#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mgq s ASN 10 N 0.00 7.08 0.59 4.52 2.47 -1.26 -4.97 114.94 123.37 1mgq s ASN 10 Ca 0.00 1.30 0.32 0.00 0.42 0.00 0.00 52.86 54.90 1mgq s ASN 10 Cb 0.00 -2.43 1.23 0.00 -1.45 0.00 0.00 41.25 38.60 1mgq s ASN 10 CO 0.00 -0.03 1.51 -0.37 -3.72 0.00 0.00 177.10 174.50 1mgq h VAL 11 N 4.39 0.11 -0.21 -5.21 -1.51 -2.06 0.31 116.25 112.06 1mgq h VAL 11 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 1mgq h VAL 11 Cb 1.20 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.52 1mgq h VAL 11 CO 0.72 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.06 1mgq n GLN 12 N -3.54 2.92 -3.72 5.19 10.64 -1.26 -4.82 117.38 122.79 1mgq n GLN 12 Ca 0.24 -1.85 -0.28 0.00 -1.83 0.00 0.00 57.00 53.28 1mgq n GLN 12 Cb 1.42 -1.17 -0.12 0.00 -0.86 0.00 0.00 30.24 29.52 1mgq n GLN 12 CO 0.00 0.00 0.00 1.03 -1.83 0.00 0.00 177.06 176.26 1mgq s ARG 13 N -1.02 1.82 0.50 2.61 0.52 0.11 -4.94 118.95 118.55 1mgq s ARG 13 Ca 0.15 -2.76 0.18 0.00 -0.52 0.00 0.00 55.73 52.78 1mgq s ARG 13 Cb 0.08 -2.67 1.26 0.00 0.52 0.00 0.00 34.95 34.14 1mgq s ARG 13 CO 0.10 -1.29 2.10 -1.35 0.02 0.00 0.00 175.30 174.87 1mgq h PRO 14 N 5.70 0.00 0.00 3.54 0.11 -1.88 -1.16 132.00 138.31 1mgq h PRO 14 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1mgq h PRO 14 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1mgq h PRO 14 CO 0.58 0.08 0.00 -0.07 -0.21 0.00 0.00 178.00 178.38 1mgq h LEU 15 N 0.00 0.00 -1.99 2.35 3.38 -1.93 -1.59 115.31 115.53 1mgq h LEU 15 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1mgq h LEU 15 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1mgq h LEU 15 CO 0.01 0.00 -0.06 0.44 0.09 0.00 0.00 178.44 178.93 1mgq h ASP 16 N 0.00 0.00 0.29 -0.43 3.32 -1.57 -1.19 116.42 116.84 1mgq h ASP 16 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1mgq h ASP 16 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1mgq h ASP 16 CO 0.00 0.06 -0.19 0.00 -1.72 0.00 0.00 179.24 177.39 1mgq h ALA 17 N 1.94 1.48 -0.02 3.45 0.00 -1.48 -0.30 119.26 124.34 1mgq h ALA 17 Ca -0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1mgq h ALA 17 Cb 0.33 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1mgq h ALA 17 CO 0.01 0.23 -0.63 -0.07 0.00 0.00 0.00 179.25 178.79 1mgq h LEU 18 N 0.00 0.59 -0.78 0.00 3.38 -1.41 -3.04 115.31 114.06 1mgq h LEU 18 Ca -0.00 -0.73 0.09 0.00 0.09 0.00 0.00 57.88 57.33 1mgq h LEU 18 Cb 0.38 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1mgq h LEU 18 CO 0.02 1.24 0.43 1.23 0.09 0.00 0.00 178.44 181.46 1mgq h GLY 19 N -0.00 1.20 2.00 0.83 0.00 -1.12 0.89 103.07 106.87 1mgq h GLY 19 Ca -0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1mgq h GLY 19 CO 0.12 0.10 -0.05 3.43 0.00 0.00 0.00 176.54 180.15 1mgq h ASN 20 N 0.72 0.00 -0.06 0.19 2.35 -1.09 -2.93 115.58 114.76 1mgq h ASN 20 Ca 0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 1mgq h ASN 20 Cb 0.