#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2daw s SER 2 N 0.00 6.75 0.00 1.61 1.04 -1.26 -5.01 113.70 116.84 2daw s SER 2 Ca 0.00 2.40 -0.12 0.00 0.48 0.00 0.00 55.95 58.71 2daw s SER 2 Cb 0.00 -2.59 0.01 0.00 0.10 0.00 0.00 66.02 63.55 2daw s SER 2 CO 0.00 -0.71 0.25 -0.44 0.98 0.00 0.00 173.24 173.31 2daw s SER 3 N 1.23 -0.10 0.00 7.02 0.01 -1.26 -5.14 113.70 115.46 2daw s SER 3 Ca 0.66 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.86 2daw s SER 3 Cb -0.38 0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2daw s SER 3 CO 0.30 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 174.11 2daw n GLY 4 N 1.20 0.95 3.10 3.44 0.00 -1.26 -5.13 105.19 107.49 2daw n GLY 4 Ca -0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.79 2daw n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2daw s SER 5 N 0.58 -0.69 0.38 1.61 0.15 -1.26 -5.16 113.70 109.31 2daw s SER 5 Ca 0.00 0.69 -0.13 0.00 0.70 0.00 0.00 55.95 57.20 2daw s SER 5 Cb 0.00 1.73 -0.08 0.00 -1.71 0.00 0.00 66.02 65.96 2daw s SER 5 CO 0.00 -0.27 0.78 -0.55 1.20 0.00 0.00 173.24 174.40 2daw s SER 6 N 2.73 6.66 0.00 5.45 0.15 -1.26 -4.94 113.70 122.49 2daw s SER 6 Ca 0.15 1.26 0.00 0.00 0.70 0.00 0.00 55.95 58.05 2daw s SER 6 Cb -0.15 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2daw s SER 6 CO -0.18 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2daw n GLY 7 N -0.87 -0.55 0.71 9.45 0.00 -1.26 -5.03 105.19 107.65 2daw n GLY 7 Ca 0.03 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 2daw n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2daw n MET 8 N 0.00 0.19 -1.68 1.61 2.00 -1.26 -5.00 117.12 112.98 2daw n MET 8 Ca 0.00 0.08 -0.45 0.00 0.00 0.00 0.00 57.70 57.33 2daw n MET 8 Cb 0.00 -0.83 -0.04 0.00 0.00 0.00 0.00 33.22 32.35 2daw n MET 8 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2daw n SER 9 N -3.68 3.58 -4.34 7.83 7.64 -1.26 -4.92 113.62 118.47 2daw n SER 9 Ca -0.11 1.00 -0.33 0.00 1.01 0.00 0.00 58.87 60.45 2daw n SER 9 Cb 0.36 -1.45 0.13 0.00 -1.01 0.00 0.00 64.21 62.24 2daw n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2daw n ALA 10 N 5.46 -3.34 -1.82 -0.43 0.00 -1.26 -4.91 120.51 114.21 2daw n ALA 10 Ca 0.19 -0.85 -0.40 0.00 0.00 0.00 0.00 53.44 52.38 2daw n ALA 10 Cb 0.32 -1.65 -0.05 0.00 0.00 0.00 0.00 19.45 18.08 2daw n ALA 10 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2daw s SER 11 N -1.88 7.37 0.46 0.00 0.01 -1.26 -4.93 113.70 113.46 2daw s SER 11 Ca 0.55 2.15 0.12 0.00 1.31 0.00 0.00 55.95 60.07 2daw s SER 11 Cb -0.17 -2.62 1.06 0.00 0.21 0.00 0.00 66.02 64.50 2daw s SER 11 CO 0.68 -0.08 2.10 0.58 0.41 0.00 0.00 173.24 176.93 2daw h VAL 12 N 3.25 1.05 -1.41 3.43 2.07 -1.91 -2.21 116.25 120.52 2daw h VAL 12 Ca -0.46 -0.10 0.42 0.00 0.82 0.00 0.00 66.70 67.38 2daw h VAL 12 Cb 1.21 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 31.63 2daw h VAL 12 CO 0.68 0.05 0.98 0.11 0.02 0.00 0.00 177.57 179.41 2daw h LYS 13 N 0.29 0.07 0.02 1.57 1.57 -1.95 -0.74 116.57 117.40 2daw h LYS 13 Ca 0.08 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2daw h LYS 13 Cb -0.01 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2daw h LYS 13 CO -0.02 0.05 -0.01 0.93 -0.57 0.00 0.00 179.45 179.83 2daw h GLU 14 N 0.08 -0.03 -0.92 3.15 4.39 -1.79 -2.80 114.58 116.66 2daw h GLU 14 Ca 0.73 0.00 0.25 0.00 0.34 0.00 0.00 59.36 60.69 2daw h GLU 14 Cb 2.63 0.01 -0.17 0.00 -0.10 0.00 0.00 28.75 31.12 2daw h GLU 14 CO -0.15 -0.02 0.03 -1.13 -1.16 0.00 0.00 179.01 176.58 2daw n SER 15 N -2.78 -0.10 -0.17 1.42 3.41 -0.83 0.20 113.62 114.78 2daw n SER 15 Ca -0.00 1.56 -0.07 0.00 -0.26 0.00 0.00 58.87 60.10 2daw n SER 15 Cb 0.01 -0.57 0.09 0.00 -0.26 0.00 0.00 64.21 63.48 2daw n SER 15 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2daw h LEU 16 N 0.00 0.93 -1.19 1.04 3.38 -1.30 -1.89 115.31 116.27 2daw h LEU 16 Ca 0.56 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 58.31 2daw h LEU 16 Cb 1.16 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.62 2daw h LEU 16 CO -0.86 0.98 0.56 -0.61 0.09 0.00 0.00 178.44 178.60 2daw h GLN 17 N 0.88 1.05 0.00 1.13 -0.00 0.26 -1.57 115.11 116.86 2daw h GLN 17 Ca 0.16 -0.06 -0.15 0.00 -0.00 0.00 0.00 58.65 58.60 2daw h GLN 17 Cb 0.51 -0.24 -0.02 0.00 0.00 0.00 0.00 27.48 27.74 2daw h GLN 17 CO 0.03 0.69 -0.70 -0.07 0.00 0.00 0.00 178.83 178.78 2daw h LEU 18 N 1.08 0.00 -1.47 -2.39 3.38 -0.97 -2.80 115.31 112.13 2daw h LEU 18 Ca 0.33 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.25 2daw h LEU 18 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2daw