 145 Cb 0.04 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2oqm h THR 145 CO -0.04 0.54 0.18 0.00 0.37 0.00 0.00 175.52 176.56 2oqm h ALA 146 N 0.87 0.35 -0.36 6.16 0.00 -0.88 -1.05 119.26 124.36 2oqm h ALA 146 Ca 0.03 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2oqm h ALA 146 Cb 1.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2oqm h ALA 146 CO 0.10 -0.19 0.11 -0.92 0.00 0.00 0.00 179.25 178.36 2oqm h TYR 147 N 0.37 0.19 -0.87 0.00 5.03 -0.86 -2.63 116.97 118.21 2oqm h TYR 147 Ca 0.10 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.46 2oqm h TYR 147 Cb -0.04 -0.03 -0.05 0.00 1.55 0.00 0.00 36.73 38.16 2oqm h TYR 147 CO -0.06 0.07 0.56 0.78 -1.32 0.00 0.00 178.16 178.19 2oqm h GLY 148 N 0.25 1.25 0.76 1.82 0.00 -0.49 -0.01 103.07 106.66 2oqm h GLY 148 Ca 0.17 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.10 2oqm h GLY 148 CO -0.18 0.38 0.16 -2.22 0.00 0.00 0.00 176.54 174.67 2oqm h ILE 149 N 1.10 0.94 -0.26 2.60 2.04 -0.99 0.40 117.51 123.34 2oqm h ILE 149 Ca 0.34 -0.12 -0.06 0.00 1.00 0.00 0.00 64.86 66.03 2oqm h ILE 149 Cb -0.02 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2oqm h ILE 149 CO -0.11 0.06 -0.06 -0.07 0.00 0.00 0.00 178.15 177.98 2oqm h LEU 150 N 0.34 0.50 -0.51 1.44 3.38 -1.05 -2.49 115.31 116.91 2oqm h LEU 150 Ca 0.16 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2oqm h LEU 150 Cb 0.10 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2oqm h LEU 150 CO -0.14 0.74 0.28 -0.09 0.09 0.00 0.00 178.44 179.33 2oqm h ARG 151 N 0.24 0.54 -0.63 1.13 9.65 -0.87 -1.67 114.38 122.77 2oqm h ARG 151 Ca 0.07 -0.03 0.03 0.00 -1.10 0.00 0.00 59.98 58.94 2oqm h ARG 151 Cb 0.52 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.95 2oqm h ARG 151 CO 0.02 0.36 0.42 1.25 2.80 0.00 0.00 179.97 184.82 2oqm h HIS 152 N 0.56 0.73 -0.00 2.20 2.76 -0.80 -1.62 115.15 118.97 2oqm h HIS 152 Ca 0.22 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2oqm h HIS 152 Cb 0.08 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 28.79 2oqm h HIS 152 CO -0.08 0.43 -0.03 0.09 -1.30 0.00 0.00 177.93 177.03 2oqm n ASN 153 N -4.46 0.04 0.00 3.26 3.02 -0.80 -4.92 115.26 111.40 2oqm n ASN 153 Ca 0.08 0.39 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 2oqm n ASN 153 Cb 0.12 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 2oqm n ASN 153 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oqm n GLY 154 N 1.48 0.99 3.71 7.41 0.00 -0.61 -5.09 105.19 113.07 2oqm n GLY 154 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2oqm n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oqm s VAL 155 N -2.00 2.91 -1.43 1.61 1.01 -0.70 -4.89 120.40 116.92 2oqm s VAL 155 Ca 0.00 0.57 -0.11 0.00 0.00 0.00 0.00 61.98 62.44 2oqm s VAL 155 Cb 0.00 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 33.07 2oqm s VAL 155 CO 0.00 0.03 2.34 -0.62 0.00 0.00 0.00 175.10 176.84 2oqm n GLU 156 N 4.57 3.51 -3.65 2.72 1.02 -1.26 -4.23 120.64 123.31 2oqm n GLU 156 Ca 0.14 -2.87 -0.31 0.00 -0.02 0.00 0.00 57.16 54.10 2oqm n GLU 156 Cb 0.40 -2.98 -0.05 0.00 -0.02 0.00 0.00 31.44 28.79 2oqm n GLU 156 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2oqm s VAL 157 N 1.59 5.15 0.35 2.62 -7.23 -1.26 -5.05 120.40 116.57 2oqm s VAL 157 Ca 0.51 0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.76 2oqm s VAL 157 Cb 0.15 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 