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1mgq h ASN 20 CO -0.26 0.05 0.00 -1.20 -1.65 0.00 0.00 177.43 174.38 1mgq n SER 21 N -3.50 2.71 -4.73 5.81 7.64 0.28 -4.96 113.62 116.87 1mgq n SER 21 Ca -0.02 -1.89 -0.42 0.00 1.01 0.00 0.00 58.87 57.54 1mgq n SER 21 Cb 0.17 -0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.33 1mgq n SER 21 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1mgq n LEU 22 N 1.10 4.00 -0.99 -3.43 4.77 -1.03 -1.16 117.00 120.27 1mgq n LEU 22 Ca 0.16 1.19 -0.13 0.00 -0.03 0.00 0.00 56.01 57.20 1mgq n LEU 22 Cb 0.54 -1.54 -0.06 0.00 -2.33 0.00 0.00 43.42 40.04 1mgq n LEU 22 CO 0.15 -0.17 -0.12 0.59 -1.33 0.00 0.00 177.39 176.51 1mgq n ASN 23 N 1.22 -4.72 -4.37 -1.43 5.03 0.16 -4.97 115.26 106.17 1mgq n ASN 23 Ca 0.06 0.32 -0.23 0.00 0.87 0.00 0.00 54.58 55.59 1mgq n ASN 23 Cb 0.36 -3.35 -0.11 0.00 -1.02 0.00 0.00 39.78 35.66 1mgq n ASN 23 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1mgq s SER 24 N -2.78 3.00 0.31 6.41 0.01 -0.30 -4.87 113.70 115.47 1mgq s SER 24 Ca 0.00 -0.88 -0.29 0.00 1.31 0.00 0.00 55.95 56.09 1mgq s SER 24 Cb 0.00 -0.20 -0.10 0.00 0.21 0.00 0.00 66.02 65.93 1mgq s SER 24 CO 0.00 0.02 1.36 -2.84 0.41 0.00 0.00 173.24 172.19 1mgq s PRO 25 N -2.85 4.31 0.16 12.44 0.02 -1.26 -1.65 135.00 146.17 1mgq s PRO 25 Ca 0.19 2.27 0.02 0.00 0.02 0.00 0.00 61.00 63.50 1mgq s PRO 25 Cb -0.06 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.34 1mgq s PRO 25 CO 0.08 -0.29 -0.01 0.14 -0.33 0.00 0.00 177.00 176.60 1mgq s VAL 26 N -0.80 0.65 -0.13 3.83 -7.23 0.38 -4.66 120.40 112.44 1mgq s VAL 26 Ca 0.52 -1.97 0.01 0.00 -1.81 0.00 0.00 61.98 58.73 1mgq s VAL 26 Cb -0.41 -2.06 -0.00 0.00 0.56 0.00 0.00 36.38 34.47 1mgq s VAL 26 CO 0.51 -0.53 -0.17 -0.63 -0.31 0.00 0.00 175.10 173.97 1mgq s ILE 27 N -3.67 2.59 -0.21 -0.62 1.01 0.44 -2.32 121.20 118.43 1mgq s ILE 27 Ca 0.22 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 1mgq s ILE 27 Cb 0.06 -2.07 0.00 0.00 0.01 0.00 0.00 42.46 40.47 1mgq s ILE 27 CO 0.03 0.53 -0.10 -0.63 0.00 0.00 0.00 174.94 174.76 1mgq s ILE 28 N 0.55 2.85 -0.21 2.92 -1.09 0.45 0.08 121.20 126.75 1mgq s ILE 28 Ca -0.11 -0.68 -0.10 0.00 -2.23 0.00 0.00 60.65 57.53 1mgq s ILE 28 Cb -0.16 -2.27 -0.05 0.00 -1.58 0.00 0.00 42.46 38.40 1mgq s ILE 28 CO 0.04 0.46 0.14 -0.75 -1.23 0.00 0.00 174.94 173.60 1mgq s LYS 29 N 1.40 4.16 0.28 2.79 2.47 -0.20 -1.01 119.74 129.62 1mgq s LYS 29 Ca 0.05 -0.23 0.08 0.00 -1.56 0.00 0.00 55.97 54.32 1mgq s LYS 29 Cb -0.14 -3.44 -0.04 0.00 -1.46 0.00 0.00 37.83 32.75 1mgq s LYS 29 CO -0.07 0.25 0.10 -0.51 0.16 0.00 0.00 175.35 175.27 1mgq s