#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2daw n SER 2 N 0.00 -1.57 -4.66 1.61 3.41 -1.26 -4.75 113.62 106.39 2daw n SER 2 Ca 0.00 -1.18 -0.42 0.00 -0.26 0.00 0.00 58.87 57.01 2daw n SER 2 Cb 0.00 -1.51 -0.03 0.00 -0.26 0.00 0.00 64.21 62.41 2daw n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2daw n SER 3 N -2.29 4.15 0.00 4.04 3.41 -1.26 -4.58 113.62 117.08 2daw n SER 3 Ca 0.09 0.91 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 2daw n SER 3 Cb 0.44 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.86 2daw n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2daw n GLY 4 N 4.54 1.78 0.13 5.00 0.00 -1.26 -5.05 105.19 110.32 2daw n GLY 4 Ca 0.20 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 2daw n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2daw h SER 5 N 0.00 -0.19 -4.21 1.61 0.87 -2.00 -3.46 113.55 106.17 2daw h SER 5 Ca 0.00 -0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.23 2daw h SER 5 Cb 0.00 0.05 -0.21 0.00 -0.44 0.00 0.00 62.40 61.80 2daw h SER 5 CO 0.00 0.20 0.07 -0.94 -0.53 0.00 0.00 176.83 175.63 2daw s SER 6 N -5.32 -0.66 0.00 6.23 1.04 -1.26 -5.17 113.70 108.56 2daw s SER 6 Ca -0.15 1.16 0.00 0.00 0.48 0.00 0.00 55.95 57.45 2daw s SER 6 Cb 0.02 1.15 0.00 0.00 0.10 0.00 0.00 66.02 67.29 2daw s SER 6 CO 0.59 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.11 2daw n GLY 7 N 2.32 4.71 0.42 7.32 0.00 -1.26 -5.10 105.19 113.60 2daw n GLY 7 Ca -0.15 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2daw n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2daw n MET 8 N 0.00 0.00 -1.70 1.61 -0.00 -1.26 -5.09 117.12 110.68 2daw n MET 8 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.70 57.41 2daw n MET 8 Cb 0.00 -0.61 0.11 0.00 -0.00 0.00 0.00 33.22 32.72 2daw n MET 8 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2daw s SER 9 N -3.93 4.00 -0.03 3.17 0.01 -1.26 -5.07 113.70 110.58 2daw s SER 9 Ca 0.00 0.90 0.03 0.00 1.31 0.00 0.00 55.95 58.19 2daw s SER 9 Cb 0.00 -1.45 -0.03 0.00 0.21 0.00 0.00 66.02 64.75 2daw s SER 9 CO 0.00 -2.24 -0.10 0.00 0.41 0.00 0.00 173.24 171.31 2daw s ALA 10 N -3.40 2.85 -0.17 1.44 0.00 -1.26 -5.09 121.76 116.13 2daw s ALA 10 Ca 0.63 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 51.31 2daw s ALA 10 Cb -0.13 -1.07 -0.00 0.00 0.00 0.00 0.00 23.12 21.92 2daw s ALA 10 CO 0.51 0.58 1.02 -1.12 0.00 0.00 0.00 175.76 176.75 2daw s SER 11 N -1.02 7.16 0.35 0.00 0.01 -1.26 -4.91 113.70 114.03 2daw s SER 11 Ca 0.14 1.44 0.17 0.00 1.31 0.00 0.00 55.95 59.01 2daw s SER 11 Cb -0.11 -2.54 1.21 0.00 0.21 0.00 0.00 66.02 64.79 2daw s SER 11 CO 0.03 -0.56 1.60 0.58 0.41 0.00 0.00 173.24 175.30 2daw h VAL 12 N 5.28 0.07 -0.94 3.43 2.07 -1.99 0.24 116.25 124.41 2daw h VAL 12 Ca -0.25 -0.02 0.28 0.00 0.82 0.00 0.00 66.70 67.52 2daw h VAL 12 Cb 1.10 -0.01 -0.17 0.00 -1.52 0.00 0.00 31.29 30.69 2daw h VAL 12 CO 0.92 0.01 0.08 0.29 0.02 0.00 0.00 177.57 178.89 2daw n LYS 13 N -5.25 -0.07 0.16 1.57 5.02 -1.26 -0.93 118.16 117.40 2daw n LYS 13 Ca 0.35 1.39 -0.09 0.00 -2.02 0.00 0.00 58.31 57.94 2daw n LYS 13 Cb 1.15 -2.25 -0.04 0.00 -0.02 0.00 0.00 35.03 33.87 2daw n LYS 13 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2daw h GLU 14 N 0.00 -0.48 -0.50 1.97 4.39 -0.91 -0.20 114.58 118.85 2daw h GLU 14 Ca 0.60 0.03 0.05 0.00 0.34 0.00 0.00 59.36 60.38 2daw h GLU 14 Cb 1.29 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.97 2daw h GLU 14 CO -0.86 -0.32 -0.46 0.77 -1.16 0.00 0.00 179.01 176.98 2daw h SER 15 N -0.50 -1.60 -0.77 1.42 0.02 -1.16 0.74 113.55 111.70 2daw h SER 15 Ca -0.04 0.22 0.18 0.00 -0.84 0.00 0.00 61.79 61.32 2daw h SER 15 Cb 0.42 0.67 -0.12 0.00 0.14 0.00 0.00 62.40 63.51 2daw h SER 15 CO 0.00 -0.28 0.15 -0.07 -1.14 0.00 0.00 176.83 175.50 2daw h LEU 16 N -0.21 -0.08 -0.70 5.07 3.38 -1.31 0.94 115.31 122.41 2daw h LEU 16 Ca 0.08 0.17 0.15 0.00 0.09 0.00 0.00 57.88 58.37 2daw h LEU 16 Cb 0.43 0.25 -0.11 0.00 0.09 0.00 0.00 40.66 41.31 2daw h LEU 16 CO -0.58 -0.10 0.09 -0.61 0.09 0.00 0.00 178.44 177.33 2daw h GLN 17 N 0.21 0.18 0.00 1.13 -0.00 0.10 0.26 115.11 117.00 2daw h GLN 17 Ca 0.45 -0.01 -0.12 0.00 -0.00 0.00 0.00 58.65 58.96 2daw h GLN 17 Cb 0.81 -0.04 -0.02 0.00 0.00 0.00 0.00 27.48 28.23 2daw h GLN 17 CO -0.58 0.12 -0.58 -0.07 0.00 0.00 0.00 178.83 177.72 2daw h LEU 18 N 0.19 0.00 -0.86 -2.39 4.07 -0.34 -2.93 115.31 113.05 2daw h LEU 18 Ca 0.38 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.28 2daw h LEU 18 Cb 0.65 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.36 2daw h LEU 18 CO -0.54 0.58 0.18 1.56 -1.08 0.00 0.00 178.44 179.13 2daw h GLN 19 N 0.00 1.02 -0.07 1.13 4.20 0.88 -2.64 115.11 119.64 2daw h GLN 19 Ca -0.01 -0.22 -0.16 0.00 0.06 0.00 0.00 58.65 58.32 2daw h GLN 19 Cb 1.06 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 2daw h GLN 19 CO 0.08 0.89 -0.65 -0.07 -0.67 0.00 0.00 178.83 178.41 2daw h LEU 20 N 0.98 0.31 0.54 1.46 3.38 -1.08 -3.27 115.31 117.63 2daw h LEU 20 Ca 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2daw h LEU 20 Cb 0.32 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2daw h LEU 20 CO -0.00 0.88 -0.35 -0.07 0.09 0.00 0.00 178.44 178.98 2daw h LEU 21 N 0.19 -0.89 -1.34 