#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5a n GLN 4 N 0.00 0.03 -0.04 1.20 6.02 -1.26 -2.35 117.38 120.98 2o5a n GLN 4 Ca 0.00 0.53 -0.12 0.00 -0.01 0.00 0.00 57.00 57.39 2o5a n GLN 4 Cb 0.00 -1.61 -0.07 0.00 1.02 0.00 0.00 30.24 29.58 2o5a n GLN 4 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2o5a h GLU 5 N 0.00 0.25 0.02 -1.09 3.07 -2.04 0.36 114.58 115.14 2o5a h GLU 5 Ca 0.00 -0.10 -0.23 0.00 -0.50 0.00 0.00 59.36 58.53 2o5a h GLU 5 Cb 0.01 -0.01 0.02 0.00 -0.84 0.00 0.00 28.75 27.93 2o5a h GLU 5 CO 0.00 0.58 -0.89 1.25 -1.40 0.00 0.00 179.01 178.55 2o5a h LEU 6 N -0.09 0.76 -0.32 1.33 6.46 -1.89 -2.68 115.31 118.87 2o5a h LEU 6 Ca 0.03 -0.76 0.03 0.00 -0.12 0.00 0.00 57.88 57.05 2o5a h LEU 6 Cb 0.50 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 2o5a h LEU 6 CO 0.02 1.42 0.14 0.25 -0.62 0.00 0.00 178.44 179.65 2o5a h LEU 7 N 0.17 0.20 -1.34 2.25 5.85 -1.50 0.24 115.31 121.18 2o5a h LEU 7 Ca -0.12 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.56 2o5a h LEU 7 Cb 1.57 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.58 2o5a h LEU 7 CO 0.17 0.15 -0.32 1.56 -0.34 0.00 0.00 178.44 179.67 2o5a h GLN 8 N 0.30 0.00 -0.47 1.25 4.20 -0.36 0.19 115.11 120.22 2o5a h GLN 8 Ca 0.14 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.71 2o5a h GLN 8 Cb 0.07 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2o5a h GLN 8 CO -0.11 0.32 -0.25 1.25 -0.67 0.00 0.00 178.83 179.37 2o5a h LEU 9 N 0.00 1.03 -0.03 1.46 5.85 -0.83 -1.98 115.31 120.80 2o5a h LEU 9 Ca -0.00 -0.41 -0.26 0.00 0.84 0.00 0.00 57.88 58.05 2o5a h LEU 9 Cb 0.63 -0.28 0.02 0.00 0.37 0.00 0.00 40.66 41.39 2o5a h LEU 9 CO 0.04 1.21 -1.05 0.00 -0.34 0.00 0.00 178.44 178.30 2o5a h ALA 10 N 0.86 0.17 -0.76 1.25 0.00 -0.03 -2.83 119.26 117.92 2o5a h ALA 10 Ca 0.10 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 2o5a h ALA 10 Cb 0.83 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2o5a h ALA 10 CO 0.07 0.72 0.41 0.28 0.00 0.00 0.00 179.25 180.74 2o5a h VAL 11 N 0.34 1.23 0.33 0.00 2.07 -0.60 -1.47 116.25 118.14 2o5a h VAL 11 Ca -0.13 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 2o5a h VAL 11 Cb 1.70 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 2o5a h VAL 11 CO 0.20 0.26 -0.16 0.78 0.02 0.00 0.00 177.57 178.67 2o5a h ASN 12 N 1.06 -0.37 -0.46 0.57 -0.26 -1.42 -0.19 115.58 114.50 2o5a h ASN 12 Ca 0.27 -0.16 0.09 0.00 -0.56 0.00 0.00 56.30 55.94 2o5a h ASN 12 Cb 0.05 0.10 -0.10 0.00 -1.06 0.00 0.00 38.32 37.30 2o5a h ASN 12 CO -0.04 -0.02 -0.32 0.00 -1.06 0.00 0.00 177.43 175.99 2o5a h ALA 13 N -0.25 -0.12 0.00 -0.83 0.00 -1.43 0.57 119.26 117.21 2o5a h ALA 13 Ca -0.04 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2o5a h ALA 13 Cb 0.51 0.71 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2o5a h ALA 13 CO 0.07 -0.70 -0.05 0.28 0.00 0.00 0.00 179.25 178.85 2o5a h VAL 14 N -0.22 0.88 0.01 0.00 2.07 -1.27 -2.47 116.25 115.25 2o5a h VAL 14 Ca 0.19 -0.19 -0.21 0.00 0.82 0.00 0.00 66.70 67.32 2o5a h VAL 14 Cb 0.54 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2o5a h VAL 14 CO -0.58 0.05 -0.98 0.44 0.02 0.00 0.00 177.57 176.53 2o5a h ASP 15 N 0.00 0.06 0.25 0.57 5.19 0.18 -2.27 116.42 120.41 2o5a h ASP 15 Ca -0.00 -0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.31 2o5a h ASP 15 Cb 0.10 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 2o5a h ASP 15 CO 0.01 1.00 -0.20 0.44 -3.12 0.00 0.00 179.24 177.36 2o5a h ASP 16 N 0.02 0.00 -0.37 6.45 3.45 0.06 -2.35 116.42 123.68 2o5a h