LEU 30 N 0.52 3.41 0.56 5.43 1.43 0.60 -0.19 118.68 130.44 1mgq s LEU 30 Ca 0.08 -0.55 -0.21 0.00 -1.03 0.00 0.00 54.13 52.42 1mgq s LEU 30 Cb -0.12 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1mgq s LEU 30 CO -0.01 -0.08 1.32 -0.54 0.23 0.00 0.00 176.35 177.27 1mgq s LYS 31 N -3.77 3.05 0.00 1.70 1.02 0.01 -1.18 119.74 120.57 1mgq s LYS 31 Ca 0.33 2.15 0.00 0.00 0.02 0.00 0.00 55.97 58.47 1mgq s LYS 31 Cb -0.06 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.09 1mgq s LYS 31 CO 0.22 -1.23 0.00 0.41 -0.92 0.00 0.00 175.35 173.83 1mgq n GLY 32 N 0.73 0.98 2.40 -3.33 0.00 -1.26 -4.10 105.19 100.61 1mgq n GLY 32 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1mgq n GLY 32 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mgq n ASP 33 N 0.00 -2.47 -4.76 1.61 8.00 -0.33 -5.01 116.55 113.59 1mgq n ASP 33 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 1mgq n ASP 33 Cb 0.00 -0.74 -0.04 0.00 -0.02 0.00 0.00 41.12 40.32 1mgq n ASP 33 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1mgq s ARG 34 N -0.23 4.55 -0.03 -1.24 3.52 -1.23 -4.84 118.95 119.44 1mgq s ARG 34 Ca 0.00 1.88 0.07 0.00 -0.13 0.00 0.00 55.73 57.55 1mgq s ARG 34 Cb 0.00 -3.13 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 1mgq s ARG 34 CO 0.00 0.10 -0.24 -2.00 -0.81 0.00 0.00 175.30 172.35 1mgq s GLU 35 N -1.58 2.09 0.01 5.12 2.12 -1.11 -0.29 118.70 125.07 1mgq s GLU 35 Ca 0.46 -0.85 0.07 0.00 0.36 0.00 0.00 54.97 55.01 1mgq s GLU 35 Cb -0.33 -1.93 -0.02 0.00 0.26 0.00 0.00 34.13 32.10 1mgq s GLU 35 CO 0.43 0.46 -0.22 -0.06 -0.54 0.00 0.00 175.26 175.33 1mgq s PHE 36 N -0.41 1.99 -0.05 5.30 0.08 -0.18 0.49 117.98 125.20 1mgq s PHE 36 Ca 0.05 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.75 1mgq s PHE 36 Cb -0.11 -1.23 0.01 0.00 -0.57 0.00 0.00 43.02 41.12 1mgq s PHE 36 CO 0.01 0.04 -0.12 1.03 -0.10 0.00 0.00 175.22 176.07 1mgq s ARG 37 N -0.87 1.47 -0.00 0.44 0.52 -0.25 -0.41 118.95 119.85 1mgq s ARG 37 Ca 0.09 -0.41 -0.04 0.00 -0.52 0.00 0.00 55.73 54.85 1mgq s ARG 37 Cb -0.09 -1.27 0.01 0.00 0.52 0.00 0.00 34.95 34.13 1mgq s ARG 37 CO 0.01 0.09 0.17 0.41 0.02 0.00 0.00 175.30 175.99 1mgq n GLY 38 N 3.54 0.61 3.68 -3.53 0.00 -0.98 -0.81 105.19 107.69 1mgq n GLY 38 Ca -0.21 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.58 1mgq n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mgq s VAL 39 N -2.15 5.26 -0.11 1.61 1.01 -0.43 -0.47 120.40 125.12 1mgq s VAL 39 Ca 0.04 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.25 1mgq s VAL 39 Cb -0.00 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1mgq s VAL 39 CO -0.00 0.30 1.28 -0.22 0.00 0.00 0.00 175.10 176.47 1mgq s LEU 40 N 1.09 4.23 -0.13 3.92 2.96 -0.66 -0.47 118.68 129.61 1mgq s LEU 40 Ca 0.15 1.80 0.05 0.00 -0.22 