h LEU 18 CO -0.09 0.70 -0.19 1.56 0.09 0.00 0.00 178.44 180.50 2daw h GLN 19 N 0.00 0.00 0.00 1.13 4.20 -0.48 -1.96 115.11 118.00 2daw h GLN 19 Ca -0.01 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 2daw h GLN 19 Cb 1.37 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 2daw h GLN 19 CO 0.09 0.19 -0.62 -0.07 -0.67 0.00 0.00 178.83 177.76 2daw h LEU 20 N 0.00 0.00 -0.99 1.46 3.38 -1.36 -3.33 115.31 114.46 2daw h LEU 20 Ca -0.00 -0.42 0.13 0.00 0.09 0.00 0.00 57.88 57.68 2daw h LEU 20 Cb 0.57 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 2daw h LEU 20 CO 0.03 1.06 0.62 0.17 0.09 0.00 0.00 178.44 180.40 2daw h LEU 21 N -1.00 0.89 -1.58 1.67 8.10 -1.53 0.31 115.31 122.17 2daw h LEU 21 Ca -0.14 0.06 0.09 0.00 0.11 0.00 0.00 57.88 58.00 2daw h LEU 21 Cb 0.85 -0.12 -0.04 0.00 -0.44 0.00 0.00 40.66 40.92 2daw h LEU 21 CO -0.08 0.45 0.41 1.05 -4.11 0.00 0.00 178.44 176.16 2daw h GLU 22 N 0.95 0.47 -0.81 0.17 4.11 -1.52 -1.58 114.58 116.37 2daw h GLU 22 Ca 0.50 -0.03 0.13 0.00 0.07 0.00 0.00 59.36 60.04 2daw h GLU 22 Cb 0.54 -0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.60 2daw h GLU 22 CO -0.28 0.31 0.41 0.52 0.07 0.00 0.00 179.01 180.04 2daw h MET 23 N 0.48 0.60 -0.61 1.06 2.86 -1.04 0.52 114.93 118.81 2daw h MET 23 Ca 0.28 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.85 2daw h MET 23 Cb 0.46 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 2daw h MET 23 CO -0.08 0.40 0.26 0.93 1.06 0.00 0.00 176.91 179.47 2daw h GLU 24 N 0.62 0.88 -0.27 1.72 5.08 -1.36 0.11 114.58 121.35 2daw h GLU 24 Ca 0.43 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.49 2daw h GLU 24 Cb 0.57 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 2daw h GLU 24 CO -0.34 0.71 -0.52 0.52 -1.00 0.00 0.00 179.01 178.38 2daw h MET 25 N 0.87 0.78 -0.06 2.33 2.86 -0.99 -2.46 114.93 118.26 2daw h MET 25 Ca 0.21 -0.48 -0.03 0.00 -2.06 0.00 0.00 59.70 57.34 2daw h MET 25 Cb 0.15 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2daw h MET 25 CO -0.02 1.10 -0.09 -0.07 1.06 0.00 0.00 176.91 178.89 2daw h LEU 26 N 0.60 0.18 -0.32 1.22 3.38 -0.60 -2.88 115.31 116.89 2daw h LEU 26 Ca 0.02 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.51 2daw h LEU 26 Cb 1.10 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 2daw h LEU 26 CO 0.11 0.67 0.04 -0.26 0.09 0.00 0.00 178.44 179.09 2daw h PHE 27 N -0.30 0.05 -0.61 1.13 0.04 -0.85 -1.78 116.94 114.63 2daw h PHE 27 Ca 0.01 0.02 0.08 0.00 2.80 0.00 0.00 57.97 60.88 2daw h PHE 27 Cb 0.63 0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.74 2daw h PHE 27 CO 0.10 -0.01 0.26 1.03 -0.60 0.00 0.00 178.31 179.09 2daw h SER 28 N 0.14 0.30 -0.81 2.17 0.87 -1.49 -1.06 113.55 113.68 2daw h SER 28 Ca 0.15 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.79 2daw h SER 28 Cb 0.19 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 2daw h SER 28 CO -0.22 0.18 0.54 0.24 -0.53 0.00 0.00 176.83 177.04 2daw h MET 29 N 0.46 1.05 -3.37 2.24 2.86 -1.17 -3.28 114.93 113.73 2daw h MET 29 Ca 0.30 -0.06 -0.72 0.00 -2.06 0.00 0.00 59.70 57.15 2daw h MET 29 Cb 0.32 -0.24 -0.34 0.00 0.06 0.00 0.00 31.60 31.41 2daw h MET 29 CO -0.27 0.70 -0.00 -0.06 1.06 0.00 0.00 176.91 178.34 2daw s PHE 30 N -5.90 3.95 0.31 -0.22 0.08 -0.40 -4.87 117.98 110.92 2daw s PHE 30 Ca -0.11 -2.95 0.09 0.00 0.12 0.00 0.00 56.93 54.08 2daw s PHE 30 Cb 0.18 -3.35 0.49 0.00 -0.57 0.00 0.00 43.02 39.77 2daw s PHE 30 CO 0.79 -0.78 1.70 -1.00 -0.10 0.00 0.00 175.22 175.83 2daw h PRO 31 N 6.17 0.10 -6.30 0.24 0.13 -1.62 -3.42 132.00 127.30 2daw h PRO 31 Ca 0.16 -0.05 -0.56 0.00 -0.87 0.00 0.00 66.00 64.67 2daw h PRO 31 Cb 0.83 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.93 2daw h PRO 31 CO 0.88 0.55 1.23 -0.80 -0.23 0.00 0.00 178.00 179.63 2daw s ASN 32 N -6.89 5.92 0.28 1.44 0.01 -1.26 -4.94 114.94 109.51 2daw s ASN 32 Ca -0.03 1.02 -0.27 0.00 -0.71 0.00 0.00 52.86 52.87 2daw s ASN 32 Cb 0.13 -2.53 -0.15 0.00 0.41 0.00 0.00 41.25 39.12 2daw s ASN 32 CO 0.76 -1.73 0.84 0.00 -1.51 0.00 0.00 177.10 175.46 2daw n GLN 33 N 8.46 0.94 0.00 -0.60 3.00 -1.26 -2.75 117.38 125.17 2daw n GLN 33 Ca 0.21 0.33 0.00 0.00 -0.01 0.00 0.00 57.00 57.53 2daw n GLN 33 Cb 0.48 -1.61 0.00 0.00 0.00 0.00 0.00 30.24 29.11 2daw n GLN 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2daw n GLY 34 N 1.46 3.15 0.28 1.08 0.00 -1.26 -4.95 105.19 104.95 2daw n GLY 34 Ca 0.12 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.21 -5.28 1.61 4.39 -1.86 -3.36 114.58 109.87 2daw h GLU 35 Ca 0.00 0.01 -0.64 