1.67 3.38 -1.29 -2.27 115.31 114.75 2daw h LEU 21 Ca -0.01 0.06 0.30 0.00 0.09 0.00 0.00 57.88 58.31 2daw h LEU 21 Cb 1.19 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 42.10 2daw h LEU 21 CO 0.10 -0.54 0.70 1.05 0.09 0.00 0.00 178.44 179.84 2daw h GLU 22 N -0.85 0.32 -0.67 1.13 4.11 -1.57 0.59 114.58 117.65 2daw h GLU 22 Ca -0.06 -0.02 0.07 0.00 0.07 0.00 0.00 59.36 59.42 2daw h GLU 22 Cb 0.70 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 2daw h GLU 22 CO 0.05 0.21 0.44 0.52 0.07 0.00 0.00 179.01 180.30 2daw h MET 23 N 0.33 0.63 -0.22 1.06 2.86 -1.46 0.24 114.93 118.37 2daw h MET 23 Ca 0.65 -0.04 -0.18 0.00 -2.06 0.00 0.00 59.70 58.07 2daw h MET 23 Cb 1.71 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 33.23 2daw h MET 23 CO -0.34 0.41 -0.58 0.93 1.06 0.00 0.00 176.91 178.39 2daw h GLU 24 N 0.64 0.70 -0.18 1.72 5.08 0.25 -2.15 114.58 120.64 2daw h GLU 24 Ca 0.29 -0.46 -0.22 0.00 -1.00 0.00 0.00 59.36 57.97 2daw h GLU 24 Cb 0.32 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.64 2daw h GLU 24 CO -0.09 1.08 -0.74 0.52 -1.00 0.00 0.00 179.01 178.78 2daw h MET 25 N 0.53 0.81 0.54 2.33 2.86 -1.05 -3.09 114.93 117.86 2daw h MET 25 Ca 0.00 -0.64 -0.03 0.00 -2.06 0.00 0.00 59.70 56.98 2daw h MET 25 Cb 1.16 0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.95 2daw h MET 25 CO 0.12 1.25 -0.26 -0.07 1.06 0.00 0.00 176.91 179.00 2daw h LEU 26 N 0.57 -0.62 -0.61 1.22 3.38 -0.58 -1.40 115.31 117.28 2daw h LEU 26 Ca -0.04 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.00 2daw h LEU 26 Cb 1.37 0.16 -0.12 0.00 0.09 0.00 0.00 40.66 42.16 2daw h LEU 26 CO 0.15 -0.33 -0.34 -0.26 0.09 0.00 0.00 178.44 177.76 2daw h PHE 27 N -0.90 -0.94 -0.86 1.13 0.04 -1.49 0.19 116.94 114.11 2daw h PHE 27 Ca -0.07 0.07 0.03 0.00 2.80 0.00 0.00 57.97 60.80 2daw h PHE 27 Cb 0.62 0.50 -0.05 0.00 2.20 0.00 0.00 35.95 39.22 2daw h PHE 27 CO -0.01 -0.38 0.56 0.77 -0.60 0.00 0.00 178.31 178.65 2daw h SER 28 N -0.16 0.93 0.43 2.17 0.02 -1.52 -0.62 113.55 114.80 2daw h SER 28 Ca 0.24 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2daw h SER 28 Cb 0.55 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.88 2daw h SER 28 CO -0.69 0.65 -0.08 0.24 -1.14 0.00 0.00 176.83 175.81 2daw h MET 29 N 1.09 0.00 -3.06 3.45 2.86 0.39 -3.31 114.93 116.36 2daw h MET 29 Ca 0.34 0.00 -0.62 0.00 -2.06 0.00 0.00 59.70 57.36 2daw h MET 29 Cb -0.02 0.00 -0.42 0.00 0.06 0.00 0.00 31.60 31.23 2daw h MET 29 CO -0.11 0.08 -0.60 -0.06 1.06 0.00 0.00 176.91 177.27 2daw s PHE 30 N -4.08 3.37 0.14 -0.22 0.08 0.38 -4.91 117.98 112.73 2daw s PHE 30 Ca -0.02 -3.25 0.32 0.00 0.12 0.00 0.00 56.93 54.09 2daw s PHE 30 Cb 0.12 -2.60 1.34 0.00 -0.57 0.00 0.00 43.02 41.32 2daw s PHE 30 CO 0.55 -0.58 1.98 -1.00 -0.10 0.00 0.00 175.22 176.06 2daw h PRO 31 N 5.52 0.00 -5.84 0.24 0.13 -1.65 -3.43 132.00 126.97 2daw h PRO 31 Ca 0.13 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.67 2daw h PRO 31 Cb 0.78 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.83 2daw h PRO 31 CO 0.69 0.04 0.41 -0.80 -0.23 0.00 0.00 178.00 178.11 2daw s ASN 32 N -5.77 6.87 0.23 1.44 0.01 -1.26 -5.01 114.94 111.45 2daw s ASN 32 Ca 0.01 1.08 -0.31 0.00 -0.71 0.00 0.00 52.86 52.92 2daw s ASN 32 Cb 0.09 -2.44 -0.11 0.00 0.41 0.00 0.00 41.25 39.21 2daw s ASN 32 CO 0.55 -0.45 1.61 -1.58 -1.51 0.00 0.00 177.10 175.73 2daw s GLN 33 N 2.49 4.16 0.00 -0.60 0.74 -1.26 -3.25 119.66 121.95 2daw s GLN 33 Ca 0.36 2.50 0.00 0.00 0.05 0.00 0.00 55.36 58.27 2daw s GLN 33 Cb -0.16 -3.08 0.00 0.00 1.10 0.00 0.00 33.01 30.87 2daw s GLN 33 CO 0.10 -0.64 0.00 0.41 -0.55 0.00 0.00 175.29 174.61 2daw n GLY 34 N 3.18 3.44 0.39 2.59 0.00 -1.26 -4.98 105.19 108.54 2daw n GLY 34 Ca 0.12 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 2daw n GLY 34 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2daw h GLU 35 N 0.00 -0.39 -5.25 1.61 3.07 -1.88 -3.37 114.58 108.37 2daw h GLU 35 Ca 0.00 0.03 -0.64 0.00 -0.50 0.00 0.00 59.36 58.24 2daw h GLU 35 Cb 0.00 0.09 -0.15 0.00 -0.84 0.00 0.00 28.75 27.85 2daw h GLU 35 CO 0.00 -0.26 -0.05 0.08 -1.40 0.00 0.00 179.01 177.38 2daw s VAL 36 N -5.24 5.03 -0.48 3.13 1.01 -1.25 -1.87 120.40 120.72 2daw s VAL 36 Ca -0.12 0.40 -0.05 0.00 0.00 0.00 0.00 61.98 62.21 2daw s VAL 36 Cb 0.07 -3.94 0.13 0.00 0.00 0.00 0.00 36.38 32.63 2daw s VAL 36 CO 0.51 -0.17 0.31 -0.54 0.00 0.00 0.00 175.10 175.21 2daw s LYS 37 N 2.38 2.30 -0.00 2.72 1.02 -0.62 -4.95 119.74 122.59 2daw s LYS 37 Ca 0.19 -1.95 -0.27 0.00 0.02 0.00 0.00 55.97 53.96 2daw s LYS 37 Cb -0.15 -3.75 -0.04 0.00 -0.52 0.00 0.00 37.83 33.37 2daw s LYS 37 CO 0.13 -1.14 0.86 -0.51 -0.92 0.00 0.00 175.35 173.77 2daw s LEU 38 N 0.97 4.38 0.58 3.17 1.43 -1.26 -2.66 118.68 125.29 2daw s LEU 38 Ca 0.09 1.49 0.35 0.00 -1.03 0.00 0.00 54.13 55.03 2daw s LEU 38 Cb -0.23 -3.37 1.77 0.00 0.03 0.00 0.00 46.19 44.40 2daw s LEU 38 CO -0.03 -0.15 2.16 -0.33 0.23 0.00 0.00 176.35 178.23 2daw h GLU 39 N 6.48 0.00 -1.63 1.70 4.39 -1.98 -3.42 114.58 120.13 2daw h GLU 39 Ca -0.42 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.38 2daw h GLU 39 Cb 1.21 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.63 2daw h GLU 39 CO 0.74 0.04 0.10 0.16 -1.16 0.00 