0.00 0.00 54.13 55.91 1mgq s LEU 40 Cb -0.14 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.89 1mgq s LEU 40 CO 0.06 -0.72 -0.05 0.29 -1.32 0.00 0.00 176.35 174.61 1mgq n LYS 41 N 6.16 1.16 -3.59 1.98 4.76 0.53 0.36 118.16 129.52 1mgq n LYS 41 Ca 0.13 0.04 -0.13 0.00 -2.87 0.00 0.00 58.31 55.49 1mgq n LYS 41 Cb 0.45 -1.30 -0.05 0.00 -1.84 0.00 0.00 35.03 32.29 1mgq n LYS 41 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1mgq s SER 42 N -4.97 -0.39 0.17 4.39 0.15 -1.07 -4.83 113.70 107.14 1mgq s SER 42 Ca -0.13 0.05 -0.24 0.00 0.70 0.00 0.00 55.95 56.33 1mgq s SER 42 Cb 0.04 0.49 0.06 0.00 -1.71 0.00 0.00 66.02 64.90 1mgq s SER 42 CO 0.40 -0.75 0.84 0.72 1.20 0.00 0.00 173.24 175.65 1mgq s PHE 43 N -2.78 -0.22 0.34 3.44 -0.12 -1.26 0.02 117.98 117.40 1mgq s PHE 43 Ca -0.03 -0.10 0.05 0.00 -0.05 0.00 0.00 56.93 56.79 1mgq s PHE 43 Cb -0.00 0.64 -0.03 0.00 -0.63 0.00 0.00 43.02 43.00 1mgq s PHE 43 CO -0.04 -0.91 0.20 0.16 -0.05 0.00 0.00 175.22 174.57 1mgq s ASP 44 N -2.86 1.88 0.57 1.98 1.47 -0.65 -4.97 116.67 114.10 1mgq s ASP 44 Ca 0.10 -1.67 0.27 0.00 1.18 0.00 0.00 52.55 52.42 1mgq s ASP 44 Cb -0.03 0.50 1.61 0.00 -0.34 0.00 0.00 42.92 44.66 1mgq s ASP 44 CO 0.01 -0.98 2.12 0.17 0.68 0.00 0.00 175.17 177.18 1mgq h LEU 45 N 2.08 0.00 0.00 2.11 -0.00 -2.01 0.42 115.31 117.91 1mgq h LEU 45 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.58 1mgq h LEU 45 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 1mgq h LEU 45 CO 0.47 0.00 0.00 1.41 -0.00 0.00 0.00 178.44 180.32 1mgq n HIS 46 N -3.97 0.00 -1.25 0.17 8.25 -1.26 -4.90 115.22 112.26 1mgq n HIS 46 Ca 0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.38 1mgq n HIS 46 Cb 0.28 -0.19 -0.04 0.00 1.12 0.00 0.00 29.99 31.16 1mgq n HIS 46 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1mgq n MET 47 N -1.19 -0.81 -2.00 -0.41 2.81 0.15 -4.27 117.12 111.39 1mgq n MET 47 Ca 0.14 0.75 -0.41 0.00 -1.81 0.00 0.00 57.70 56.38 1mgq n MET 47 Cb 0.17 -4.67 -0.01 0.00 -0.71 0.00 0.00 33.22 27.99 1mgq n MET 47 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1mgq s ASN 48 N -2.70 6.59 0.12 7.83 0.01 -1.26 -3.51 114.94 122.03 1mgq s ASN 48 Ca 0.00 2.82 -0.10 0.00 -0.71 0.00 0.00 52.86 54.87 1mgq s ASN 48 Cb 0.00 -2.66 -0.00 0.00 0.41 0.00 0.00 41.25 39.00 1mgq s ASN 48 CO 0.00 -0.68 0.25 -1.48 -1.51 0.00 0.00 177.10 173.69 1mgq s LEU 49 N -1.94 1.13 -0.11 0.60 0.05 -0.70 -1.63 118.68 116.08 1mgq s LEU 49 Ca 0.51 -0.70 0.03 0.00 0.05 0.00 0.00 54.13 54.02 1mgq s LEU 49 Cb -0.42 1.19 -0.01 0.00 -2.05 0.00 0.00 46.19 44.90 1mgq s LEU 49 CO 0.56 -0.81 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.67 1mgq s VAL 50 N -3.89 2.45 0.11 1.48 1.01 0.10 -1.04 120.40 120.62 1mgq s VAL 50 Ca 0.09 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1mgq