0.00 0.34 0.00 0.00 59.36 59.08 2daw h GLU 35 Cb 0.00 0.05 -0.14 0.00 -0.10 0.00 0.00 28.75 28.55 2daw h GLU 35 CO 0.00 -0.14 -0.03 0.08 -1.16 0.00 0.00 179.01 177.76 2daw s VAL 36 N -4.65 5.02 -0.26 3.13 1.01 -1.26 -2.73 120.40 120.67 2daw s VAL 36 Ca -0.09 0.50 0.01 0.00 0.00 0.00 0.00 61.98 62.40 2daw s VAL 36 Cb 0.06 -3.93 0.05 0.00 0.00 0.00 0.00 36.38 32.55 2daw s VAL 36 CO 0.39 -0.14 -0.09 -0.54 0.00 0.00 0.00 175.10 174.72 2daw s LYS 37 N 2.39 2.46 -0.77 2.72 1.02 -1.12 -5.00 119.74 121.44 2daw s LYS 37 Ca 0.20 -1.21 -0.19 0.00 0.02 0.00 0.00 55.97 54.78 2daw s LYS 37 Cb -0.15 -2.92 0.12 0.00 -0.52 0.00 0.00 37.83 34.35 2daw s LYS 37 CO 0.12 -0.51 0.94 -0.51 -0.92 0.00 0.00 175.35 174.47 2daw s LEU 38 N 1.19 5.22 0.49 3.17 1.43 -1.26 -2.95 118.68 125.96 2daw s LEU 38 Ca -0.05 -1.74 0.35 0.00 -1.03 0.00 0.00 54.13 51.66 2daw s LEU 38 Cb -0.19 -2.35 1.49 0.00 0.03 0.00 0.00 46.19 45.17 2daw s LEU 38 CO -0.05 -1.10 1.67 -0.33 0.23 0.00 0.00 176.35 176.77 2daw h GLU 39 N 8.95 0.08 -3.09 1.70 4.39 -1.98 -3.06 114.58 121.57 2daw h GLU 39 Ca -0.06 -0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.02 2daw h GLU 39 Cb 1.05 -0.02 -0.40 0.00 -0.10 0.00 0.00 28.75 29.28 2daw h GLU 39 CO 1.08 0.05 -0.72 0.16 -1.16 0.00 0.00 179.01 178.42 2daw s ASP 40 N -4.59 3.79 0.38 1.42 1.47 -1.26 -4.96 116.67 112.92 2daw s ASP 40 Ca -0.07 -2.66 0.05 0.00 1.18 0.00 0.00 52.55 51.05 2daw s ASP 40 Cb 0.27 -1.15 0.74 0.00 -0.34 0.00 0.00 42.92 42.44 2daw s ASP 40 CO 0.83 -0.27 2.03 -0.37 0.68 0.00 0.00 175.17 178.07 2daw h VAL 41 N 5.34 1.14 0.00 2.11 -1.51 -1.95 0.00 116.25 121.37 2daw h VAL 41 Ca -0.03 -0.27 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 2daw h VAL 41 Cb 0.92 0.40 0.00 0.00 -2.13 0.00 0.00 31.29 30.48 2daw h VAL 41 CO 0.52 0.14 0.00 -0.46 -1.23 0.00 0.00 177.57 176.54 2daw n ASN 42 N -4.45 0.31 0.09 4.19 0.23 -1.26 -3.22 115.26 111.15 2daw n ASN 42 Ca 0.05 0.58 -0.12 0.00 -0.53 0.00 0.00 54.58 54.56 2daw n ASN 42 Cb 0.06 -0.65 -0.05 0.00 -2.08 0.00 0.00 39.78 37.06 2daw n ASN 42 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2daw h ALA 43 N 2.36 -0.27 -0.98 -2.53 0.00 -1.35 0.11 119.26 116.61 2daw h ALA 43 Ca 0.00 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.02 2daw h ALA 43 Cb 0.28 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 2daw h ALA 43 CO 0.00 -0.69 0.60 -0.07 0.00 0.00 0.00 179.25 179.09 2daw h LEU 44 N -0.32 0.85 0.57 0.00 3.38 -1.71 -2.68 115.31 115.39 2daw h LEU 44 Ca 0.03 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2daw h LEU 44 Cb 0.36 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.01 2daw h LEU 44 CO -0.11 0.42 -0.28 0.74 0.09 0.00 0.00 178.44 179.30 2daw h THR 45 N 0.90 0.05 -0.82 0.22 2.02 -1.58 -3.17 112.91 110.54 2daw h THR 45 Ca 0.50 -0.44 0.26 0.00 0.77 0.00 0.00 66.41 67.51 2daw h THR 45 Cb 0.57 0.08 -0.15 0.00 -1.74 0.00 0.00 68.15 66.90 2daw h THR 45 CO -0.29 0.01 0.14 0.59 0.37 0.00 0.00 175.52 176.33 2daw n ASN 46 N -5.29 0.01 0.20 4.18 3.02 0.34 -0.52 115.26 117.20 2daw n ASN 46 Ca -0.10 1.39 -0.10 0.00 -0.03 0.00 0.00 54.58 55.74 2daw n ASN 46 Cb 0.31 -0.55 -0.05 0.00 -0.61 0.00 0.00 39.78 38.88 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 -0.88 2.41 2.04 -1.49 -2.58 117.51 117.01 2daw h ILE 47 Ca 0.56 0.00 0.35 0.00 1.00 0.00 0.00 64.86 66.76 2daw h ILE 47 Cb 1.26 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.18 2daw h ILE 47 CO -0.73 0.00 0.39 0.29 0.00 0.00 0.00 178.15 178.09 2daw n LYS 48 N -3.84 -0.06 -0.16 2.37 5.02 0.32 0.18 118.16 121.99 2daw n LYS 48 Ca -0.07 1.24 -0.06 0.00 -2.02 0.00 0.00 58.31 57.39 2daw n LYS 48 Cb 0.25 -2.17 0.03 0.00 -0.02 0.00 0.00 35.03 33.11 2daw n LYS 48 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2daw h ARG 49 N 0.00 0.59 0.00 1.97 3.08 -1.07 0.13 114.38 119.08 2daw h ARG 49 Ca 0.71 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.72 2daw h ARG 49 Cb 1.82 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.73 2daw h ARG 49 CO -0.71 0.39 0.00 -0.92 -1.07 0.00 0.00 179.97 177.67 2daw h TYR 50 N 0.61 0.00 0.14 3.04 5.03 0.22 -1.92 116.97 124.09 2daw h TYR 50 Ca 0.19 0.00 -0.32 0.00 2.58 0.00 0.00 58.73 61.18 2daw h TYR 50 Cb -0.01 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.27 2daw h TYR 50 CO -0.06 0.00 -1.64 -0.07 -1.32 0.00 0.00 178.16 175.07 2daw h LEU 51 N 0.00 0.48 -1.52 2.82 3.38 -0.19 -3.33 115.31 116.95 2daw h LEU 51 Ca 0.00 -0.90 -0.00 0.00 0.09 0.00 0.00 57.88 57.07 2daw h LEU 51 Cb 0.39 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2daw h LEU 51 CO 0.00 1.73 -0.01 1.05 0.09 0.00 0.00 178.44 181.30 2daw h GLU 52 N -0.09 0.00 0.00 1.13 4.11 -0.89 -3.46 114.58 115.38 2daw h GLU 52 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 2daw h GLU 52 Cb 1.