0.00 179.01 178.90 2daw s ASP 40 N -5.71 -0.82 0.58 1.42 -4.77 -1.26 -5.02 116.67 101.09 2daw s ASP 40 Ca -0.03 1.19 0.36 0.00 -3.30 0.00 0.00 52.55 50.78 2daw s ASP 40 Cb 0.12 1.71 1.70 0.00 -1.09 0.00 0.00 42.92 45.36 2daw s ASP 40 CO 0.51 -0.17 2.11 -0.37 0.70 0.00 0.00 175.17 177.95 2daw h VAL 41 N 5.45 0.09 0.00 2.11 -1.51 -2.02 -1.64 116.25 118.73 2daw h VAL 41 Ca -0.22 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 2daw h VAL 41 Cb 1.15 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 31.65 2daw h VAL 41 CO 0.13 0.02 -0.12 0.78 -1.23 0.00 0.00 177.57 177.15 2daw h ASN 42 N 0.00 0.00 -0.46 4.19 -0.26 -1.99 -3.28 115.58 113.79 2daw h ASN 42 Ca -0.00 -0.02 0.11 0.00 -0.56 0.00 0.00 56.30 55.83 2daw h ASN 42 Cb 0.34 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.58 2daw h ASN 42 CO 0.00 0.01 0.32 0.00 -1.06 0.00 0.00 177.43 176.70 2daw h ALA 43 N 2.29 2.27 0.15 -0.83 0.00 -1.63 0.12 119.26 121.61 2daw h ALA 43 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 2daw h ALA 43 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2daw h ALA 43 CO 0.00 -0.39 -1.52 -0.07 0.00 0.00 0.00 179.25 177.28 2daw h LEU 44 N 0.12 0.48 0.38 0.00 3.38 -1.74 -3.35 115.31 114.59 2daw h LEU 44 Ca 0.22 -0.63 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2daw h LEU 44 Cb 0.69 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2daw h LEU 44 CO -0.03 1.52 -0.18 0.74 0.09 0.00 0.00 178.44 180.58 2daw h THR 45 N 0.08 0.00 -1.59 0.22 2.02 -1.39 -3.12 112.91 109.13 2daw h THR 45 Ca -0.24 -0.31 0.47 0.00 0.77 0.00 0.00 66.41 67.09 2daw h THR 45 Cb 2.04 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 68.38 2daw h THR 45 CO 0.18 0.00 1.13 0.59 0.37 0.00 0.00 175.52 177.80 2daw n ASN 46 N -4.23 0.02 0.23 4.18 3.02 0.30 0.28 115.26 119.05 2daw n ASN 46 Ca -0.06 0.84 -0.10 0.00 -0.03 0.00 0.00 54.58 55.23 2daw n ASN 46 Cb 0.20 -0.42 -0.05 0.00 -0.61 0.00 0.00 39.78 38.90 2daw n ASN 46 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2daw h ILE 47 N 0.00 0.00 -1.84 2.41 2.04 -1.68 -2.98 117.51 115.46 2daw h ILE 47 Ca 0.77 -0.38 0.54 0.00 1.00 0.00 0.00 64.86 66.79 2daw h ILE 47 Cb 3.05 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 39.05 2daw h ILE 47 CO -0.04 0.00 1.32 0.11 0.00 0.00 0.00 178.15 179.54 2daw h LYS 48 N -1.01 0.00 -0.15 2.37 1.57 -0.15 1.25 116.57 120.44 2daw h LYS 48 Ca -0.06 -0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 2daw h LYS 48 Cb 0.49 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2daw h LYS 48 CO 0.11 0.00 -0.49 0.00 -0.57 0.00 0.00 179.45 178.50 2daw h ARG 49 N 0.00 0.60 -0.17 3.15 3.08 -1.44 -3.08 114.38 116.53 2daw h ARG 49 Ca 0.88 -0.44 0.05 0.00 0.07 0.00 0.00 59.98 60.54 2daw h ARG 49 Cb 3.52 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 33.64 2daw h ARG 49 CO -0.02 1.06 0.16 -0.92 -1.07 0.00 0.00 179.97 179.19 2daw h TYR 50 N 0.26 0.00 0.16 3.04 3.20 0.17 -2.16 116.97 121.64 2daw h TYR 50 Ca -0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2daw h TYR 50 Cb 1.11 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.38 2daw h TYR 50 CO 0.10 0.00 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.47 2daw h LEU 51 N 0.00 -0.18 -0.74 2.82 -0.00 -1.40 -2.47 115.31 113.34 2daw h LEU 51 Ca 0.08 -0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.78 2daw h LEU 51 Cb 0.40 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.11 2daw h LEU 51 CO -0.00 0.08 0.00 -1.84 -0.00 0.00 0.00 178.44 176.68 2daw n GLU 52 N -5.08 0.11 -2.25 1.13 0.28 -0.83 -4.84 120.64 109.15 2daw n GLU 52 Ca -0.09 0.49 -0.01 0.00 -0.16 0.00 0.00 57.16 57.39 2daw n GLU 52 Cb 0.19 -1.78 0.00 0.00 1.43 0.00 0.00 31.44 31.29 2daw n GLU 52 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2daw n GLY 53 N -0.76 0.59 0.79 -1.84 0.00 -0.93 -4.95 105.19 98.09 2daw n GLY 53 Ca 0.01 -0.76 0.09 0.00 0.00 0.00 0.00 46.02 45.35 2daw n GLY 53 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2daw n THR 54 N -3.36 0.30 -3.82 2.61 5.66 -1.16 -4.95 114.28 109.55 2daw n THR 54 Ca -0.01 -0.65 -0.36 0.00 -3.05 0.00 0.00 64.05 59.98 2daw n THR 54 Cb 0.51 1.10 -0.07 0.00 -1.55 0.00 0.00 70.33 70.32 2daw n THR 54 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2daw s ARG 55 N -1.32 3.73 -0.03 1.09 6.06 -1.26 -4.98 118.95 122.24 2daw s ARG 55 Ca 0.25 -0.17 0.07 0.00 -2.50 0.00 0.00 55.73 53.38 2daw s ARG 55 Cb 0.16 -3.28 -0.24 0.00 0.06 0.00 0.00 34.95 31.65 2daw s ARG 55 CO 0.23 0.59 0.72 1.49 -2.50 0.00 0.00 175.30 175.83 2daw h GLU 56 N 5.65 0.08 -6.75 5.12 4.81 -1.99 -3.47 114.58 118.03 2daw h GLU 56 Ca -0.49 -0.13 -0.67 0.00 -0.13 0.00 0.00 59.36 57.93 2daw h GLU 56 Cb 1.20 0.05 -0.20 0.00 0.63 0.00 0.00 28.75 30.43 2daw h GLU 56 CO 0.65 0.75 -0.84 0.00 -0.73 0.00 0.00 179.01 178.85 2daw s ALA 57 N -2.61 2.50 0.15 2.92 0.00 -1.26 -5.10 121.76 118.36 2daw s ALA 57 Ca -0.07 -1.53 -0.31 0.00 0.00 0.00 0.00 51.96 50.04 2daw s ALA 57 Cb 0.08 -0.40 -0.10 0.00 0.00 0.00 0.00 23.12 22.70 2daw s ALA 57 CO 0.82 0.50 1.67 -1.17 0.00 0.00 0.00 175.76 177.57 2daw s LEU 58 N -2.36 4.37 0.76 0.00 1.98 -1.26 -4.98 118.68 117.20 2daw s LEU 58 Ca 0.18 2.67 -0.11 0.00 -2.89 0.00 0.00 54.13 53.97 2daw s LEU 58 Cb -0.09 -3.58 0.05 