s VAL 50 Cb 0.04 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1mgq s VAL 50 CO -0.07 0.55 -0.08 -0.76 0.00 0.00 0.00 175.10 174.74 1mgq s LEU 51 N 0.30 3.14 0.12 3.92 1.43 -0.42 -0.34 118.68 126.81 1mgq s LEU 51 Ca -0.15 -0.35 0.06 0.00 -1.03 0.00 0.00 54.13 52.66 1mgq s LEU 51 Cb -0.17 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1mgq s LEU 51 CO 0.07 0.17 -0.04 0.20 0.23 0.00 0.00 176.35 176.98 1mgq s ASN 52 N -2.29 4.71 -1.39 2.29 0.01 0.37 -1.60 114.94 117.05 1mgq s ASN 52 Ca 0.23 -0.31 -0.03 0.00 -0.71 0.00 0.00 52.86 52.03 1mgq s ASN 52 Cb -0.11 -1.01 0.02 0.00 0.41 0.00 0.00 41.25 40.56 1mgq s ASN 52 CO 0.15 0.16 0.63 0.47 -1.51 0.00 0.00 177.10 177.00 1mgq n ASP 53 N 0.46 -1.39 -4.82 -1.22 8.00 0.71 -1.32 116.55 116.97 1mgq n ASP 53 Ca -0.12 -0.90 -0.33 0.00 0.71 0.00 0.00 54.79 54.16 1mgq n ASP 53 Cb 0.53 -3.58 -0.02 0.00 -0.02 0.00 0.00 41.12 38.03 1mgq n ASP 53 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mgq s ALA 54 N -3.72 2.93 -0.02 2.24 0.00 0.10 -4.63 121.76 118.67 1mgq s ALA 54 Ca 0.12 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.41 1mgq s ALA 54 Cb -0.06 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.89 1mgq s ALA 54 CO 0.85 -0.43 -0.04 -1.21 0.00 0.00 0.00 175.76 174.94 1mgq s GLU 55 N -3.93 0.45 -0.07 0.00 2.02 0.01 -1.06 118.70 116.12 1mgq s GLU 55 Ca 0.62 -0.10 -0.09 0.00 0.02 0.00 0.00 54.97 55.42 1mgq s GLU 55 Cb -0.13 -0.49 -0.04 0.00 0.10 0.00 0.00 34.13 33.57 1mgq s GLU 55 CO 0.31 0.01 0.22 -2.00 0.02 0.00 0.00 175.26 173.82 1mgq s GLU 56 N 0.36 3.57 0.07 1.61 2.12 0.11 -1.09 118.70 125.44 1mgq s GLU 56 Ca -0.04 -0.01 0.09 0.00 0.36 0.00 0.00 54.97 55.37 1mgq s GLU 56 Cb -0.07 -3.18 -0.03 0.00 0.26 0.00 0.00 34.13 31.11 1mgq s GLU 56 CO -0.00 0.74 -0.23 -0.51 -0.54 0.00 0.00 175.26 174.71 1mgq s LEU 57 N -1.17 2.21 -0.22 2.70 1.02 0.18 0.59 118.68 124.00 1mgq s LEU 57 Ca 0.19 -0.61 -0.04 0.00 0.02 0.00 0.00 54.13 53.70 1mgq s LEU 57 Cb -0.13 -1.09 0.07 0.00 0.02 0.00 0.00 46.19 45.06 1mgq s LEU 57 CO 0.08 0.18 0.09 -1.61 0.02 0.00 0.00 176.35 175.10 1mgq s GLU 58 N -1.46 0.32 -0.75 1.70 2.02 -1.00 -2.74 118.70 116.78 1mgq s GLU 58 Ca 0.10 -0.39 -0.00 0.00 0.02 0.00 0.00 54.97 54.70 1mgq s GLU 58 Cb -0.10 -1.76 0.00 0.00 0.10 0.00 0.00 34.13 32.38 1mgq s GLU 58 CO 0.03 -0.78 0.68 -0.25 0.02 0.00 0.00 175.26 174.95 1mgq n ASP 59 N 5.17 -7.13 0.00 -0.19 8.00 -1.26 -3.03 116.55 118.11 1mgq n ASP 59 Ca -0.07 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.16 1mgq n ASP 59 Cb 0.46 -4.47 0.00 0.00 -0.02 0.00 0.00 41.12 37.09 1mgq n ASP 59 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mgq n GLY 60 N -1.72 0.00 3.31 0.44 0.00 -1.26 -4.88 105.19 101.09 1mgq n GLY 60 