ASP 16 Ca -0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.44 2o5a h ASP 16 Cb 1.70 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.47 2o5a h ASP 16 CO 0.13 0.20 0.00 0.29 -1.57 0.00 0.00 179.24 178.29 2o5a n LYS 17 N -4.12 2.14 -2.15 3.56 4.76 -1.22 -4.95 118.16 116.17 2o5a n LYS 17 Ca -0.02 -1.74 -0.08 0.00 -2.87 0.00 0.00 58.31 53.60 2o5a n LYS 17 Cb 0.27 -1.43 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 2o5a n LYS 17 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2o5a n LYS 18 N 0.93 -0.64 -1.85 1.97 4.76 -0.88 -4.81 118.16 117.64 2o5a n LYS 18 Ca 0.18 0.37 -0.42 0.00 -2.87 0.00 0.00 58.31 55.57 2o5a n LYS 18 Cb 0.45 -4.29 -0.02 0.00 -1.84 0.00 0.00 35.03 29.33 2o5a n LYS 18 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2o5a s ALA 19 N -2.39 3.77 0.19 7.82 0.00 -0.86 -4.98 121.76 125.32 2o5a s ALA 19 Ca 0.00 1.48 -0.01 0.00 0.00 0.00 0.00 51.96 53.43 2o5a s ALA 19 Cb -0.00 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2o5a s ALA 19 CO 0.00 -0.87 0.38 -1.21 0.00 0.00 0.00 175.76 174.06 2o5a s GLU 20 N 0.23 3.52 -1.31 0.00 2.02 -0.65 -4.55 118.70 117.97 2o5a s GLU 20 Ca 0.66 -0.33 -0.00 0.00 0.02 0.00 0.00 54.97 55.32 2o5a s GLU 20 Cb -0.46 -2.85 -0.00 0.00 0.10 0.00 0.00 34.13 30.92 2o5a s GLU 20 CO 0.40 0.41 0.69 1.04 0.02 0.00 0.00 175.26 177.82 2o5a n GLN 21 N -0.58 -4.75 -2.11 1.61 6.02 -1.26 -2.24 117.38 114.07 2o5a n GLN 21 Ca -0.05 0.61 -0.42 0.00 -0.01 0.00 0.00 57.00 57.13 2o5a n GLN 21 Cb 0.54 -5.13 -0.03 0.00 1.02 0.00 0.00 30.24 26.63 2o5a n GLN 21 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2o5a s VAL 22 N -3.68 3.41 -0.03 5.09 1.01 -1.26 -4.38 120.40 120.56 2o5a s VAL 22 Ca 0.01 0.85 0.01 0.00 0.00 0.00 0.00 61.98 62.85 2o5a s VAL 22 Cb -0.00 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2o5a s VAL 22 CO 0.82 0.00 -0.02 -0.69 0.00 0.00 0.00 175.10 175.21 2o5a s VAL 23 N 2.35 0.30 0.01 2.92 1.01 0.21 -5.01 120.40 122.19 2o5a s VAL 23 Ca 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.64 2o5a s VAL 23 Cb -0.35 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2o5a s VAL 23 CO 0.29 0.16 0.09 0.00 0.00 0.00 0.00 175.10 175.64 2o5a s ALA 24 N 0.78 3.61 -0.12 5.51 0.00 -1.26 -0.86 121.76 129.43 2o5a s ALA 24 Ca -0.09 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 50.99 2o5a s ALA 24 Cb -0.12 -1.58 0.02 0.00 0.00 0.00 0.00 23.12 21.44 2o5a s ALA 24 CO -0.01 0.71 -0.12 -0.51 0.00 0.00 0.00 175.76 175.83 2o5a s LEU 25 N -1.89 1.53 0.94 0.00 1.43 -0.19 -1.08 118.68 119.42 2o5a s LEU 25 Ca 0.25 -0.39 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 2o5a s LEU 25 Cb -0.12 -1.00 0.17 0.00 0.03 0.00 0.00 46.19 45.26 2o5a s LEU 25 CO 0.16 -0.05 1.22 0.21 0.23 0.00 0.00 176.35 178.13 2o5a s ASN 26 N 1.33 3.27 0.02 2.29 3.84 0.04 -1.28 114.94 124.46 2o5a s ASN 26 Ca -0.00 0.59 0.00 0.00 0.21 0.00 0.00 52.86 53.65 2o5a s ASN 26 Cb -0.14 -0.88 0.00 0.00 -0.55 0.00 0.00 41.25 39.68 2o5a s ASN 26 CO -0.06 -2.66 0.00 1.17 -2.79 0.00 0.00 177.10 172.76 2o5a n LYS 28 N -3.78 -0.82 -0.60 0.43 3.00 -1.26 -4.88 118.16 110.26 2o5a n LYS 28 Ca 0.11 1.01 0.00 0.00 -0.00 0.00 0.00 58.31 59.43 2o5a n LYS 28 Cb 0.60 -0.75 0.00 0.00 0.00 0.00 0.00 35.03 34.88 2o5a n LYS 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2o5a n GLY 29 N 0.28 0.70 1.44 3.14 0.00 -1.26 -4.86 105.19 104.64 2o5a n GLY 29 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2o5a n GLY 29 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2o5a n ILE 30 N -2.59 0.03 -4.72 -0.61 2.08 -1.26 -5.12 119.36 107.17 2o5a n ILE 30 Ca 0.00 0.01 -0.32 0.00 0.56 0.00 0.00 62.75 63.00 2o5a n ILE 30 Cb 0.00 -1.06 -0.08 0.00 -0.75 0.00 0.00 39.64 37.75 2o5a n ILE 30 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2o5a s SER 31 N -5.02 3.91 -0.50 4.38 0.15 -1.26 -5.16 113.70 110.20 2o5a s SER 31 Ca 0.00 -1.65 0.08 0.00 0.70 0.00 0.00 55.95 55.08 2o5a s SER 31 Cb 0.00 0.48 0.29 0.00 -1.71 0.00 0.00 66.02 65.08 2o5a s SER 31 CO 0.00 -0.85 0.71 0.18 1.20 0.00 0.00 173.24 174.48 2o5a n LEU 32 N -1.20 2.21 0.00 3.45 4.77 -1.26 -4.77 117.00 120.20 2o5a n LEU 32 Ca -0.17 -5.17 0.00 0.00 -0.03 0.00 0.00 56.01 50.64 2o5a n LEU 32 Cb 0.67 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2o5a n LEU 32 CO 0.38 2.16 0.00 0.47 -1.33 0.00 0.00 177.39 179.07 2o5a n ASP 35 N 0.71 0.00 -3.85 -1.43 10.43 -1.25 -5.12 116.55 116.04 2o5a n ASP 35 Ca 0.26 0.00 -0.20 0.00 2.57 0.00 0.00 54.79 57.42 2o5a n ASP 35 Cb 0.49 0.00 -0.17 0.00 1.84 0.00 0.00 41.12 43.29 2o5a n ASP 35 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2o5a s PHE 36 N 0.00 0.64 -0.15 1.24 0.08 -1.13 -4.01 117.98 114.66 2o5a s PHE 36 Ca 0.00 -0.15 -0.04 0.00 0.12 0.00 0.00 56.93 56.85 2o5a s PHE 36 Cb 0.00 -0.64 -0.03 0.00 -0.57 0.00 0.00 43.02 41.78 2o5a s PHE 36 CO 0.00 -0.21 -0.00 -0.06 -0.10 0.00 0.00 175.22 174.85 2o5a s PHE 37 N 1.16 3.11 -0.08 0.36 0.40 -0.40 -2.45 117.98 120.08 2o5a s PHE 37 Ca -0.07 -0.09 0.04 0.00 -0.60 0.00 0.00 56.93 56.21 2o5a s PHE 37 Cb -0.14 -1.95 -0.00 0.00 0.51 0.00 0.00 43.02 41.44 2o5a s PHE 37 CO -0.01 0.13 -0.23 -1.17 0.70 0.00 0.00 175.22 174.64 2o5a s LEU 38 N 0.07 2.03 0.08 -0.37 2.96 -0.15 -1.02 118.68 122.28 2o5a s LEU 38 Ca 0.02 -0.51 0.09 0.00 -0.22 0.00 0.00 54.13 53.51 2o5a s LEU 38 Cb -0.13 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.21 2o5a s LEU 38 CO 0.02 0.17 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.35 2o5a s ILE 39 N 0.23 1.98 0.11 6.68 1.01 -0.04 0.23 121.20 131.40 2o5a s ILE 39 Ca -0.14 -1.48 -0.25 0.00 0.00 0.00 0.00 60.65 58.78 2o5a s ILE 39 Cb -0.16 -1.73 0.08 0.00 0.01 0.00 0.00 42.46 40.66 2o5a s ILE 39 CO 0.07 0.17 1.11 0.00 0.00 0.00 0.00 174.94 176.28 2o5a s HIS 41 N -2.40 0.16 0.30 0.00 -3.43 -0.95 -1.18 115.29 107.79 2o5a s HIS 41 Ca 0.20 -0.53 0.10 0.00 -0.80 0.00 0.00 55.06 54.03 2o5a s HIS 41 Cb -0.01 0.06 -0.05 0.00 -1.43 0.00 0.00 32.58 31.16 2o5a s HIS 41 CO 0.02 -0.70 -0.03 0.20 -2.00 0.00 0.00 174.74 172.22 2o5a s GLY 42 N -2.90 1.86 0.00 -1.38 0.00 0.12 -1.64 107.32 103.38 2o5a s GLY 42 Ca 0.11 -1.81 0.26 0.00 0.00 0.00 0.00 44.72 43.27 2o5a s GLY 42 CO -0.05 -1.84 1.49 0.70 0.00 0.00 0.00 173.10 173.40 2o5a n ASN 43 N -0.87 1.91 -3.56 1.64 3.02 -1.26 0.35 115.26 116.48 2o5a n ASN 43 Ca -0.05 -1.53 -0.11 0.00 -0.03 0.00 0.00 54.58 52.86 2o5a n ASN 43 Cb 0.60 0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.83 2o5a n ASN 43 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2o5a s SER 44 N -2.16 -0.39 0.52 6.41 1.04 -1.26 -4.81 113.70 113.05 2o5a s SER 44 Ca 0.30 -0.21 0.27 0.00 0.48 0.00 0.00 55.95 56.78 2o5a s SER 44 Cb 0.20 0.56 1.44 0.00 0.10 0.00 0.00 66.02 68.32 2o5a s SER 44 CO 0.39 -0.96 2.07 -0.33 0.98 0.00 0.00 173.24 175.40 2o5a h GLU 45 N 2.16 0.00 -0.07 4.02 5.08 -1.92 -0.42 114.58 123.42 2o5a h GLU 45 Ca -0.32 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.82 2o5a h GLU 45 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2o5a h GLU 45 CO 0.40 0.12 -0.83 -0.22 -1.00 0.00 0.00 179.01 177.48 2o5a h LYS 46 N 