0.00 0.66 0.00 0.00 46.19 43.23 2daw s LEU 58 CO 0.08 -0.90 1.09 -2.16 -1.89 0.00 0.00 176.35 172.58 2daw s PRO 59 N 1.76 2.30 0.08 0.98 0.04 -1.26 -4.98 135.00 133.93 2daw s PRO 59 Ca 0.74 1.20 -0.31 0.00 0.04 0.00 0.00 61.00 62.67 2daw s PRO 59 Cb -0.45 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 2daw s PRO 59 CO 0.32 -1.61 1.38 -1.25 0.04 0.00 0.00 177.00 175.88 2daw s PRO 60 N -4.81 4.32 1.13 0.56 0.04 -1.26 -5.00 135.00 129.97 2daw s PRO 60 Ca 0.62 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 63.51 2daw s PRO 60 Cb -0.18 -3.34 0.14 0.00 0.04 0.00 0.00 34.50 31.16 2daw s PRO 60 CO 0.54 -0.46 0.19 0.36 0.04 0.00 0.00 177.00 177.68 2daw n LYS 61 N 4.33 -1.75 -3.19 4.56 2.85 -1.26 -4.85 118.16 118.84 2daw n LYS 61 Ca 0.12 -0.49 -0.43 0.00 -1.05 0.00 0.00 58.31 56.45 2daw n LYS 61 Cb 0.43 -1.79 -0.07 0.00 -0.65 0.00 0.00 35.03 32.95 2daw n LYS 61 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2daw s ILE 62 N -2.27 4.92 -0.02 0.58 1.01 -1.24 -4.97 121.20 119.21 2daw s ILE 62 Ca 0.58 -0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.99 2daw s ILE 62 Cb -0.14 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 38.12 2daw s ILE 62 CO 0.66 -0.64 -0.14 -0.70 0.00 0.00 0.00 174.94 174.12 2daw s GLU 63 N 2.54 1.29 0.26 2.79 2.12 -1.26 -3.34 118.70 123.10 2daw s GLU 63 Ca 0.16 -0.49 -0.20 0.00 0.36 0.00 0.00 54.97 54.80 2daw s GLU 63 Cb -0.17 -1.19 0.07 0.00 0.26 0.00 0.00 34.13 33.10 2daw s GLU 63 CO 0.14 0.25 0.96 -0.59 -0.54 0.00 0.00 175.26 175.48 2daw s PHE 64 N -0.12 0.11 -0.12 5.30 -0.71 -1.14 -3.57 117.98 117.73 2daw s PHE 64 Ca 0.01 -0.62 0.02 0.00 -1.04 0.00 0.00 56.93 55.31 2daw s PHE 64 Cb -0.08 0.76 0.01 0.00 -1.21 0.00 0.00 43.02 42.50 2daw s PHE 64 CO 0.00 -1.16 -0.19 0.08 -1.34 0.00 0.00 175.22 172.61 2daw s VAL 65 N -2.11 1.78 -0.17 -2.49 1.01 -1.09 -1.96 120.40 115.39 2daw s VAL 65 Ca 0.20 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 2daw s VAL 65 Cb -0.04 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 2daw s VAL 65 CO 0.08 0.50 -0.00 -0.63 0.00 0.00 0.00 175.10 175.04 2daw s ILE 66 N 0.85 4.23 0.02 2.22 1.01 -0.05 -1.59 121.20 127.89 2daw s ILE 66 Ca -0.08 -0.24 -0.22 0.00 0.00 0.00 0.00 60.65 60.12 2daw s ILE 66 Cb -0.15 -2.87 -0.06 0.00 0.01 0.00 0.00 42.46 39.39 2daw s ILE 66 CO -0.01 0.48 0.64 -0.89 0.00 0.00 0.00 174.94 175.17 2daw s THR 67 N 0.36 4.83 -0.71 2.92 2.01 -0.78 -0.96 115.64 123.31 2daw s THR 67 Ca -0.01 1.36 -0.13 0.00 0.31 0.00 0.00 61.69 63.21 2daw s THR 67 Cb -0.13 -3.98 0.18 0.00 0.01 0.00 0.00 72.50 68.57 2daw s THR 67 CO 0.02 0.42 0.64 -0.76 -0.69 0.00 0.00 174.62 174.24 2daw s LEU 68 N -0.25 6.42 -0.96 4.42 2.01 0.09 -4.94 118.68 125.46 2daw s LEU 68 Ca 0.33 -2.39 -0.23 0.00 0.01 0.00 0.00 54.13 51.85 2daw s LEU 68 Cb -0.19 -2.17 -0.14 0.00 0.01 0.00 0.00 46.19 43.70 2daw s LEU 68 CO 0.19 -0.65 1.92 1.67 1.01 0.00 0.00 176.35 180.49 2daw n GLN 69 N 4.37 1.39 -1.56 1.70 -0.06 -1.26 -3.70 117.38 118.27 2daw n GLN 69 Ca 0.04 -2.12 -0.43 0.00 -2.00 0.00 0.00 57.00 52.49 2daw n GLN 69 Cb 0.44 -3.38 -0.04 0.00 -4.06 0.00 0.00 30.24 23.19 2daw n GLN 69 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 2daw n ILE 70 N 7.19 0.20 -0.05 1.69 2.08 -1.17 -4.85 119.36 124.45 2daw n ILE 70 Ca 0.46 -0.50 -0.09 0.00 0.56 0.00 0.00 62.75 63.19 2daw n ILE 70 Cb 0.44 -2.40 -0.03 0.00 -0.75 0.00 0.00 39.64 36.90 2daw n ILE 70 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2daw h GLU 71 N 15.60 -0.32 -2.98 0.38 5.08 -1.90 -3.07 114.58 127.37 2daw h GLU 71 Ca -0.34 0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 57.82 2daw h GLU 71 Cb 1.26 0.07 -0.32 0.00 0.50 0.00 0.00 28.75 30.26 2daw h GLU 71 CO 1.03 -0.22 -0.55 -2.00 -1.00 0.00 0.00 179.01 176.28 2daw s GLU 72 N -5.99 0.13 0.51 2.33 2.12 -1.26 -2.66 118.70 113.89 2daw s GLU 72 Ca -0.15 0.62 -0.21 0.00 0.36 0.00 0.00 54.97 55.59 2daw s GLU 72 Cb 0.12 -0.12 -0.06 0.00 0.26 0.00 0.00 34.13 34.32 2daw s GLU 72 CO 0.67 -0.25 1.14 -1.25 -0.54 0.00 0.00 175.26 175.03 2daw s PRO 73 N 1.99 3.52 -1.16 4.30 0.04 -1.26 -4.66 135.00 137.76 2daw s PRO 73 Ca -0.02 1.68 -0.24 0.00 0.04 0.00 0.00 61.00 62.46 2daw s PRO 73 Cb -0.12 -2.16 -0.14 0.00 0.04 0.00 0.00 34.50 32.12 2daw s PRO 73 CO -0.08 -0.73 2.00 0.21 0.04 0.00 0.00 177.00 178.44 2daw s LYS 74 N -3.05 2.03 0.36 4.56 2.47 -1.09 -4.65 119.74 120.37 2daw s LYS 74 Ca 0.69 -0.93 0.04 0.00 -1.56 0.00 0.00 55.97 54.21 2daw s LYS 74 Cb -0.26 -5.16 -0.06 0.00 -1.46 0.00 0.00 37.83 30.90 2daw s LYS 74 CO 0.30 -4.53 0.05 0.14 0.16 0.00 0.00 175.35 171.47 2daw s VAL 75 N 13.14 1.27 0.01 4.02 -7.23 -1.16 -5.04 120.40 125.41 2daw s VAL 75 Ca 0.73 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.96 2daw s VAL 75 Cb -0.02 -2.75 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 2daw s VAL 75 CO 0.15 0.00 -0.17 -0.75 -0.31 0.00 0.00 175.10 174.03 2daw s LYS 76 N -3.84 2.23 -0.09 4.82 2.20 -1.26 -3.03 119.74 120.77 2daw s LYS 76 Ca 0.33 -0.88 -0.05 0.00 -0.36 0.00 0.00 55.97 55.02 2daw s LYS 76 Cb 0.08 -2.26 0.04 0.00 -1.51 0.00 0.00 37.83 34.18 2daw s LYS 76 CO 0.15 0.57 0.21 0.42 -0.36 0.00 0.00 175.35 176.34 2daw s ILE 77 N -0.85 -0.03 -0.20 5.43 1.01 -1.24 -4.81 121.20 120.51 2daw