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1mgq n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mgq s GLU 61 N -0.63 3.30 -0.14 1.61 0.41 -1.17 -5.07 118.70 117.02 1mgq s GLU 61 Ca 0.00 -0.71 -0.37 0.00 -0.41 0.00 0.00 54.97 53.48 1mgq s GLU 61 Cb 0.00 -2.68 -0.14 0.00 -1.78 0.00 0.00 34.13 29.53 1mgq s GLU 61 CO 0.00 0.07 1.75 0.28 -0.49 0.00 0.00 175.26 176.87 1mgq n VAL 62 N 3.94 0.37 -0.00 2.63 0.31 -1.26 -2.39 118.33 121.93 1mgq n VAL 62 Ca -0.19 -0.07 0.09 0.00 -0.01 0.00 0.00 64.34 64.17 1mgq n VAL 62 Cb 0.52 -1.48 -0.14 0.00 -0.91 0.00 0.00 33.84 31.83 1mgq n VAL 62 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1mgq n THR 63 N 4.55 0.00 -3.64 2.52 -2.24 0.20 -4.92 114.28 110.74 1mgq n THR 63 Ca 0.23 -0.41 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1mgq n THR 63 Cb 0.21 0.09 -0.07 0.00 -2.10 0.00 0.00 70.33 68.46 1mgq n THR 63 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1mgq s ARG 64 N -3.26 0.78 -0.10 -0.78 3.52 -1.15 -4.99 118.95 112.97 1mgq s ARG 64 Ca -0.07 0.97 -0.00 0.00 -0.13 0.00 0.00 55.73 56.50 1mgq s ARG 64 Cb 0.12 0.36 -0.03 0.00 -1.56 0.00 0.00 34.95 33.84 1mgq s ARG 64 CO 0.76 -0.10 -0.08 1.03 -0.81 0.00 0.00 175.30 176.09 1mgq s ARG 65 N 0.49 3.10 0.01 5.12 0.52 -1.26 0.04 118.95 126.97 1mgq s ARG 65 Ca -0.01 -0.59 0.02 0.00 -0.52 0.00 0.00 55.73 54.63 1mgq s ARG 65 Cb -0.05 -2.66 -0.01 0.00 0.52 0.00 0.00 34.95 32.76 1mgq s ARG 65 CO -0.01 0.45 -0.07 -0.51 0.02 0.00 0.00 175.30 175.17 1mgq s LEU 66 N -0.23 2.07 0.13 2.53 1.43 -0.22 -5.01 118.68 119.38 1mgq s LEU 66 Ca 0.03 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 1mgq s LEU 66 Cb -0.13 -0.32 -0.13 0.00 0.03 0.00 0.00 46.19 45.65 1mgq s LEU 66 CO 0.03 0.02 1.30 1.23 0.23 0.00 0.00 176.35 179.16 1mgq h GLY 67 N 5.63 0.13 -5.29 -3.19 0.00 -1.93 0.29 103.07 98.71 1mgq h GLY 67 Ca -0.31 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 46.65 1mgq h GLY 67 CO 0.48 0.24 -0.18 -1.59 0.00 0.00 0.00 176.54 175.49 1mgq s THR 68 N -2.90 -0.01 -0.17 4.70 2.01 -1.26 -0.20 115.64 117.81 1mgq s THR 68 Ca -0.01 0.02 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1mgq s THR 68 Cb 0.10 -0.67 0.05 0.00 0.01 0.00 0.00 72.50 71.99 1mgq s THR 68 CO 0.83 0.01 0.44 0.54 -0.69 0.00 0.00 174.62 175.75 1mgq s VAL 69 N 0.61 -0.01 -0.36 3.82 0.11 -0.62 -4.99 120.40 118.96 1mgq s VAL 69 Ca -0.03 0.03 -0.12 0.00 -2.93 0.00 0.00 61.98 58.94 1mgq s VAL 69 Cb -0.05 -0.62 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1mgq s VAL 69 CO -0.04 0.01 0.21 -0.22 -3.33 0.00 0.00 175.10 171.74 1mgq s LEU 70 N 0.65 4.60 -0.18 2.54 2.96 -1.26 -1.30 118.68 126.69 1mgq s LEU 70 Ca -0.03 -0.77 -0.11 0.00 -0.22 0.00 0.00 54.13 53.00 1mgq s LEU 70 Cb -0.05 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.53 1mgq s