0.00 0.56 -0.08 2.33 3.64 -1.96 -2.57 116.57 118.49 2o5a h LYS 46 Ca -0.00 -0.50 -0.20 0.00 -1.27 0.00 0.00 60.65 58.68 2o5a h LYS 46 Cb 0.32 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2o5a h LYS 46 CO 0.02 1.13 -0.76 0.37 -2.27 0.00 0.00 179.45 177.94 2o5a h GLN 47 N 0.36 0.48 -0.67 1.90 4.15 -1.74 -1.96 115.11 117.62 2o5a h GLN 47 Ca -0.06 -0.40 -0.05 0.00 0.77 0.00 0.00 58.65 58.91 2o5a h GLN 47 Cb 1.45 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 29.20 2o5a h GLN 47 CO 0.15 1.04 0.22 0.28 -1.93 0.00 0.00 178.83 178.59 2o5a h VAL 48 N 0.32 1.25 -0.03 2.39 2.07 -1.11 -1.91 116.25 119.23 2o5a h VAL 48 Ca -0.04 -0.85 -0.14 0.00 0.82 0.00 0.00 66.70 66.49 2o5a h VAL 48 Cb 1.35 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2o5a h VAL 48 CO 0.14 0.33 -0.61 1.56 0.02 0.00 0.00 177.57 179.00 2o5a h GLN 49 N 0.97 0.12 -0.59 1.57 4.20 -1.43 -1.99 115.11 117.96 2o5a h GLN 49 Ca 0.22 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 2o5a h GLN 49 Cb 0.28 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 2o5a h GLN 49 CO -0.01 0.70 0.20 0.00 -0.67 0.00 0.00 178.83 179.05 2o5a h ALA 50 N 1.28 0.78 0.14 3.87 0.00 -0.97 -0.01 119.26 124.35 2o5a h ALA 50 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2o5a h ALA 50 Cb 1.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2o5a h ALA 50 CO 0.09 0.43 -0.07 0.82 0.00 0.00 0.00 179.25 180.51 2o5a h ILE 51 N 0.83 0.98 -0.81 0.00 2.04 -1.22 -1.31 117.51 118.02 2o5a h ILE 51 Ca 0.19 -0.57 0.09 0.00 1.00 0.00 0.00 64.86 65.57 2o5a h ILE 51 Cb 0.26 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 2o5a h ILE 51 CO -0.01 0.14 0.53 0.00 0.00 0.00 0.00 178.15 178.80 2o5a h ALA 52 N 0.34 1.71 -0.21 1.87 0.00 -1.25 -1.91 119.26 119.81 2o5a h ALA 52 Ca -0.02 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2o5a h ALA 52 Cb 0.37 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2o5a h ALA 52 CO 0.03 0.13 -0.64 1.25 0.00 0.00 0.00 179.25 180.03 2o5a h HIS 53 N 0.78 1.04 -0.26 0.00 6.17 -0.84 -1.85 115.15 120.20 2o5a h HIS 53 Ca 0.37 -0.42 -0.02 0.00 0.71 0.00 0.00 60.37 61.00 2o5a h HIS 53 Cb 0.39 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 30.13 2o5a h HIS 53 CO -0.00 1.24 0.05 1.49 0.71 0.00 0.00 177.93 181.42 2o5a h GLU 54 N 0.55 0.37 -0.29 5.26 4.57 -0.67 0.70 114.58 125.08 2o5a h GLU 54 Ca -0.02 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 57.96 2o5a h GLU 54 Cb 1.26 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2o5a h GLU 54 CO 0.14 0.36 -0.39 1.25 -1.18 0.00 0.00 179.01 179.19 2o5a h LEU 55 N 0.37 0.84 -0.12 1.64 6.46 -1.25 0.33 115.31 123.58 2o5a h LEU 55 Ca 0.09 -0.50 -0.01 0.00 -0.12 0.00 0.00 57.88 57.33 2o5a h LEU 55 Cb 0.17 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 39.85 2o5a h LEU 55 CO -0.00 1.17 0.02 0.50 -0.62 0.00 0.00 178.44 179.51 2o5a h LYS 56 N 0.52 0.19 -0.27 1.25 3.64 -0.40 0.39 116.57 121.90 2o5a h LYS 56 Ca 0.03 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2o5a h LYS 56 Cb 0.98 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 2o5a h LYS 56 CO 0.09 0.39 0.08 -0.22 -2.27 0.00 0.00 179.45 177.52 2o5a h LYS 57 N -0.03 0.19 -0.29 1.90 3.64 0.42 -1.73 116.57 120.67 2o5a h LYS 57 Ca 0.04 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 2o5a h LYS 57 Cb 0.29 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 2o5a h LYS 57 CO 0.00 0.13 -0.15 0.28 -2.27 0.00 0.00 179.45 177.44 2o5a h VAL 58 N 0.20 1.24 -0.16 2.00 2.07 -0.85 -2.73 116.25 118.02 2o5a h VAL 58 Ca 0.12 -1.07 -0.09 0.00 0.82 0.00 0.00 66.70 66.48 2o5a h VAL 58 Cb 0.10 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2o5a h VAL 58 CO -0.14 0.35 -0.28 0.00 0.02 0.00 0.00 177.57 177.52 2o5a h ALA 59 N 1.38 1.23 0.00 1.67 0.00 -0.36 -2.47 119.26 120.70 2o5a h ALA 59 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2o5a h ALA 59 Cb 0.