s ILE 77 Ca 0.14 0.12 -0.12 0.00 0.00 0.00 0.00 60.65 60.78 2daw s ILE 77 Cb -0.11 -0.32 -0.05 0.00 0.01 0.00 0.00 42.46 42.00 2daw s ILE 77 CO 0.04 0.05 0.24 -1.81 0.00 0.00 0.00 174.94 173.46 2daw s ASP 78 N 0.94 6.31 -0.24 3.58 1.01 -1.11 -0.73 116.67 126.43 2daw s ASP 78 Ca -0.07 0.35 -0.02 0.00 0.71 0.00 0.00 52.55 53.52 2daw s ASP 78 Cb -0.08 -2.15 0.02 0.00 1.01 0.00 0.00 42.92 41.71 2daw s ASP 78 CO -0.06 0.08 -0.07 -0.22 0.21 0.00 0.00 175.17 175.12 2daw s LEU 79 N 0.72 3.03 -0.55 1.23 2.96 -0.13 -0.94 118.68 125.00 2daw s LEU 79 Ca 0.13 -0.74 -0.23 0.00 -0.22 0.00 0.00 54.13 53.07 2daw s LEU 79 Cb -0.13 -1.66 0.05 0.00 0.50 0.00 0.00 46.19 44.94 2daw s LEU 79 CO 0.03 -0.09 0.87 -1.10 -1.32 0.00 0.00 176.35 174.74 2daw s GLN 80 N 1.36 3.27 -0.15 1.98 -0.21 -0.15 -0.87 119.66 124.88 2daw s GLN 80 Ca 0.02 -0.45 -0.08 0.00 0.02 0.00 0.00 55.36 54.87 2daw s GLN 80 Cb -0.16 -4.08 -0.04 0.00 1.00 0.00 0.00 33.01 29.73 2daw s GLN 80 CO -0.05 -1.45 0.13 0.54 -2.12 0.00 0.00 175.29 172.34 2daw s VAL 81 N 3.65 5.41 -0.19 1.09 0.11 -0.83 -1.55 120.40 128.09 2daw s VAL 81 Ca 0.26 0.18 -0.05 0.00 -2.93 0.00 0.00 61.98 59.44 2daw s VAL 81 Cb -0.14 -3.40 0.07 0.00 -1.53 0.00 0.00 36.38 31.38 2daw s VAL 81 CO 0.17 0.55 0.10 -0.89 -3.33 0.00 0.00 175.10 171.70 2daw s THR 82 N -0.48 -0.08 -0.25 5.04 2.01 -0.59 -2.87 115.64 118.42 2daw s THR 82 Ca 0.12 -0.28 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 2daw s THR 82 Cb -0.12 -0.66 0.01 0.00 0.01 0.00 0.00 72.50 71.74 2daw s THR 82 CO 0.02 -0.37 -0.02 -0.04 -0.69 0.00 0.00 174.62 173.52 2daw s MET 83 N 2.13 3.13 0.00 4.92 -1.94 -1.21 -2.08 119.30 124.24 2daw s MET 83 Ca 0.03 -0.80 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 2daw s MET 83 Cb -0.16 -3.09 0.00 0.00 2.01 0.00 0.00 34.83 33.59 2daw s MET 83 CO -0.15 -0.33 0.00 -0.35 -0.01 0.00 0.00 175.02 174.19 2daw n PRO 84 N 4.77 -0.01 -0.00 2.03 -0.04 -1.26 -3.73 135.00 136.76 2daw n PRO 84 Ca -0.17 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.44 2daw n PRO 84 Cb 0.49 0.00 0.75 0.00 -0.04 0.00 0.00 33.50 34.70 2daw n PRO 84 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2daw n HIS 85 N -1.51 0.01 -0.09 0.54 8.25 -1.26 -4.07 115.22 117.08 2daw n HIS 85 Ca 0.00 -0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 2daw n HIS 85 Cb 0.00 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.07 2daw n HIS 85 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2daw n SER 86 N -0.50 1.92 -2.88 0.41 2.88 -1.26 -4.32 113.62 109.86 2daw n SER 86 Ca 0.21 0.38 -0.26 0.00 -1.33 0.00 0.00 58.87 57.87 2daw n SER 86 Cb 0.21 -0.77 0.01 0.00 -0.75 0.00 0.00 64.21 62.90 2daw n SER 86 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2daw n TYR 87 N -4.46 -1.99 0.90 0.66 4.19 -1.26 -1.85 117.16 113.37 2daw n TYR 87 Ca -0.18 0.31 0.08 0.00 3.31 0.00 0.00 57.90 61.41 2daw n TYR 87 Cb 0.53 -1.14 0.44 0.00 0.49 0.00 0.00 39.34 39.65 2daw n TYR 87 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2daw n PRO 88 N 1.03 0.42 -0.36 2.98 -0.04 -1.26 -4.64 135.00 133.13 2daw n PRO 88 Ca 0.05 0.04 0.01 0.00 -0.04 0.00 0.00 63.50 63.56 2daw n PRO 88 Cb 0.32 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.35 2daw n PRO 88 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2daw n TYR 89 N -1.07 0.13 -3.23 0.54 4.02 -0.77 -4.34 117.16 112.44 2daw n TYR 89 Ca 0.11 1.18 -0.09 0.00 -0.01 0.00 0.00 57.90 59.08 2daw n TYR 89 Cb 0.07 -0.92 0.02 0.00 -0.02 0.00 0.00 39.34 38.48 2daw n TYR 89 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 176.86 177.32 2daw n LEU 90 N -5.46 0.00 -4.35 7.72 -0.00 -1.26 -4.48 117.00 109.16 2daw n LEU 90 Ca 0.12 -1.10 -0.45 0.00 -0.00 0.00 0.00 56.01 54.57 2daw n LEU 90 Cb 0.42 -0.12 -0.04 0.00 -0.00 0.00 0.00 43.42 43.67 2daw n LEU 90 CO -0.13 -0.52 0.38 0.00 -0.00 0.00 0.00 177.39 177.12 2daw s ALA 91 N -2.31 3.62 1.03 1.47 0.00 -1.26 -4.58 121.76 119.73 2daw s ALA 91 Ca 0.21 -2.59 -0.20 0.00 0.00 0.00 0.00 51.96 49.39 2daw s ALA 91 Cb -0.02 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.62 2daw s ALA 91 CO 0.14 -2.29 -0.47 1.47 0.00 0.00 0.00 175.76 174.61 2daw n LEU 92 N 5.55 -2.38 -4.48 0.00 -0.00 -1.26 -4.97 117.00 109.45 2daw n LEU 92 Ca -0.04 -0.13 -0.33 0.00 -0.00 0.00 0.00 56.01 55.51 2daw n LEU 92 Cb 0.43 -0.74 -0.13 0.00 -0.00 0.00 0.00 43.42 42.98 2daw n LEU 92 CO 0.51 -2.84 -0.39 -1.58 -0.00 0.00 0.00 177.39 173.09 2daw s GLN 93 N -2.88 3.28 0.03 1.47 0.74 -0.88 -5.00 119.66 116.42 2daw s GLN 93 Ca 0.43 -0.59 0.05 0.00 0.05 0.00 0.00 55.36 55.30 2daw s GLN 93 Cb -0.02 -2.71 -0.02 0.00 1.10 0.00 0.00 33.01 31.35 2daw s GLN 93 CO 0.56 0.36 -0.15 -0.51 -0.55 0.00 0.00 175.29 175.01 2daw s LEU 94 N -0.01 2.15 -0.25 3.68 1.43 -1.26 -1.54 118.68 122.88 2daw s LEU 94 Ca -0.01 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2daw s LEU 94 Cb -0.14 -0.68 0.12 0.00 0.03 0.00 0.00 46.19 45.52 2daw s LEU 94 CO 0.03 0.08 0.31 0.12 0.23 0.00 0.00 176.35 177.12 2daw s PHE 95 N -0.75 -0.56 -0.20 0.29 5.36 -0.60 -4.97 117.98 116.56 2daw s PHE 95 Ca 0.03 0.29 -0.16 0.00 -0.96 0.00 0.00 56.93 56.13 2daw s PHE 95 Cb -0.08 -0.26 -0.04 0.00 -0.34 0.00 0.00 43.02 42.30 2daw s PHE 95 CO 0.01 -0.77 0.41 0.20 -1.46 