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.18 2daw h GLU 52 CO 0.11 0.01 0.00 0.41 0.07 0.00 0.00 179.01 179.60 2daw n GLY 53 N -0.01 1.09 0.48 1.06 0.00 -1.02 -4.97 105.19 101.80 2daw n GLY 53 Ca 0.00 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.09 0.00 -4.46 2.61 5.66 -0.75 -4.94 114.28 110.31 2daw n THR 54 Ca 0.00 -0.28 -0.27 0.00 -3.05 0.00 0.00 64.05 60.45 2daw n THR 54 Cb 0.04 1.25 -0.13 0.00 -1.55 0.00 0.00 70.33 69.94 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 -2.33 1.34 -0.06 1.09 3.52 -1.16 -4.95 118.95 116.39 2daw s ARG 55 Ca 0.17 -1.17 0.03 0.00 -0.13 0.00 0.00 55.73 54.63 2daw s ARG 55 Cb 0.17 -1.64 -0.06 0.00 -1.56 0.00 0.00 34.95 31.86 2daw s ARG 55 CO 0.53 0.40 -0.02 -1.91 -0.81 0.00 0.00 175.30 173.49 2daw n GLU 56 N 1.25 1.84 -2.84 5.12 2.13 -1.26 -4.74 120.64 122.14 2daw n GLU 56 Ca -0.18 0.02 -0.41 0.00 0.66 0.00 0.00 57.16 57.24 2daw n GLU 56 Cb 0.53 -1.15 -0.04 0.00 0.27 0.00 0.00 31.44 31.06 2daw n GLU 56 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2daw s ALA 57 N -2.14 3.30 -0.22 4.31 0.00 -1.26 -4.97 121.76 120.78 2daw s ALA 57 Ca -0.06 0.32 -0.35 0.00 0.00 0.00 0.00 51.96 51.87 2daw s ALA 57 Cb 0.02 -3.22 -0.12 0.00 0.00 0.00 0.00 23.12 19.80 2daw s ALA 57 CO 0.21 -0.31 1.98 -0.11 0.00 0.00 0.00 175.76 177.53 2daw n LEU 58 N 4.22 2.84 -4.70 0.00 -0.00 -1.26 -4.94 117.00 113.15 2daw n LEU 58 Ca 0.04 0.76 -0.29 0.00 -0.00 0.00 0.00 56.01 56.52 2daw n LEU 58 Cb 0.50 -1.31 0.15 0.00 -0.00 0.00 0.00 43.42 42.77 2daw n LEU 58 CO 0.50 -0.38 0.66 -2.16 -0.00 0.00 0.00 177.39 176.01 2daw s PRO 59 N 4.82 0.93 0.58 1.96 0.04 -1.26 -5.01 135.00 137.06 2daw s PRO 59 Ca 1.00 0.70 -0.18 0.00 0.04 0.00 0.00 61.00 62.56 2daw s PRO 59 Cb -0.79 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 2daw s PRO 59 CO 0.52 -2.44 1.12 -1.25 0.04 0.00 0.00 177.00 175.00 2daw s PRO 60 N -4.95 3.18 0.93 0.56 0.04 -1.26 -5.00 135.00 128.50 2daw s PRO 60 Ca 0.64 1.54 -0.15 0.00 0.04 0.00 0.00 61.00 63.07 2daw s PRO 60 Cb -0.18 -1.99 0.17 0.00 0.04 0.00 0.00 34.50 32.54 2daw s PRO 60 CO 0.57 -0.98 1.24 -1.59 0.04 0.00 0.00 177.00 176.28 2daw s LYS 61 N -3.55 0.91 -0.63 4.56 -2.85 -1.26 -4.77 119.74 112.14 2daw s LYS 61 Ca 0.71 -0.15 -0.17 0.00 -1.00 0.00 0.00 55.97 55.36 2daw s LYS 61 Cb -0.23 -1.85 0.13 0.00 -2.06 0.00 0.00 37.83 33.82 2daw s LYS 61 CO 0.32 -2.28 0.67 0.42 0.10 0.00 0.00 175.35 174.58 2daw s ILE 62 N -3.65 5.05 -0.10 3.79 1.01 -1.24 -4.92 121.20 121.14 2daw s ILE 62 Ca 0.69 -1.39 0.03 0.00 0.00 0.00 0.00 60.65 59.98 2daw s ILE 62 Cb -0.08 -4.46 -0.01 0.00 0.01 0.00 0.00 42.46 37.93 2daw s ILE 62 CO 0.52 -1.06 -0.20 -0.70 0.00 0.00 0.00 174.94 173.50 2daw s GLU 63 N 2.00 3.06 0.34 2.79 2.12 -1.26 -3.14 118.70 124.60 2daw s GLU 63 Ca 0.11 -0.81 -0.13 0.00 0.36 0.00 0.00 54.97 54.50 2daw s GLU 63 Cb -0.23 -2.39 0.03 0.00 0.26 0.00 0.00 34.13 31.80 2daw s GLU 63 CO 0.02 0.24 0.67 -0.59 -0.54 0.00 0.00 175.26 175.07 2daw s PHE 64 N 0.21 0.31 -0.12 5.30 -0.71 -1.06 -3.99 117.98 117.92 2daw s PHE 64 Ca -0.13 -0.82 0.03 0.00 -1.04 0.00 0.00 56.93 54.97 2daw s PHE 64 Cb -0.16 0.54 0.00 0.00 -1.21 0.00 0.00 43.02 42.18 2daw s PHE 64 CO 0.07 -1.36 -0.22 0.08 -1.34 0.00 0.00 175.22 172.46 2daw s VAL 65 N -2.93 2.21 -0.19 -2.49 1.01 -1.15 -1.57 120.40 115.29 2daw s VAL 65 Ca 0.19 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 2daw s VAL 65 Cb -0.04 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2daw s VAL 65 CO 0.12 0.55 0.01 -0.63 0.00 0.00 0.00 175.10 175.16 2daw s ILE 66 N 0.51 4.18 -0.23 2.22 1.01 0.25 -2.80 121.20 126.33 2daw s ILE 66 Ca -0.14 -0.24 -0.21 0.00 0.00 0.00 0.00 60.65 60.06 2daw s ILE 66 Cb -0.17 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 2daw s ILE 66 CO 0.05 0.44 0.68 -0.89 0.00 0.00 0.00 174.94 175.22 2daw s THR 67 N 0.77 4.96 -0.61 2.92 2.01 -1.10 -0.96 115.64 123.63 2daw s THR 67 Ca 0.01 1.25 -0.21 0.00 0.31 0.00 0.00 61.69 63.05 2daw s THR 67 Cb -0.14 -3.98 0.08 0.00 0.01 0.00 0.00 72.50 68.47 2daw s THR 67 CO 0.02 0.03 0.83 -0.76 -0.69 0.00 0.00 174.62 174.05 2daw s LEU 68 N 2.39 4.80 -1.31 4.42 2.01 -0.76 -4.95 118.68 125.28 2daw s LEU 68 Ca 0.29 -1.10 -0.18 0.00 0.01 0.00 0.00 54.13 53.16 2daw s LEU 68 Cb -0.16 -2.41 0.04 0.00 0.01 0.00 0.00 46.19 43.68 2daw s LEU 68 CO 0.09 -1.24 1.88 1.67 1.01 0.00 0.00 