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2o5a h ALA 59 CO 0.03 0.51 -0.20 1.96 0.00 0.00 0.00 179.25 181.55 2o5a h GLN 60 N 0.27 0.00 0.03 0.00 4.20 -1.10 0.30 115.11 118.81 2o5a h GLN 60 Ca 0.04 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.68 2o5a h GLN 60 Cb 0.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2o5a h GLN 60 CO 0.05 0.00 -0.31 0.93 -0.67 0.00 0.00 178.83 178.82 2o5a h GLU 61 N 0.00 0.06 0.00 1.46 5.08 -1.19 -3.27 114.58 116.73 2o5a h GLU 61 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2o5a h GLU 61 Cb 0.75 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2o5a h GLU 61 CO 0.00 1.05 0.00 0.94 -1.00 0.00 0.00 179.01 180.00 2o5a n GLN 62 N -4.49 0.17 -2.95 2.33 -0.06 -0.96 -4.90 117.38 106.52 2o5a n GLN 62 Ca -0.13 0.11 -0.10 0.00 -2.00 0.00 0.00 57.00 54.88 2o5a n GLN 62 Cb 0.57 -1.50 0.03 0.00 -4.06 0.00 0.00 30.24 25.29 2o5a n GLN 62 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2o5a n GLY 63 N 0.60 0.34 3.71 1.69 0.00 -0.96 -5.03 105.19 105.54 2o5a n GLY 63 Ca 0.08 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2o5a n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o5a s ILE 64 N -3.13 4.40 -0.21 -0.61 1.01 0.10 -5.01 121.20 117.74 2o5a s ILE 64 Ca 0.24 -0.37 -0.17 0.00 0.00 0.00 0.00 60.65 60.35 2o5a s ILE 64 Cb -0.11 -2.92 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 2o5a s ILE 64 CO 0.30 0.48 0.46 -0.70 0.00 0.00 0.00 174.94 175.48 2o5a s GLU 65 N -1.28 4.15 -0.39 2.79 2.12 -1.26 -4.45 118.70 120.38 2o5a s GLU 65 Ca 0.17 0.28 -0.26 0.00 0.36 0.00 0.00 54.97 55.53 2o5a s GLU 65 Cb -0.12 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.72 2o5a s GLU 65 CO 0.07 -0.14 0.93 0.42 -0.54 0.00 0.00 175.26 176.01 2o5a s ILE 66 N 1.62 4.55 0.08 -3.70 1.01 -1.26 -4.54 121.20 118.97 2o5a s ILE 66 Ca 0.21 1.11 -0.12 0.00 0.00 0.00 0.00 60.65 61.85 2o5a s ILE 66 Cb -0.15 -4.36 -0.22 0.00 0.01 0.00 0.00 42.46 37.73 2o5a s ILE 66 CO 0.09 -0.61 1.21 0.11 0.00 0.00 0.00 174.94 175.74 2o5a h LYS 67 N 8.61 0.65 -3.79 2.79 1.57 -0.67 -3.47 116.57 122.27 2o5a h LYS 67 Ca -0.23 -0.70 -0.12 0.00 -1.87 0.00 0.00 60.65 57.72 2o5a h LYS 67 Cb 1.08 0.20 -0.17 0.00 0.08 0.00 0.00 32.23 33.42 2o5a h LYS 67 CO 0.99 1.29 -0.50 1.03 -0.57 0.00 0.00 179.45 181.70 2o5a s ARG 68 N -3.31 0.63 -0.30 3.15 0.52 -1.15 -4.93 118.95 113.56 2o5a s ARG 68 Ca -0.09 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 2o5a s ARG 68 Cb 0.07 0.25 0.19 0.00 0.52 0.00 0.00 34.95 35.98 2o5a s ARG 68 CO 0.91 -0.16 0.62 -1.17 0.02 0.00 0.00 175.30 175.52 2o5a s LEU 69 N -2.22 -1.41 0.03 2.53 0.20 -1.20 0.37 118.68 116.98 2o5a s LEU 69 Ca -0.04 0.66 0.03 0.00 0.69 0.00 0.00 54.13 55.48 2o5a s LEU 69 Cb -0.00 2.09 -0.02 0.00 -0.43 0.00 0.00 46.19 47.83 2o5a s LEU 69 CO -0.05 -0.26 -0.09 -1.61 -0.29 0.00 0.00 176.35 174.04 2o5a s GLU 70 N 2.86 0.65 -0.01 1.98 2.02 -0.30 -4.82 118.70 121.08 2o5a s GLU 70 Ca 0.17 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.54 2o5a s GLU 70 Cb -0.13 -0.56 0.00 0.00 0.10 0.00 0.00 34.13 33.54 2o5a s GLU 70 CO -0.22 0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.60 2o5a n GLY 71 N 1.98 0.40 0.06 -1.39 0.00 -1.26 -0.77 105.19 104.21 2o5a n GLY 71 Ca -0.19 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2o5a n GLY 71 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2o5a h TYR 72 N 0.00 0.04 -0.01 1.61 3.20 -1.87 -1.41 116.97 118.53 2o5a h TYR 72 Ca -0.00 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 2o5a h TYR 72 Cb 0.01 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 2o5a h TYR 72 CO 0.00 0.39 -0.20 0.93 -1.64 0.00 0.00 178.16 177.64 2o5a h GLU 73 N -0.31 -0.31 -0.10 1.82 5.08 -1.99 -2.40 114.58 116.37 2o5a h GLU 73 Ca 0.01 0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2o5a h GLU 73 Cb 0.37 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2o5a h GLU 73 CO 0.00 -0.20 -0.19 0.37 -1.00 0.00 0.00 179.01 177.99 2o5a h GLN 74 N -0.32 0.16 -6.21 2.33 5.75 -1.98 -3.47 115.11 111.37 2o5a h GLN 74 Ca 0.06 -0.04 -0.46 0.00 -0.15 0.00 0.00 58.65 58.06 2o5a h GLN 74 Cb 0.40 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.92 2o5a h GLN 74 CO -0.20 0.35 -0.74 0.00 -2.65 0.00 0.00 178.83 175.60 2o5a n ALA 75 N -2.49 -1.27 -0.06 3.38 0.00 -0.53 -4.85 120.51 114.69 2o5a n ALA 75 Ca -0.01 0.23 -0.07 0.00 0.00 0.00 0.00 53.44 53.59 2o5a n ALA 75 Cb 0.30 -4.63 -0.07 0.00 0.00 0.00 0.00 19.45 15.04 2o5a n ALA 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2o5a n ARG 76 N -4.72 1.32 -3.25 0.00 5.12 -1.26 -4.56 116.66 109.32 2o5a n ARG 76 Ca 0.04 0.04 -0.04 0.00 -1.93 0.00 0.00 57.85 55.95 2o5a n ARG 76 Cb 0.53 -1.25 -0.03 0.00 -1.16 0.00 0.00 32.46 30.54 2o5a n ARG 76 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 2o5a s TRP 77 N -2.25 -1.32 -0.16 -1.55 -0.11 -1.26 -1.78 118.94 110.52 2o5a s TRP 77 Ca -0.11 0.09 -0.15 0.00 1.22 0.00 0.00 56.10 57.15 2o5a s TRP 77 Cb 0.04 0.09 -0.04 0.00 -1.50 0.00 0.00 33.47 32.05 2o5a s TRP 77 CO 0.35 -1.10 0.36 0.08 -4.62 0.00 0.00 176.95 172.02 2o5a s VAL 78 N 1.93 5.25 -0.18 5.86 1.01 -0.46 -4.34 120.40 129.48 2o5a s VAL 78 Ca 0.15 0.68 -0.02 0.00 0.00 0.00 0.00 61.98 62.79 2o5a s VAL 78 Cb -0.08 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 2o5a s VAL 78 CO -0.11 0.34 -0.08 -0.22 0.00 0.00 0.00 175.10 175.03 2o5a s LEU 79 N 0.71 2.81 -0.31 3.92 0.20 0.05 -1.09 118.68 124.97 2o5a s LEU 79 Ca 0.19 -0.37 0.02 0.00 0.69 0.00 0.00 54.13 54.67 2o5a s LEU 79 Cb -0.14 -1.68 0.08 0.00 -0.43 0.00 0.00 46.19 44.02 2o5a s LEU 79 CO 0.06 0.06 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.54 2o5a s ILE 80 N 1.01 2.42 -0.48 6.68 1.09 -0.57 -1.14 121.20 130.21 2o5a s ILE 80 Ca -0.00 -1.92 -0.25 0.00 -1.10 0.00 0.00 60.65 57.37 2o5a s ILE 80 Cb -0.15 -2.58 0.03 0.00 -1.06 0.00 0.00 42.46 38.70 2o5a s ILE 80 CO -0.01 -0.32 0.94 -0.62 -0.10 0.00 0.00 174.94 174.83 2o5a s ASP 81 N 1.11 6.48 -0.00 3.58 -1.08 0.16 -1.67 116.67 125.24 2o5a s ASP 81 Ca 0.01 0.05 0.20 0.00 -0.52 0.00 0.00 52.55 52.29 2o5a s ASP 81 Cb -0.20 -2.45 0.56 0.00 -1.46 0.00 0.00 42.92 39.37 2o5a s ASP 81 CO -0.06 -1.09 1.47 0.18 0.52 0.00 0.00 175.17 176.20 2o5a n LEU 82 N 7.24 3.71 0.00 -1.34 4.77 -0.13 0.11 117.00 131.37 2o5a n LEU 82 Ca 0.06 -2.00 0.00 0.00 -0.03 0.00 0.00 56.01 54.03 2o5a n LEU 82 Cb 0.48 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2o5a n LEU 82 CO 0.64 0.92 0.00 0.61 -1.33 0.00 0.00 177.39 178.24 2o5a n GLY 83 N 1.36 0.91 0.31 -0.72 0.00 -1.26 -4.34 105.19 101.45 2o5a n GLY 83 Ca 0.21 -0.87 0.20 0.00 0.00 0.00 0.00 46.02 45.56 2o5a n GLY 83 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2o5a h ASP 84 N 0.00 0.00 -3.98 1.61 3.32 -1.96 -3.41 116.42 