0.00 0.00 175.22 173.61 2daw s GLY 96 N 2.42 2.10 -0.03 13.12 0.00 -1.26 -0.98 107.32 122.69 2daw s GLY 96 Ca 0.10 -0.50 0.03 0.00 0.00 0.00 0.00 44.72 44.34 2daw s GLY 96 CO -0.21 0.83 -0.11 0.50 0.00 0.00 0.00 173.10 174.11 2daw s ARG 97 N 1.29 1.18 0.02 2.90 0.52 -0.12 -4.90 118.95 119.84 2daw s ARG 97 Ca 0.20 -0.36 -0.01 0.00 -0.52 0.00 0.00 55.73 55.04 2daw s ARG 97 Cb -0.15 -1.07 -0.02 0.00 0.52 0.00 0.00 34.95 34.24 2daw s ARG 97 CO 0.08 0.11 -0.01 0.45 0.02 0.00 0.00 175.30 175.96 2daw s SER 98 N 0.27 0.22 0.18 0.23 0.15 -1.26 -2.74 113.70 110.76 2daw s SER 98 Ca -0.05 -0.49 -0.10 0.00 0.70 0.00 0.00 55.95 56.01 2daw s SER 98 Cb -0.10 0.12 0.09 0.00 -1.71 0.00 0.00 66.02 64.42 2daw s SER 98 CO 0.01 -0.33 1.72 0.77 1.20 0.00 0.00 173.24 176.61 2daw h SER 99 N 4.52 0.94 -0.03 5.45 4.64 -2.01 -3.12 113.55 123.94 2daw h SER 99 Ca -0.32 -0.20 -0.01 0.00 -0.47 0.00 0.00 61.79 60.79 2daw h SER 99 Cb 1.20 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2daw h SER 99 CO 0.42 0.90 -0.01 1.05 -0.87 0.00 0.00 176.83 178.32 2daw h GLU 100 N 0.94 0.06 -6.72 4.77 4.11 -1.97 -3.43 114.58 112.34 2daw h GLU 100 Ca 0.21 -0.02 -0.52 0.00 0.07 0.00 0.00 59.36 59.10 2daw h GLU 100 Cb 0.29 -0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.57 2daw h GLU 100 CO -0.01 0.41 0.62 -0.51 0.07 0.00 0.00 179.01 179.59 2daw s LEU 101 N -9.45 4.43 0.71 3.06 1.43 -1.18 -5.03 118.68 112.65 2daw s LEU 101 Ca -0.15 2.42 -0.04 0.00 -1.03 0.00 0.00 54.13 55.33 2daw s LEU 101 Cb 0.03 -3.62 0.09 0.00 0.03 0.00 0.00 46.19 42.73 2daw s LEU 101 CO 0.68 -0.48 0.99 -1.81 0.23 0.00 0.00 176.35 175.96 2daw s ASP 102 N 0.08 4.56 0.11 2.29 1.11 -1.26 -4.50 116.67 119.05 2daw s ASP 102 Ca 0.54 0.04 -0.29 0.00 0.18 0.00 0.00 52.55 53.02 2daw s ASP 102 Cb -0.36 -0.58 -0.10 0.00 1.07 0.00 0.00 42.92 42.95 2daw s ASP 102 CO 0.41 -1.72 1.61 -0.09 1.18 0.00 0.00 175.17 176.56 2daw h ARG 103 N -0.54 -0.57 0.36 8.23 2.43 -1.96 -0.79 114.38 121.55 2daw h ARG 103 Ca -0.41 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2daw h ARG 103 Cb 1.29 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.93 2daw h ARG 103 CO 0.49 -0.38 -0.50 1.25 -1.51 0.00 0.00 179.97 179.32 2daw h HIS 104 N -0.59 -1.39 -0.73 2.20 2.76 -2.01 -2.26 115.15 113.13 2daw h HIS 104 Ca 0.02 0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.35 2daw h HIS 104 Cb 0.60 0.56 -0.14 0.00 1.55 0.00 0.00 27.41 29.98 2daw h HIS 104 CO -0.27 -0.63 -0.19 1.96 -1.30 0.00 0.00 177.93 177.50 2daw h GLN 105 N -0.90 -0.01 0.04 5.26 1.08 -1.92 -1.41 115.11 117.25 2daw h GLN 105 Ca -0.04 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2daw h GLN 105 Cb 0.82 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.20 2daw h GLN 105 CO -0.14 -0.00 -0.52 1.96 -0.95 0.00 0.00 178.83 179.18 2daw h GLN 106 N -0.01 -0.66 -0.98 1.46 4.20 -0.72 -1.28 115.11 117.12 2daw h GLN 106 Ca 0.35 0.05 0.30 0.00 0.06 0.00 0.00 58.65 59.40 2daw h GLN 106 Cb 0.54 0.15 -0.18 0.00 0.30 0.00 0.00 27.48 28.28 2daw h GLN 106 CO -0.75 -0.44 0.11 1.28 -0.67 0.00 0.00 178.83 178.36 2daw n LEU 107 N -5.47 -0.03 -0.15 1.46 4.77 -0.55 0.11 117.00 117.14 2daw n LEU 107 Ca -0.07 1.66 -0.09 0.00 -0.03 0.00 0.00 56.01 57.48 2daw n LEU 107 Cb 0.40 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2daw n LEU 107 CO 0.14 -1.72 0.94 -0.07 -1.33 0.00 0.00 177.39 175.35 2daw h LEU 108 N 0.00 0.60 0.54 2.23 3.38 -1.03 -0.48 115.31 120.56 2daw h LEU 108 Ca 0.64 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.42 2daw h LEU 108 Cb 1.40 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.00 2daw h LEU 108 CO -0.89 0.59 -0.26 0.25 0.09 0.00 0.00 178.44 178.22 2daw h LEU 109 N 0.57 -0.62 0.21 1.67 5.85 0.16 -2.57 115.31 120.58 2daw h LEU 109 Ca 0.15 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2daw h LEU 109 Cb 0.17 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 2daw h LEU 109 CO -0.01 -0.27 -0.48 0.78 -0.34 0.00 0.00 178.44 178.11 2daw h ASN 110 N -1.00 -1.42 -0.88 1.25 -0.26 -0.53 -1.05 115.58 111.69 2daw h ASN 110 Ca -0.07 0.14 0.18 0.00 -0.56 0.00 0.00 56.30 55.98 2daw h ASN 110 Cb 0.63 0.51 -0.17 0.00 -1.06 0.00 0.00 38.32 38.23 2daw h ASN 110 CO 0.12 -0.54 -0.21 0.11 -1.06 0.00 0.00 177.43 175.85 2daw h LYS 111 N -0.76 0.00 -0.55 0.81 1.57 -1.17 0.77 116.57 117.24 2daw h LYS 111 Ca -0.02 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2daw h LYS 111 Cb 0.73 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 2daw h LYS 111 CO -0.21 0.00 0.29 0.78 -0.57 0.00 0.00 179.45 179.75 2daw h GLY 112 N 0.00 0.82 0.42 3.86 0.00 -0.98 -2.39 103.07 104.80 2daw h GLY 112 Ca 0.43 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 2daw h GLY 112 CO -0.90 0.34 -0.02 -2.00 0.00 0.00 0.00 176.54 173.96 2daw h LEU 113 N 0.77 -0.04 -0.62 3.11 5.85 0.17 -2.81 115.31 121.73 2daw h LEU 113 Ca 0.20 -0.52 0.13 0.00 0.84 0.00 0.00 57.88 58.52 2daw h LEU 113 Cb 0.04 0.01 -0.10 0.00 0.37 0.00 0.00 40.66 40.98 2daw h LEU 113 CO -0.03 0.52 0.05 0.71 -0.34 0.00 0.00 178.44 179.35 2daw h THR 114 N -0.63 0.53 -0.49 1.05 1.35 -0.45 -0.49 112.91 113.78 2daw h THR 114 Ca -0.01 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2daw h THR 114 Cb 0.57 0.