176.35 179.76 2daw n GLN 69 N 7.01 2.93 -1.68 1.70 0.00 -1.26 -3.75 117.38 122.33 2daw n GLN 69 Ca -0.06 -3.00 -0.47 0.00 -0.00 0.00 0.00 57.00 53.47 2daw n GLN 69 Cb 0.44 -3.45 -0.04 0.00 0.00 0.00 0.00 30.24 27.19 2daw n GLN 69 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 2daw n ILE 70 N 6.18 0.49 -0.25 1.69 2.08 -1.25 -4.86 119.36 123.44 2daw n ILE 70 Ca 0.49 -0.09 0.03 0.00 0.56 0.00 0.00 62.75 63.75 2daw n ILE 70 Cb 0.44 -1.87 0.16 0.00 -0.75 0.00 0.00 39.64 37.62 2daw n ILE 70 CO 0.00 0.00 0.00 1.05 0.56 0.00 0.00 176.55 178.16 2daw h GLU 71 N 8.74 0.50 -1.61 0.38 4.11 -1.93 -3.32 114.58 121.45 2daw h GLU 71 Ca -0.48 -0.03 0.08 0.00 0.07 0.00 0.00 59.36 59.01 2daw h GLU 71 Cb 1.26 -0.11 -0.26 0.00 0.50 0.00 0.00 28.75 30.14 2daw h GLU 71 CO 0.94 0.33 0.37 -1.83 0.07 0.00 0.00 179.01 178.89 2daw s GLU 72 N -6.04 0.46 0.14 1.06 -1.05 -1.26 -3.66 118.70 108.35 2daw s GLU 72 Ca -0.13 0.70 -0.31 0.00 -0.15 0.00 0.00 54.97 55.09 2daw s GLU 72 Cb 0.19 0.14 -0.08 0.00 -0.44 0.00 0.00 34.13 33.94 2daw s GLU 72 CO 0.76 -0.08 1.34 -1.25 0.95 0.00 0.00 175.26 176.98 2daw s PRO 73 N 0.99 4.36 -0.57 -4.83 0.04 -1.26 -4.61 135.00 129.11 2daw s PRO 73 Ca -0.05 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 2daw s PRO 73 Cb -0.04 -3.23 -0.12 0.00 0.04 0.00 0.00 34.50 31.14 2daw s PRO 73 CO -0.12 -0.35 2.42 1.17 0.04 0.00 0.00 177.00 180.16 2daw n LYS 74 N 3.41 0.82 -3.48 4.56 4.81 -1.24 -4.79 118.16 122.25 2daw n LYS 74 Ca 0.09 0.10 -0.13 0.00 -0.87 0.00 0.00 58.31 57.50 2daw n LYS 74 Cb 0.43 -2.67 -0.04 0.00 0.02 0.00 0.00 35.03 32.76 2daw n LYS 74 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 2daw n VAL 75 N 7.65 0.00 -4.99 3.15 0.24 -1.25 -5.05 118.33 118.08 2daw n VAL 75 Ca 0.45 -1.57 -0.28 0.00 -2.04 0.00 0.00 64.34 60.91 2daw n VAL 75 Cb 0.32 0.84 -0.16 0.00 -1.47 0.00 0.00 33.84 33.37 2daw n VAL 75 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2daw s LYS 76 N -2.82 1.91 -0.09 7.34 2.20 -1.26 -3.85 119.74 123.17 2daw s LYS 76 Ca 0.26 -0.72 -0.03 0.00 -0.36 0.00 0.00 55.97 55.12 2daw s LYS 76 Cb 0.01 -1.71 0.04 0.00 -1.51 0.00 0.00 37.83 34.65 2daw s LYS 76 CO 0.18 0.35 0.05 0.42 -0.36 0.00 0.00 175.35 175.99 2daw s ILE 77 N -0.20 0.07 -0.39 5.43 1.01 -1.25 -4.74 121.20 121.13 2daw s ILE 77 Ca 0.01 0.15 -0.27 0.00 0.00 0.00 0.00 60.65 60.54 2daw s ILE 77 Cb -0.11 -0.40 0.02 0.00 0.01 0.00 0.00 42.46 41.98 2daw s ILE 77 CO 0.01 0.07 0.98 -1.81 0.00 0.00 0.00 174.94 174.20 2daw s ASP 78 N 2.09 6.68 -0.50 3.58 1.11 -1.17 -1.83 116.67 126.64 2daw s ASP 78 Ca 0.04 0.57 -0.14 0.00 0.18 0.00 0.00 52.55 53.20 2daw s ASP 78 Cb -0.13 -2.49 0.11 0.00 1.07 0.00 0.00 42.92 41.48 2daw s ASP 78 CO -0.05 -0.95 0.42 -0.22 1.18 0.00 0.00 175.17 175.55 2daw s LEU 79 N 3.69 5.84 -0.88 1.23 2.96 -0.13 -2.78 118.68 128.61 2daw s LEU 79 Ca 0.41 -1.68 -0.25 0.00 -0.22 0.00 0.00 54.13 52.39 2daw s LEU 79 Cb -0.11 -2.14 0.04 0.00 0.50 0.00 0.00 46.19 44.48 2daw s LEU 79 CO 0.21 -0.74 1.36 -1.10 -1.32 0.00 0.00 176.35 174.77 2daw s GLN 80 N 1.54 3.38 0.05 1.98 -0.21 0.17 -0.58 119.66 126.00 2daw s GLN 80 Ca 0.04 -0.67 -0.16 0.00 0.02 0.00 0.00 55.36 54.59 2daw s GLN 80 Cb -0.27 -4.76 -0.06 0.00 1.00 0.00 0.00 33.01 28.92 2daw s GLN 80 CO 0.03 -2.18 0.48 0.54 -2.12 0.00 0.00 175.29 172.04 2daw s VAL 81 N 5.37 4.92 -0.20 1.09 0.11 -0.61 -2.45 120.40 128.63 2daw s VAL 81 Ca 0.40 0.92 -0.05 0.00 -2.93 0.00 0.00 61.98 60.32 2daw s VAL 81 Cb -0.04 -3.77 0.07 0.00 -1.53 0.00 0.00 36.38 31.12 2daw s VAL 81 CO 0.03 0.49 0.11 -0.89 -3.33 0.00 0.00 175.10 171.51 2daw s THR 82 N -1.18 -0.11 -0.52 5.04 2.01 -1.01 -2.57 115.64 117.30 2daw s THR 82 Ca 0.29 -0.30 -0.10 0.00 0.31 0.00 0.00 61.69 61.88 2daw s THR 82 Cb -0.17 -0.68 0.13 0.00 0.01 0.00 0.00 72.50 71.79 2daw s THR 82 CO 0.17 -0.38 0.40 -0.04 -0.69 0.00 0.00 174.62 174.08 2daw s MET 83 N 2.15 2.63 0.92 4.92 -1.94 -1.19 -2.99 119.30 123.80 2daw s MET 83 Ca 0.04 -1.85 -0.12 0.00 -1.71 0.00 0.00 55.69 52.05 2daw s MET 83 Cb -0.16 -4.01 0.14 0.00 2.01 0.00 0.00 34.83 32.82 2daw s MET 83 CO -0.16 -1.22 1.09 -1.25 -0.01 0.00 0.00 175.02 173.47 2daw s PRO 84 N 1.23 1.04 0.62 2.03 0.04 -1.26 -3.60 135.00 135.09 2daw s PRO 84 Ca 0.07 0.74 0.25 0.00 0.04 0.00 0.00 61.00 62.10 2daw s PRO 84 Cb -0.25 -1.79 1.19 0.00 0.04 0.00 0.00 34.50 33.69 2daw s PRO 84 CO -0.01 -2.37 1.64 0.45 0.04 0.00 0.00 177.00 176.75 2daw h HIS 85 N -1.64 0.00 0.09 0.56 3.86 -1.97 -1.97 115.15 114.08 2daw h HIS 85 Ca -0.51 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.70 2daw h HIS 85 Cb 1.30 