112.00 2o5a h ASP 84 Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 2o5a h ASP 84 Cb 0.00 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 39.24 2o5a h ASP 84 CO 0.00 0.01 -0.83 -0.69 -1.72 0.00 0.00 179.24 176.01 2o5a s VAL 85 N -4.02 1.34 -0.14 -1.35 1.01 -1.26 -2.82 120.40 113.15 2o5a s VAL 85 Ca -0.03 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2o5a s VAL 85 Cb 0.12 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.37 2o5a s VAL 85 CO 0.47 0.39 -0.14 -0.69 0.00 0.00 0.00 175.10 175.12 2o5a s VAL 86 N -0.04 1.56 -0.15 2.92 1.01 -1.03 -0.95 120.40 123.72 2o5a s VAL 86 Ca -0.02 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 2o5a s VAL 86 Cb -0.10 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2o5a s VAL 86 CO 0.01 0.46 0.13 -0.69 0.00 0.00 0.00 175.10 175.01 2o5a s VAL 87 N 1.38 5.41 -0.27 2.92 1.01 -0.67 -0.98 120.40 129.20 2o5a s VAL 87 Ca 0.02 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.20 2o5a s VAL 87 Cb -0.13 -3.39 0.06 0.00 0.00 0.00 0.00 36.38 32.91 2o5a s VAL 87 CO -0.09 0.56 -0.08 -1.00 0.00 0.00 0.00 175.10 174.49 2o5a s HIS 88 N -0.55 3.28 -0.44 5.22 3.76 0.14 -1.51 115.29 125.19 2o5a s HIS 88 Ca 0.12 -2.22 -0.11 0.00 -0.15 0.00 0.00 55.06 52.71 2o5a s HIS 88 Cb -0.12 -1.99 0.08 0.00 1.11 0.00 0.00 32.58 31.66 2o5a s HIS 88 CO 0.02 -0.86 0.30 0.08 -0.85 0.00 0.00 174.74 173.43 2o5a s VAL 89 N 1.14 4.48 0.36 -0.90 1.01 -0.25 -2.26 120.40 123.98 2o5a s VAL 89 Ca -0.08 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.59 2o5a s VAL 89 Cb -0.20 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 2o5a s VAL 89 CO -0.04 -0.54 0.54 -0.36 0.00 0.00 0.00 175.10 174.69 2o5a s PHE 90 N 1.48 3.30 -0.09 5.22 0.40 -0.33 -1.35 117.98 126.61 2o5a s PHE 90 Ca 0.03 0.11 -0.15 0.00 -0.60 0.00 0.00 56.93 56.32 2o5a s PHE 90 Cb -0.24 -2.00 -0.05 0.00 0.51 0.00 0.00 43.02 41.24 2o5a s PHE 90 CO 0.03 -0.02 0.37 -1.58 0.70 0.00 0.00 175.22 174.72 2o5a s HIS 91 N -2.30 3.58 0.63 0.36 5.65 -0.73 0.14 115.29 122.62 2o5a s HIS 91 Ca 0.43 0.81 0.19 0.00 0.25 0.00 0.00 55.06 56.74 2o5a s HIS 91 Cb -0.10 -2.34 0.90 0.00 -1.18 0.00 0.00 32.58 29.86 2o5a s HIS 91 CO 0.34 0.41 1.46 1.57 -0.65 0.00 0.00 174.74 177.87 2o5a h LYS 92 N 5.84 0.00 -0.33 2.88 2.10 -0.42 0.59 116.57 127.23 2o5a h LYS 92 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2o5a h LYS 92 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2o5a h LYS 92 CO 0.69 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.89 2o5a n ASP 93 N -3.01 3.21 -4.71 7.07 8.00 -1.26 -4.95 116.55 120.90 2o5a n ASP 93 Ca 0.07 -1.96 -0.42 0.00 0.71 0.00 0.00 54.79 53.19 2o5a n ASP 93 Cb 0.94 -0.21 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 2o5a n ASP 93 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2o5a s GLU 94 N -1.59 4.41 0.10 -1.24 2.56 0.21 -4.95 118.70 118.20 2o5a s GLU 94 Ca 0.37 1.78 -0.15 0.00 0.00 0.00 0.00 54.97 56.98 2o5a s GLU 94 Cb 0.22 -3.38 -0.09 0.00 2.00 0.00 0.00 34.13 32.87 2o5a s GLU 94 CO 0.31 -0.31 1.40 0.00 -0.56 0.00 0.00 175.26 176.11 2o5a h ARG 95 N 6.94 0.70 0.00 4.30 3.08 -1.92 -2.90 114.38 124.58 2o5a h ARG 95 Ca -0.40 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.26 2o5a h ARG 95 Cb 1.21 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2o5a h ARG 95 CO 0.83 1.01 0.03 0.00 -1.07 0.00 0.00 179.97 180.76 2o5a h ALA 96 N 0.68 1.02 0.00 0.04 0.00 -1.96 0.18 119.26 119.23 2o5a h ALA 96 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2o5a h ALA 96 