33.42 2oqm s VAL 157 CO -0.06 0.01 0.12 -0.83 -0.31 0.00 0.00 175.10 174.04 2oqm s GLY 158 N -2.48 2.30 0.37 2.32 0.00 -1.26 -4.99 107.32 103.59 2oqm s GLY 158 Ca 0.41 -1.59 0.09 0.00 0.00 0.00 0.00 44.72 43.63 2oqm s GLY 158 CO 0.25 -1.75 1.93 1.70 0.00 0.00 0.00 173.10 175.23 2oqm h LYS 159 N 2.00 0.64 -0.02 2.90 1.63 -2.00 -0.85 116.57 120.88 2oqm h LYS 159 Ca -0.36 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.40 2oqm h LYS 159 Cb 1.26 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 32.74 2oqm h LYS 159 CO 0.58 0.43 0.02 0.87 -3.45 0.00 0.00 179.45 177.89 2oqm h LYS 160 N 0.66 0.03 -0.16 1.90 6.56 -1.96 -1.05 116.57 122.54 2oqm h LYS 160 Ca 0.36 -0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.76 2oqm h LYS 160 Cb 0.49 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.15 2oqm h LYS 160 CO -0.13 0.02 -0.66 -0.44 -2.06 0.00 0.00 179.45 176.18 2oqm h ASP 161 N 0.03 0.71 -0.18 0.86 3.32 -1.52 -0.60 116.42 119.05 2oqm h ASP 161 Ca 0.01 -0.43 -0.11 0.00 0.02 0.00 0.00 57.03 56.51 2oqm h ASP 161 Cb -0.00 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.34 2oqm h ASP 161 CO -0.00 1.19 -0.34 0.22 -1.72 0.00 0.00 179.24 178.59 2oqm h TYR 162 N 0.45 0.68 0.12 4.55 3.20 -1.25 -3.36 116.97 121.36 2oqm h TYR 162 Ca -0.02 -0.24 -0.27 0.00 3.14 0.00 0.00 58.73 61.33 2oqm h TYR 162 Cb 1.25 -0.13 0.03 0.00 1.54 0.00 0.00 36.73 39.42 2oqm h TYR 162 CO 0.06 0.97 -1.14 -0.07 -1.64 0.00 0.00 178.16 176.34 2oqm h LEU 163 N 0.20 0.80 0.00 2.82 3.38 -1.25 -3.47 115.31 117.78 2oqm h LEU 163 Ca 0.01 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.14 2oqm h LEU 163 Cb 0.93 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2oqm h LEU 163 CO 0.08 1.56 0.00 0.61 0.09 0.00 0.00 178.44 180.77 2oqm n GLY 164 N 1.40 -2.34 0.00 0.83 0.00 -0.23 -5.03 105.19 99.82 2oqm n GLY 164 Ca -0.14 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2oqm n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqm n ALA 165 N -0.48 0.00 -2.79 4.61 0.00 -1.26 -4.95 120.51 115.64 2oqm n ALA 165 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2oqm n ALA 165 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2oqm n ALA 165 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2oqm n PRO 167 N -0.02 2.80 -1.92 0.00 -0.04 -1.26 -5.22 135.00 129.34 2oqm n PRO 167 Ca 0.00 -4.39 -0.39 0.00 -0.04 0.00 0.00 63.50 58.68 2oqm n PRO 167 Cb 0.00 -2.07 0.01 0.00 -0.04 0.00 0.00 33.50 31.40 2oqm n PRO 167 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2oqm s TYR 168 N -3.33 2.56 0.00 0.54 2.02 -1.26 -5.02 117.35 112.87 2oqm s TYR 168 Ca 0.45 1.36 0.08 0.00 -0.37 0.00 0.00 57.07 58.60 2oqm s TYR 168 Cb 0.35 -3.76 -0.02 0.00 -0.40 0.00 0.00 41.96 38.13 2oqm s TYR 168 CO -0.13 -2.52 -0.26 0.15 -1.57 0.00 0.00 175.55 171.22 2oqm s LYS 169 N -2.53 2.02 0.36 -0.62 1.02 -1.26 -5.12 119.74 113.60 2oqm s LYS 169 Ca 0.63 -0.99 -0.28 0.00 0.02 0.00 0.00 55.97 55.36 2oqm s LYS 169 Cb -0.40 -2.02 -0.10 0.00 -0.52 0.00 0.00 37.83 34.79 2oqm s LYS 169 CO 0.50 0.55 1.28 0.00 -0.92 0.00 0.00 175.35 176.75 2oqm s ALA 170 N -0.67 3.38 -2.00 5.17 0.00 -1.26 -5.43 121.76 120.95 2oqm s ALA 170 Ca 0.11 1.20 0.15 0.00 0.00 0.00 0.00 51.96 53.42 2oqm s ALA 170 Cb -0.10 -3.46 0.91 0.00 0.00 0.00 0.00 23.12 20.47 2oqm s ALA 170 CO -0.00 -0.65 1.33 -0.35 0.00 0.00 0.00 175.76 176.08