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.77 2daw h HIS 85 CO 0.39 0.00 -0.04 0.77 0.86 0.00 0.00 177.93 179.91 2daw h SER 86 N 0.00 -0.10 -1.37 2.45 0.02 -1.95 -3.41 113.55 109.19 2daw h SER 86 Ca 0.21 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.74 2daw h SER 86 Cb 1.61 0.03 0.12 0.00 0.14 0.00 0.00 62.40 64.30 2daw h SER 86 CO -0.00 0.08 -0.79 0.00 -1.14 0.00 0.00 176.83 174.98 2daw n TYR 87 N -3.13 -1.93 0.22 3.45 4.19 -0.74 -2.74 117.16 116.48 2daw n TYR 87 Ca -0.01 0.35 0.09 0.00 3.31 0.00 0.00 57.90 61.64 2daw n TYR 87 Cb 0.05 -1.21 0.49 0.00 0.49 0.00 0.00 39.34 39.15 2daw n TYR 87 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 2daw h PRO 88 N 0.05 0.00 -0.71 2.98 0.13 -1.84 -3.43 132.00 129.17 2daw h PRO 88 Ca -0.29 0.00 0.24 0.00 -0.87 0.00 0.00 66.00 65.08 2daw h PRO 88 Cb 1.03 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.03 2daw h PRO 88 CO 0.31 0.25 0.17 0.66 -0.23 0.00 0.00 178.00 179.15 2daw n TYR 89 N -3.53 0.61 -3.93 1.56 4.02 -1.11 -4.16 117.16 110.62 2daw n TYR 89 Ca -0.01 0.85 -0.32 0.00 -0.01 0.00 0.00 57.90 58.41 2daw n TYR 89 Cb 0.40 -1.13 -0.05 0.00 -0.02 0.00 0.00 39.34 38.54 2daw n TYR 89 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2daw s LEU 90 N -9.63 4.30 -0.61 7.72 0.20 -1.25 -4.57 118.68 114.85 2daw s LEU 90 Ca -0.08 0.29 -0.26 0.00 0.69 0.00 0.00 54.13 54.76 2daw s LEU 90 Cb 0.22 -2.70 -0.03 0.00 -0.43 0.00 0.00 46.19 43.25 2daw s LEU 90 CO 0.55 0.23 2.00 0.00 -0.29 0.00 0.00 176.35 178.84 2daw s ALA 91 N -1.38 2.00 1.13 5.97 0.00 -1.26 -3.94 121.76 124.28 2daw s ALA 91 Ca 0.30 -0.56 -0.16 0.00 0.00 0.00 0.00 51.96 51.53 2daw s ALA 91 Cb -0.13 -4.33 0.22 0.00 0.00 0.00 0.00 23.12 18.88 2daw s ALA 91 CO 0.22 -4.11 0.45 1.47 0.00 0.00 0.00 175.76 173.78 2daw n LEU 92 N 13.63 -1.20 -4.07 0.00 -0.00 -1.26 -5.00 117.00 119.09 2daw n LEU 92 Ca 0.25 -0.47 -0.31 0.00 -0.00 0.00 0.00 56.01 55.49 2daw n LEU 92 Cb 0.52 -0.85 -0.16 0.00 -0.00 0.00 0.00 43.42 42.93 2daw n LEU 92 CO 0.70 -3.56 -0.51 -1.58 -0.00 0.00 0.00 177.39 172.45 2daw s GLN 93 N -3.86 2.51 0.09 1.47 0.74 -1.16 -5.01 119.66 114.43 2daw s GLN 93 Ca 0.46 -0.65 0.10 0.00 0.05 0.00 0.00 55.36 55.31 2daw s GLN 93 Cb -0.09 -2.17 -0.03 0.00 1.10 0.00 0.00 33.01 31.82 2daw s GLN 93 CO 0.42 -0.15 -0.26 -0.51 -0.55 0.00 0.00 175.29 174.25 2daw s LEU 94 N 1.20 2.25 -0.10 3.68 1.43 -1.26 -2.40 118.68 123.49 2daw s LEU 94 Ca -0.00 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.38 2daw s LEU 94 Cb -0.14 -1.19 0.05 0.00 0.03 0.00 0.00 46.19 44.94 2daw s LEU 94 CO -0.07 0.19 0.22 0.12 0.23 0.00 0.00 176.35 177.05 2daw s PHE 95 N -0.96 -0.31 -0.06 0.29 5.36 -1.03 -4.92 117.98 116.36 2daw s PHE 95 Ca 0.12 0.78 0.04 0.00 -0.96 0.00 0.00 56.93 56.91 2daw s PHE 95 Cb -0.10 -0.06 -0.02 0.00 -0.34 0.00 0.00 43.02 42.50 2daw s PHE 95 CO 0.04 -0.28 -0.17 0.20 -1.46 0.00 0.00 175.22 173.56 2daw s GLY 96 N 1.86 1.47 -0.01 13.12 0.00 -1.26 -0.65 107.32 121.84 2daw s GLY 96 Ca -0.03 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.70 2daw s GLY 96 CO -0.08 -0.70 -0.01 0.50 0.00 0.00 0.00 173.10 172.81 2daw s ARG 97 N -0.51 0.21 -0.06 2.90 0.52 -1.12 -4.93 118.95 115.96 2daw s ARG 97 Ca 0.07 -0.00 -0.03 0.00 -0.52 0.00 0.00 55.73 55.25 2daw s ARG 97 Cb -0.12 -0.30 0.04 0.00 0.52 0.00 0.00 34.95 35.09 2daw s ARG 97 CO 0.01 -0.04 0.08 0.45 0.02 0.00 0.00 175.30 175.83 2daw s SER 98 N 0.43 1.23 0.31 0.23 0.15 -1.26 -3.02 113.70 111.78 2daw s SER 98 Ca -0.04 0.03 0.12 0.00 0.70 0.00 0.00 55.95 56.76 2daw s SER 98 Cb -0.07 -0.09 1.02 0.00 -1.71 0.00 0.00 66.02 65.18 2daw s SER 98 CO -0.01 -0.26 1.43 -1.20 1.20 0.00 0.00 173.24 174.40 2daw n SER 99 N 5.30 0.15 0.17 5.45 7.64 -1.26 -0.92 113.62 130.16 2daw n SER 99 Ca -0.04 1.52 -0.07 0.00 1.01 0.00 0.00 58.87 61.29 2daw n SER 99 Cb 0.50 -0.67 -0.03 0.00 -1.01 0.00 0.00 64.21 63.00 2daw n SER 99 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2daw h GLU 100 N 0.00 -0.45 -5.98 1.43 4.39 -1.95 -3.45 114.58 108.57 2daw h GLU 100 Ca 0.69 0.03 -0.78 0.00 0.34 0.00 0.00 59.36 59.64 2daw h GLU 100 Cb 1.69 0.10 0.05 0.00 -0.10 0.00 0.00 28.75 30.50 2daw h GLU 100 CO -0.76 -0.30 0.02 1.28 -1.16 0.00 0.00 179.01 178.09 2daw n LEU 101 N -4.04 -0.09 -4.94 1.33 4.77 -0.10 -4.93 117.00 109.01 2daw n LEU 101 Ca -0.06 1.15 -0.24 0.00 -0.03 0.00 0.00 56.01 56.83 2daw n LEU 101 Cb 0.19 -0.92 -0.00 0.00 -2.33 0.00 0.00 43.42 40.35 2daw n LEU 101 CO 0.14 -1.98 0.25 -1.81 -1.33 0.00 0.00 177.39 172.66 2daw s ASP 102 N -0.07 6.19 0.00 -1.43 1.11 -1.26 -4.70 116.67 