LEU 70 CO -0.04 -0.32 0.19 -0.63 -1.32 0.00 0.00 176.35 174.23 1mgq s ILE 71 N 1.62 5.37 0.11 6.68 1.01 -0.21 -4.96 121.20 130.83 1mgq s ILE 71 Ca 0.04 0.33 -0.30 0.00 0.00 0.00 0.00 60.65 60.71 1mgq s ILE 71 Cb -0.18 -3.53 -0.07 0.00 0.01 0.00 0.00 42.46 38.69 1mgq s ILE 71 CO 0.08 0.44 1.22 -0.13 0.00 0.00 0.00 174.94 176.54 1mgq s ARG 72 N 0.28 4.44 0.45 2.79 0.52 -1.26 -1.72 118.95 124.45 1mgq s ARG 72 Ca 0.12 1.84 0.11 0.00 -0.52 0.00 0.00 55.73 57.28 1mgq s ARG 72 Cb -0.12 -3.30 1.02 0.00 0.52 0.00 0.00 34.95 33.07 1mgq s ARG 72 CO 0.01 -0.22 2.07 0.78 0.02 0.00 0.00 175.30 177.96 1mgq h GLY 73 N 6.29 0.39 1.76 -3.53 0.00 -1.74 -2.92 103.07 103.33 1mgq h GLY 73 Ca -0.43 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 46.78 1mgq h GLY 73 CO 0.80 0.13 0.10 -1.80 0.00 0.00 0.00 176.54 175.77 1mgq h ASP 74 N 0.36 0.00 0.01 0.19 3.58 -1.88 -0.92 116.42 117.76 1mgq h ASP 74 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1mgq h ASP 74 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 1mgq h ASP 74 CO -0.03 0.00 -0.15 0.59 -2.88 0.00 0.00 179.24 176.77 1mgq n ASN 75 N -3.42 2.15 -4.73 2.28 4.13 -1.10 -4.96 115.26 109.61 1mgq n ASN 75 Ca -0.02 -1.61 -0.41 0.00 1.68 0.00 0.00 54.58 54.22 1mgq n ASN 75 Cb 0.19 0.13 -0.05 0.00 -1.54 0.00 0.00 39.78 38.52 1mgq n ASN 75 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1mgq s ILE 76 N -2.19 4.51 -0.19 2.41 1.01 -0.35 -0.80 121.20 125.60 1mgq s ILE 76 Ca 0.27 1.99 -0.15 0.00 0.00 0.00 0.00 60.65 62.77 1mgq s ILE 76 Cb 0.20 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 38.30 1mgq s ILE 76 CO 0.40 0.34 -0.19 0.52 0.00 0.00 0.00 174.94 176.02 1mgq n VAL 77 N 2.67 1.48 -3.94 2.92 0.31 0.74 -4.85 118.33 117.66 1mgq n VAL 77 Ca 0.01 0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.31 1mgq n VAL 77 Cb 0.49 -2.23 -0.08 0.00 -0.91 0.00 0.00 33.84 31.10 1mgq n VAL 77 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1mgq s TYR 78 N -2.50 0.27 -0.06 3.52 -0.85 -1.11 -5.01 117.35 111.61 1mgq s TYR 78 Ca -0.25 -0.70 0.04 0.00 -0.52 0.00 0.00 57.07 55.63 1mgq s TYR 78 Cb 0.05 -0.17 0.00 0.00 0.38 0.00 0.00 41.96 42.22 1mgq s TYR 78 CO 0.39 -0.46 -0.17 0.42 -1.52 0.00 0.00 175.55 174.21 1mgq s ILE 79 N -3.61 1.46 -0.21 -3.49 1.01 -1.26 -1.04 121.20 114.06 1mgq s ILE 79 Ca 0.03 -0.71 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 1mgq s ILE 79 Cb 0.05 -1.27 0.07 0.00 0.01 0.00 0.00 42.46 41.31 1mgq s ILE 79 CO -0.09 0.42 0.04 -0.55 0.00 0.00 0.00 174.94 174.76 1mgq s SER 80 N 0.25 3.16 0.00 3.58 0.15 0.11 -4.96 113.70 115.99 1mgq s SER 80 Ca -0.09 -0.97 0.30 0.00 0.70 0.00 0.00 55.95 55.89 1mgq s SER 80 Cb -0.14 -0.69 1.46 0.00 -1.71 0.00 0.00 66.02 64.95 1mgq s SER 80 CO 0.04 -0.31 1.98 -0.81 1.20 0.00 0.00 173.24 175.33