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.31 2daw h THR 114 CO 0.01 0.03 0.32 -1.28 -0.25 0.00 0.00 175.52 174.35 2daw h SER 115 N 0.17 0.56 -0.90 5.36 0.87 -1.49 0.30 113.55 118.41 2daw h SER 115 Ca 0.33 -0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.91 2daw h SER 115 Cb 0.53 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.30 2daw h SER 115 CO -0.49 0.41 0.59 0.22 -0.53 0.00 0.00 176.83 177.02 2daw h TYR 116 N 0.66 1.09 0.03 2.24 3.20 -0.87 -1.98 116.97 121.34 2daw h TYR 116 Ca 0.18 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.86 2daw h TYR 116 Cb -0.08 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 37.81 2daw h TYR 116 CO -0.04 0.62 -0.98 0.82 -1.64 0.00 0.00 178.16 176.94 2daw h ILE 117 N 1.12 1.59 0.00 1.81 1.08 -0.63 -3.20 117.51 119.27 2daw h ILE 117 Ca 0.36 -3.02 -0.00 0.00 -0.39 0.00 0.00 64.86 61.82 2daw h ILE 117 Cb 0.05 2.70 -0.00 0.00 -3.07 0.00 0.00 36.82 36.50 2daw h ILE 117 CO -0.11 0.87 -0.00 1.23 -0.69 0.00 0.00 178.15 179.44 2daw h GLY 118 N 2.29 0.00 1.25 5.37 0.00 0.36 -1.90 103.07 110.43 2daw h GLY 118 Ca -0.04 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.06 2daw h GLY 118 CO 0.14 0.00 -0.82 -0.91 0.00 0.00 0.00 176.54 174.95 2daw h THR 119 N 0.00 1.29 -2.79 4.70 1.35 -1.51 -3.46 112.91 112.50 2daw h THR 119 Ca -0.00 -2.05 -0.56 0.00 -0.55 0.00 0.00 66.41 63.25 2daw h THR 119 Cb 0.03 2.07 0.20 0.00 -1.73 0.00 0.00 68.15 68.73 2daw h THR 119 CO 0.00 0.64 -0.90 0.49 -0.25 0.00 0.00 175.52 175.50 2daw n PHE 120 N -3.90 -2.32 -4.16 4.73 3.01 -0.72 -4.99 117.46 109.11 2daw n PHE 120 Ca -0.08 0.25 -0.24 0.00 1.01 0.00 0.00 57.45 58.39 2daw n PHE 120 Cb 0.77 -1.74 -0.06 0.00 -0.01 0.00 0.00 39.48 38.45 2daw n PHE 120 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2daw s ASP 121 N -1.41 5.21 0.14 4.37 1.01 -1.26 -5.08 116.67 119.65 2daw s ASP 121 Ca 0.56 -0.33 -0.31 0.00 0.71 0.00 0.00 52.55 53.19 2daw s ASP 121 Cb -0.30 -1.24 -0.08 0.00 1.01 0.00 0.00 42.92 42.31 2daw s ASP 121 CO 0.67 0.01 1.34 -2.16 0.21 0.00 0.00 175.17 175.24 2daw s PRO 122 N -3.52 4.36 0.00 8.23 0.04 -1.26 -3.74 135.00 139.11 2daw s PRO 122 Ca 0.31 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2daw s PRO 122 Cb -0.08 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2daw s PRO 122 CO 0.23 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.33 2daw n GLY 123 N 3.03 2.03 3.86 0.56 0.00 -1.26 -4.92 105.19 108.48 2daw n GLY 123 Ca 0.09 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 2daw n GLY 123 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2daw s GLU 124 N 0.00 2.27 0.40 1.61 -1.05 -1.24 -4.95 118.70 115.73 2daw s GLU 124 Ca 0.00 -1.99 -0.15 0.00 -0.15 0.00 0.00 54.97 52.67 2daw s GLU 124 Cb 0.00 -2.04 -0.08 0.00 -0.44 0.00 0.00 34.13 31.56 2daw s GLU 124 CO 0.00 -0.48 0.83 -0.51 0.95 0.00 0.00 175.26 176.05 2daw s LEU 125 N -4.17 3.90 0.00 1.83 1.43 -1.26 -4.54 118.68 115.87 2daw s LEU 125 Ca 0.33 1.37 0.00 0.00 -1.03 0.00 0.00 54.13 54.80 2daw s LEU 125 Cb -0.01 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 41.99 2daw s LEU 125 CO 0.20 -0.36 0.00 0.00 0.23 0.00 0.00 176.35 176.42 2daw h VAL 127 N 0.00 0.30 -0.88 0.00 3.04 -1.99 0.58 116.25 117.29 2daw h VAL 127 Ca 0.00 -0.05 0.02 0.00 -1.01 0.00 0.00 66.70 65.66 2daw h VAL 127 Cb 0.76 0.15 -0.05 0.00 -2.01 0.00 0.00 31.29 30.14 2daw h VAL 127 CO 0.00 0.03 0.58 0.00 -1.01 0.00 0.00 177.57 177.16 2daw h ALA 129 N 1.35 0.03 -1.00 0.00 0.00 -0.16 -3.26 119.26 116.22 2daw h ALA 129 Ca 0.34 -0.34 0.32 0.00 0.00 0.00 0.00 54.91 55.24 2daw h ALA 129 Cb -0.05 -0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.55 2daw h ALA 129 CO -0.10 -0.11 0.19 0.00 0.00 0.00 0.00 179.25 179.23 2daw n ALA 130 N -2.43 0.68 0.09 0.00 0.00 -0.88 -0.76 120.51 117.20 2daw n ALA 130 Ca -0.09 1.05 -0.10 0.00 0.00 0.00 0.00 53.44 54.31 2daw n ALA 130 Cb 0.35 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 18.88 2daw n ALA 130 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2daw h ILE 131 N 0.00 0.00 0.30 0.00 2.04 -1.56 -0.29 117.51 118.01 2daw h ILE 131 Ca 0.68 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.54 2daw h ILE 131 Cb 1.57 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 2daw h ILE 131 CO -0.89 0.00 -0.25 -0.61 0.00 0.00 0.00 178.15 176.41 2daw h GLN 132 N -0.48 -0.54 -0.89 2.37 5.75 -1.17 -2.68 115.11 117.48 2daw h GLN 132 Ca -0.01 0.04 0.16 0.00 -0.15 0.00 0.00 58.65 58.69 2daw h GLN 132 Cb 0.46 0.12 -0.16 0.00 1.07 0.00 0.00 27.48 28.98 2daw h GLN 132 CO -0.15 -0.36 -0.29 2.35 -2.65 0.00 0.00 178.83 177.73 2daw h TRP 133 N -0.56 -0.74 0.32 3.99 7.01 -0.84 -1.28 115.95 123.83 2daw h TRP 133 Ca -0.02 0.09 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 2daw h TRP 133 Cb 0.50 0.46 -0.02 0.00 -2.10 0.00 0.00 29.16 28.00 2daw h TRP 133 CO -0.14 -0.39 -0.37 -0.07 -2.79 0.00 0.00 178.44 174.67 2daw h LEU 134 N -0.03 -1.04 -0.63 0.65 3.38 -0.79 0.17 115.31 117.03 2daw h LEU 134 Ca 0.38 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.49 2daw h LEU 134 Cb 0.62 0.35 -0.08 0.00 0.09 0.00 0.00 40.66 41.65 2daw h LEU 134 CO -0.91 -0.47 -0.37 0.00 0.09 0.00 0.00 178.44 176.77 2daw n GLN 135 N -4.63 -0.28 0.11 1.13 6.02 -0.52 -0.10 117.38 