116.51 2daw s ASP 102 Ca 0.89 0.50 0.00 0.00 0.18 0.00 0.00 52.55 54.12 2daw s ASP 102 Cb -1.24 -1.96 0.00 0.00 1.07 0.00 0.00 42.92 40.78 2daw s ASP 102 CO 0.57 -0.43 0.63 -1.14 1.18 0.00 0.00 175.17 175.98 2daw n ARG 103 N -1.93 0.00 -0.35 8.23 3.00 -1.26 0.20 116.66 124.54 2daw n ARG 103 Ca -0.03 0.63 0.05 0.00 -0.00 0.00 0.00 57.85 58.51 2daw n ARG 103 Cb 0.56 -1.00 0.13 0.00 0.00 0.00 0.00 32.46 32.15 2daw n ARG 103 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2daw n HIS 104 N -2.20 0.33 0.00 -0.14 -0.00 -1.26 -0.67 115.22 111.28 2daw n HIS 104 Ca 0.00 1.19 0.00 0.00 0.46 0.00 0.00 57.72 59.37 2daw n HIS 104 Cb 0.00 -1.05 0.00 0.00 -0.12 0.00 0.00 29.99 28.82 2daw n HIS 104 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2daw n GLN 105 N -5.58 0.00 -0.31 1.57 6.02 0.13 -0.77 117.38 118.43 2daw n GLN 105 Ca 0.15 0.53 0.30 0.00 -0.01 0.00 0.00 57.00 57.97 2daw n GLN 105 Cb 0.48 -1.48 0.56 0.00 1.02 0.00 0.00 30.24 30.81 2daw n GLN 105 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2daw n GLN 106 N -2.03 -0.06 0.15 -1.09 6.02 0.74 0.22 117.38 121.33 2daw n GLN 106 Ca 0.00 1.36 -0.13 0.00 -0.01 0.00 0.00 57.00 58.21 2daw n GLN 106 Cb 0.00 -2.42 -0.08 0.00 1.02 0.00 0.00 30.24 28.76 2daw n GLN 106 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2daw h LEU 107 N 0.00 -0.32 -2.03 1.08 5.85 -0.66 0.05 115.31 119.28 2daw h LEU 107 Ca 0.81 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 59.37 2daw h LEU 107 Cb 2.13 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 43.24 2daw h LEU 107 CO -0.76 0.01 0.02 -0.07 -0.34 0.00 0.00 178.44 177.29 2daw h LEU 108 N -0.68 0.00 -0.02 2.25 3.38 0.19 0.15 115.31 120.58 2daw h LEU 108 Ca -0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 2daw h LEU 108 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2daw h LEU 108 CO 0.06 0.00 -0.30 0.25 0.09 0.00 0.00 178.44 178.54 2daw h LEU 109 N 0.00 0.31 0.35 1.67 5.85 -0.36 -3.04 115.31 120.08 2daw h LEU 109 Ca 0.01 -0.72 -0.02 0.00 0.84 0.00 0.00 57.88 57.99 2daw h LEU 109 Cb 0.05 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2daw h LEU 109 CO -0.00 0.98 -0.17 0.78 -0.34 0.00 0.00 178.44 179.70 2daw h ASN 110 N -0.34 -0.40 -0.98 1.25 2.35 -0.49 -2.15 115.58 114.82 2daw h ASN 110 Ca -0.03 0.01 0.27 0.00 -0.55 0.00 0.00 56.30 56.00 2daw h ASN 110 Cb 1.01 0.10 -0.18 0.00 0.05 0.00 0.00 38.32 39.30 2daw h ASN 110 CO 0.06 -0.13 0.03 1.17 -1.65 0.00 0.00 177.43 176.91 2daw n LYS 111 N -4.11 -0.08 -0.12 0.81 4.81 0.48 0.52 118.16 120.47 2daw n LYS 111 Ca -0.06 1.47 -0.10 0.00 -0.87 0.00 0.00 58.31 58.74 2daw n LYS 111 Cb 0.18 -2.34 -0.02 0.00 0.02 0.00 0.00 35.03 32.88 2daw n LYS 111 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2daw h GLY 112 N 0.00 0.66 0.87 3.14 0.00 -1.58 -3.00 103.07 103.15 2daw h GLY 112 Ca 0.60 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2daw h GLY 112 CO -0.92 0.43 -0.30 -2.00 0.00 0.00 0.00 176.54 173.76 2daw h LEU 113 N 0.43 -0.70 -0.94 3.11 5.85 0.77 -1.52 115.31 122.30 2daw h LEU 113 Ca 0.10 -0.02 0.16 0.00 0.84 0.00 0.00 57.88 58.97 2daw h LEU 113 Cb 0.43 0.18 -0.16 0.00 0.37 0.00 0.00 40.66 41.47 2daw h LEU 113 CO 0.01 -0.41 -0.33 0.71 -0.34 0.00 0.00 178.44 178.09 2daw h THR 114 N -0.97 0.03 0.04 1.05 1.35 -0.69 0.15 112.91 113.87 2daw h THR 114 Ca -0.08 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.77 2daw h THR 114 Cb 0.68 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.13 2daw h THR 114 CO 0.14 0.00 -0.02 -1.28 -0.25 0.00 0.00 175.52 174.11 2daw h SER 115 N -0.02 -0.04 -0.46 5.36 0.87 -1.48 -0.97 113.55 116.82 2daw h SER 115 Ca 0.38 -0.12 0.13 0.00 -1.23 0.00 0.00 61.79 60.95 2daw h SER 115 Cb 0.63 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 2daw h SER 115 CO -0.96 0.10 0.51 0.22 -0.53 0.00 0.00 176.83 176.16 2daw h TYR 116 N -0.18 0.00 0.10 2.24 3.20 0.27 0.14 116.97 122.75 2daw h TYR 116 Ca -0.01 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 61.54 2daw h TYR 116 Cb 0.16 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 2daw h TYR 116 CO -0.03 0.00 -1.73 0.82 -1.64 0.00 0.00 178.16 175.58 2daw h ILE 117 N 0.00 0.91 0.00 1.81 1.08 -0.39 -3.33 117.51 117.59 2daw h ILE 117 Ca 0.22 -2.61 0.00 0.00 -0.39 0.00 0.00 64.86 62.07 2daw h ILE 117 Cb 1.23 2.62 0.00 0.00 -3.07 0.00 0.00 36.82 37.59 2daw h ILE 117 CO -0.00 0.78 0.00 1.23 -0.69 0.00 0.00 178.15 179.47 2daw h GLY 118 N 1.78 0.00 0.64 5.37 0.00 0.63 -2.66 103.07 108.83 2daw h GLY 118 Ca -0.31 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2daw h GLY 118 