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2o5a h ALA 96 CO 0.08 -0.02 0.00 -0.92 0.00 0.00 0.00 179.25 178.39 2o5a h TYR 97 N 0.00 0.00 -0.01 0.00 3.20 -1.89 -2.15 116.97 116.12 2o5a h TYR 97 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2o5a h TYR 97 Cb 0.05 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.32 2o5a h TYR 97 CO 0.00 0.00 -0.25 0.66 -1.64 0.00 0.00 178.16 176.93 2o5a n TYR 98 N -2.91 0.00 -0.08 -3.82 4.02 0.62 -4.11 117.16 110.88 2o5a n TYR 98 Ca 0.03 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.96 2o5a n TYR 98 Cb 0.44 0.00 0.10 0.00 -0.02 0.00 0.00 39.34 39.87 2o5a n TYR 98 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2o5a n ASN 99 N 0.11 2.56 0.00 7.72 5.03 -1.06 -4.51 115.26 125.11 2o5a n ASN 99 Ca 0.07 -1.93 0.05 0.00 0.87 0.00 0.00 54.58 53.64 2o5a n ASN 99 Cb 0.35 -0.15 0.29 0.00 -1.02 0.00 0.00 39.78 39.25 2o5a n ASN 99 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2o5a n LEU 100 N 0.25 0.00 -0.03 3.41 7.94 -0.82 -1.99 117.00 125.76 2o5a n LEU 100 Ca 0.08 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.87 2o5a n LEU 100 Cb 0.36 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.21 2o5a n LEU 100 CO 0.06 0.00 0.35 -0.08 -1.11 0.00 0.00 177.39 176.61 2o5a h GLU 101 N 0.00 -0.04 -0.40 1.96 4.22 -1.88 -3.32 114.58 115.12 2o5a h GLU 101 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 59.36 59.51 2o5a h GLU 101 Cb 0.00 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.17 2o5a h GLU 101 CO 0.00 0.61 -0.44 0.87 -2.18 0.00 0.00 179.01 177.87 2o5a h LYS 102 N -0.92 -0.33 -6.46 1.92 1.57 -1.76 -3.35 116.57 107.24 2o5a h LYS 102 Ca -0.00 0.02 -0.56 0.00 -1.87 0.00 0.00 60.65 58.24 2o5a h LYS 102 Cb 0.68 0.07 0.04 0.00 0.08 0.00 0.00 32.23 33.10 2o5a h LYS 102 CO 0.01 -0.22 1.03 1.28 -0.57 0.00 0.00 179.45 180.98 2o5a n LEU 103 N -5.41 3.69 0.00 2.94 4.77 -1.25 -5.21 117.00 116.54 2o5a n LEU 103 Ca -0.01 1.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 2o5a n LEU 103 Cb 0.35 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 39.96 2o5a n LEU 103 CO 0.04 0.02 0.00 0.79 -1.33 0.00 0.00 177.39 176.90 2o5a n TRP 104 N 5.31 -0.20 -0.96 -1.77 8.01 -1.26 -4.89 117.44 121.69 2o5a n TRP 104 Ca 0.19 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.38 2o5a n TRP 104 Cb 0.34 0.10 0.00 0.00 -2.01 0.00 0.00 31.31 29.74 2o5a n TRP 104 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 2o5a n PRO 108 N 0.00 0.00 -2.48 -0.99 -0.04 -1.26 -5.10 135.00 125.13 2o5a n PRO 108 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2o5a n PRO 108 Cb 0.00 -1.00 -0.02 0.00 -0.04 0.00 0.00 33.50 32.43 2o5a n PRO 108 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2o5a s THR 109 N -2.26 4.35 0.39 0.52 -4.23 -1.26 -0.78 115.64 112.36 2o5a s THR 109 Ca 0.00 1.65 -0.25 0.00 -1.18 0.00 0.00 61.69 61.91 2o5a s THR 109 Cb 0.00 -4.06 -0.09 0.00 1.34 0.00 0.00 72.50 69.69 2o5a s THR 109 CO 0.00 -0.08 1.09 -0.69 -0.54 0.00 0.00 174.62 174.41 2o5a s VAL 110 N 2.84 3.50 0.36 2.29 1.01 -0.24 -4.92 120.40 125.24 2o5a s VAL 110 Ca 0.54 1.22 -0.14 0.00 0.00 0.00 0.00 61.98 63.59 2o5a s VAL 110 Cb -0.22 -3.66 -0.08 0.00 0.00 0.00 0.00 36.38 32.41 2o5a s VAL 110 CO 0.17 0.07 0.77 -0.70 0.00 0.00 0.00 175.10 175.41 2o5a s GLU 111 N -2.33 3.96 0.00 2.72 2.56 -1.26 -4.34 118.70 120.00 2o5a s GLU 111 Ca 0.56 0.67 0.00 0.00 0.00 0.00 0.00 54.97 56.20 2o5a s GLU 111 Cb -0.26 -2.38 0.00 0.00 2.00 0.00 0.00 34.13 33.49 2o5a s GLU 111 CO 0.32 0.07 0.00 1.28 -0.56 0.00 0.00 175.26 176.37