119.11 2daw n GLN 135 Ca -0.08 1.07 -0.12 0.00 -0.01 0.00 0.00 57.00 57.86 2daw n GLN 135 Cb 0.33 -1.58 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 2daw n GLN 135 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 2daw h ASP 136 N 0.00 -0.48 -1.07 1.08 1.82 -1.32 -3.02 116.42 113.44 2daw h ASP 136 Ca 0.10 0.05 -0.73 0.00 -0.39 0.00 0.00 57.03 56.06 2daw h ASP 136 Cb 0.26 0.18 -0.11 0.00 0.68 0.00 0.00 39.33 40.33 2daw h ASP 136 CO -0.60 -0.25 2.49 0.59 -1.61 0.00 0.00 179.24 179.86 2daw n ASN 137 N -5.30 8.09 0.04 2.28 3.02 0.86 -4.24 115.26 120.01 2daw n ASN 137 Ca -0.07 -3.10 0.00 0.00 -0.03 0.00 0.00 54.58 51.38 2daw n ASN 137 Cb 0.22 -1.37 0.00 0.00 -0.61 0.00 0.00 39.78 38.01 2daw n ASN 137 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2daw n SER 138 N 1.83 0.26 -0.28 6.41 2.88 -0.50 -4.74 113.62 119.48 2daw n SER 138 Ca 0.64 0.14 0.04 0.00 -1.33 0.00 0.00 58.87 58.36 2daw n SER 138 Cb 0.25 -0.00 0.26 0.00 -0.75 0.00 0.00 64.21 63.97 2daw n SER 138 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2daw h ALA 139 N 0.00 1.55 -0.95 -1.46 0.00 -1.75 -2.42 119.26 114.23 2daw h ALA 139 Ca 0.00 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.16 2daw h ALA 139 Cb 0.30 -0.26 -0.17 0.00 0.00 0.00 0.00 17.79 17.66 2daw h ALA 139 CO 0.00 0.33 0.11 1.03 0.00 0.00 0.00 179.25 180.72 2daw h SER 140 N 0.98 -0.31 0.30 0.00 0.87 -1.88 0.63 113.55 114.14 2daw h SER 140 Ca 0.37 0.26 -0.01 0.00 -1.23 0.00 0.00 61.79 61.17 2daw h SER 140 Cb 0.19 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2daw h SER 140 CO -0.13 -0.31 -0.14 1.88 -0.53 0.00 0.00 176.83 177.59 2daw h TYR 141 N 0.05 -0.37 -0.91 2.24 -1.99 -1.77 -3.27 116.97 110.95 2daw h TYR 141 Ca 0.60 -0.01 0.35 0.00 2.00 0.00 0.00 58.73 61.67 2daw h TYR 141 Cb 1.26 0.12 -0.17 0.00 2.00 0.00 0.00 36.73 39.95 2daw h TYR 141 CO -0.40 -0.23 0.38 1.19 -0.00 0.00 0.00 178.16 179.09 2daw n PHE 142 N -4.33 0.95 -1.10 4.88 3.72 -0.74 -4.41 117.46 116.43 2daw n PHE 142 Ca -0.05 1.08 -0.44 0.00 -0.05 0.00 0.00 57.45 58.00 2daw n PHE 142 Cb 0.16 -1.41 -0.11 0.00 -0.94 0.00 0.00 39.48 37.18 2daw n PHE 142 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2daw n LEU 143 N -5.13 0.49 -3.23 4.37 4.77 0.14 0.17 117.00 118.57 2daw n LEU 143 Ca 0.31 0.42 -0.17 0.00 -0.03 0.00 0.00 56.01 56.54 2daw n LEU 143 Cb 1.06 -0.74 0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2daw n LEU 143 CO -0.01 -0.62 0.13 0.59 -1.33 0.00 0.00 177.39 176.16 2daw n ASN 144 N 6.99 -3.10 -4.55 -1.43 3.02 -1.26 -4.96 115.26 109.97 2daw n ASN 144 Ca 0.48 -0.54 -0.32 0.00 -0.03 0.00 0.00 54.58 54.17 2daw n ASN 144 Cb -0.01 -4.66 0.15 0.00 -0.61 0.00 0.00 39.78 34.64 2daw n ASN 144 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2daw n ARG 145 N -4.03 -0.42 -2.88 3.52 -4.01 0.45 -4.91 116.66 104.38 2daw n ARG 145 Ca -0.19 -0.07 -0.43 0.00 -1.04 0.00 0.00 57.85 56.12 2daw n ARG 145 Cb 0.63 -2.13 -0.04 0.00 -3.04 0.00 0.00 32.46 27.87 2daw n ARG 145 CO 0.00 0.00 0.00 0.21 -3.04 0.00 0.00 177.63 174.80 2daw s LYS 146 N -4.17 3.26 0.09 2.89 2.47 -1.26 -5.02 119.74 118.00 2daw s LYS 146 Ca 0.62 -0.45 0.07 0.00 -1.56 0.00 0.00 55.97 54.65 2daw s LYS 146 Cb -0.22 -4.09 -0.03 0.00 -1.46 0.00 0.00 37.83 32.02 2daw s LYS 146 CO 0.62 -1.53 -0.19 -0.48 0.16 0.00 0.00 175.35 173.93 2daw s LEU 147 N 3.83 2.27 -0.06 5.43 0.05 -1.26 -4.99 118.68 123.95 2daw s LEU 147 Ca 0.27 -0.64 -0.07 0.00 0.05 0.00 0.00 54.13 53.74 2daw s LEU 147 Cb -0.14 -0.81 -0.04 0.00 -2.05 0.00 0.00 46.19 43.14 2daw s LEU 147 CO 0.16 0.04 0.20 0.54 -0.55 0.00 0.00 176.35 176.75 2daw s VAL 148 N -1.12 5.41 0.60 1.48 0.11 -1.26 -5.07 120.40 120.55 2daw s VAL 148 Ca 0.05 0.18 -0.19 0.00 -2.93 0.00 0.00 61.98 59.09 2daw s VAL 148 Cb -0.10 -3.49 -0.03 0.00 -1.53 0.00 0.00 36.38 31.23 2daw s VAL 148 CO 0.03 0.51 1.20 -1.20 -3.33 0.00 0.00 175.10 172.31 2daw n SER 149 N 1.58 1.81 -3.71 3.54 7.64 -1.26 -5.03 113.62 118.20 2daw n SER 149 Ca -0.16 0.87 -0.11 0.00 1.01 0.00 0.00 58.87 60.47 2daw n SER 149 Cb 0.54 -1.51 -0.10 0.00 -1.01 0.00 0.00 64.21 62.13 2daw n SER 149 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2daw s GLY 150 N -1.20 -0.34 1.02 0.23 0.00 -1.26 -5.17 107.32 100.60 2daw s GLY 150 Ca 0.77 1.44 -0.13 0.00 0.00 0.00 0.00 44.72 46.81 2daw s GLY 150 CO 0.45 1.46 1.09 2.56 0.00 0.00 0.00 173.10 178.66 2daw s PRO 151 N 0.94 0.28 -0.19 2.90 0.04 -1.26 -5.08 135.00 132.63 2daw s PRO 151 Ca -0.06 0.47 -0.34 0.00 0.04 0.00 0.00 61.00 61.12 2daw s PRO 151 Cb -0.06 -1.72 0.14 0.00 0.04 0.00 0.00 34.50 32.90 2daw s PRO 151 CO -0.08 -2.82 1.21 0.45 0.04 0.00 0.00 177.00 175.80 2daw s SER 152 N -3.46 -0.14 0.06 6.66 0.15 -1.26 -5.19 113.70 110.52 2daw s SER 152 Ca 0.66 0.03 -0.26 0.00 0.70 0.00 0.00 55.95 57.07 2daw s SER 152 Cb -0.19 0.15 0.08 0.00 -1.71 0.00 0.00 66.02 64.35 2daw s SER 152 CO 0.58 -0.22 0.72 -0.94 1.20 0.00 0.00 173.24 174.58 2daw s SER 153 N -2.00 -0.51 0.00 5.45 1.04 -1.26 -5.38 113.70 111.04 2daw s SER 153 Ca 0.09 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.66 2daw s SER 153 Cb -0.01 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2daw s SER 153 CO -0.05 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.02