CO 0.12 0.00 -0.08 -0.91 0.00 0.00 0.00 176.54 175.67 2daw h THR 119 N 0.00 0.95 -1.00 4.70 1.35 -1.59 -3.45 112.91 113.87 2daw h THR 119 Ca 0.00 -0.72 -0.50 0.00 -0.55 0.00 0.00 66.41 64.65 2daw h THR 119 Cb 0.01 1.37 0.10 0.00 -1.73 0.00 0.00 68.15 67.90 2daw h THR 119 CO 0.00 0.16 -0.55 0.49 -0.25 0.00 0.00 175.52 175.37 2daw n PHE 120 N -5.03 -0.92 -2.46 4.73 3.01 -1.00 -4.90 117.46 110.87 2daw n PHE 120 Ca -0.09 0.63 -0.31 0.00 1.01 0.00 0.00 57.45 58.69 2daw n PHE 120 Cb 0.23 -1.44 -0.02 0.00 -0.01 0.00 0.00 39.48 38.24 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 -0.77 6.47 -0.25 4.37 1.11 -1.26 -5.00 116.67 121.35 2daw s ASP 121 Ca 0.48 1.33 -0.29 0.00 0.18 0.00 0.00 52.55 54.25 2daw s ASP 121 Cb -0.61 -2.41 -0.02 0.00 1.07 0.00 0.00 42.92 40.94 2daw s ASP 121 CO 0.45 -0.58 1.63 -2.16 1.18 0.00 0.00 175.17 175.69 2daw s PRO 122 N -4.29 3.70 0.00 8.23 0.04 -1.26 -3.58 135.00 137.83 2daw s PRO 122 Ca 0.54 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2daw s PRO 122 Cb -0.10 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.38 2daw s PRO 122 CO 0.37 -1.41 0.00 0.41 0.04 0.00 0.00 177.00 176.41 2daw n GLY 123 N 4.82 3.66 3.91 0.56 0.00 -1.26 -4.82 105.19 112.06 2daw n GLY 123 Ca 0.19 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 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 3.26 0.60 1.61 1.03 -1.24 -4.82 118.70 119.15 2daw s GLU 124 Ca 0.00 0.10 -0.18 0.00 0.03 0.00 0.00 54.97 54.92 2daw s GLU 124 Cb 0.00 -2.33 -0.03 0.00 -0.80 0.00 0.00 34.13 30.97 2daw s GLU 124 CO 0.00 -0.43 1.15 -0.51 -1.33 0.00 0.00 175.26 174.13 2daw s LEU 125 N -4.85 3.60 0.00 1.83 1.43 -1.26 -4.70 118.68 114.72 2daw s LEU 125 Ca 0.50 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 2daw s LEU 125 Cb -0.10 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.54 2daw s LEU 125 CO 0.45 -1.49 0.00 0.00 0.23 0.00 0.00 176.35 175.54 2daw h VAL 127 N 0.00 0.72 -0.67 0.00 3.04 -1.98 0.14 116.25 117.50 2daw h VAL 127 Ca 0.00 -0.19 0.11 0.00 -1.01 0.00 0.00 66.70 65.61 2daw h VAL 127 Cb 0.71 0.11 -0.04 0.00 -2.01 0.00 0.00 31.29 30.06 2daw h VAL 127 CO 0.00 0.10 0.45 0.00 -1.01 0.00 0.00 177.57 177.11 2daw h ALA 129 N 1.67 -0.04 -1.00 0.00 0.00 -1.04 -3.29 119.26 115.56 2daw h ALA 129 Ca 0.32 -0.35 0.40 0.00 0.00 0.00 0.00 54.91 55.28 2daw h ALA 129 Cb 0.63 0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.25 2daw h ALA 129 CO -0.10 -0.13 0.49 0.00 0.00 0.00 0.00 179.25 179.52 2daw h ALA 130 N 0.05 2.07 0.42 0.00 0.00 -1.13 0.22 119.26 120.89 2daw h ALA 130 Ca -0.00 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2daw h ALA 130 Cb 0.72 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2daw h ALA 130 CO 0.01 -0.91 -0.20 0.82 0.00 0.00 0.00 179.25 178.96 2daw h ILE 131 N 0.01 0.00 0.17 0.00 2.04 -1.58 -2.30 117.51 115.85 2daw h ILE 131 Ca 0.82 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 66.66 2daw h ILE 131 Cb 2.14 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 2daw h ILE 131 CO -0.78 0.00 -0.38 -0.61 0.00 0.00 0.00 178.15 176.38 2daw h GLN 132 N -0.60 -0.63 -0.74 2.37 5.75 -1.18 -2.53 115.11 117.54 2daw h GLN 132 Ca -0.06 0.04 0.07 0.00 -0.15 0.00 0.00 58.65 58.55 2daw h GLN 132 Cb 0.43 0.14 -0.09 0.00 1.07 0.00 0.00 27.48 29.03 2daw h GLN 132 CO 0.09 -0.42 -0.44 2.35 -2.65 0.00 0.00 178.83 177.76 2daw h TRP 133 N -0.65 -1.43 -0.26 3.99 7.01 -0.73 0.59 115.95 124.46 2daw h TRP 133 Ca 0.01 0.10 0.03 0.00 2.11 0.00 0.00 58.89 61.14 2daw h TRP 133 Cb 0.66 0.72 -0.06 0.00 -2.10 0.00 0.00 29.16 28.38 2daw h TRP 133 CO -0.31 -0.28 -0.39 -0.07 -2.79 0.00 0.00 178.44 174.60 2daw h LEU 134 N -0.01 -1.30 -0.57 0.65 3.38 -1.23 -0.81 115.31 115.43 2daw h LEU 134 Ca 0.12 0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.32 2daw h LEU 134 Cb 0.31 0.53 -0.09 0.00 0.09 0.00 0.00 40.66 41.50 2daw h LEU 134 CO -0.70 -0.29 -0.55 1.56 0.09 0.00 0.00 178.44 178.55 2daw h GLN 135 N -0.30 -0.27 -0.88 1.13 4.20 -0.85 0.26 115.11 118.40 2daw h GLN 135 Ca 0.05 0.02 0.23 0.00 0.06 0.00 0.00 58.65 59.01 2daw h GLN 135 Cb 0.42 0.06 -0.14 0.00 0.30 0.00 0.00 27.48 28.13 2daw h GLN 135 CO -0.40 -0.18 0.27 0.22 -0.67 0.00 0.00 178.83 178.07 2daw h ASP 136 N -0.28 0.08 -2.28 1.46 1.82 -0.33 -1.98 116.42 114.90 2daw h ASP 136 Ca 0.11 0.19 -0.62 0.00 -0.39 0.00 0.00 57.03 56.31 2daw h ASP 136 Cb 0.55 0.23 -0.40 0.00 0.68 0.00 0.00 39.33 40.39 2daw h ASP 136 CO -0.69 -0.12 -0.40 -0.46 -1.61 0.00 0.00 179.24 175.95 2daw n ASN 137 N -5.18 4.90 -0.04 2.28 0.23 0.53 -4.78 115.26 113.20 2daw n ASN 137 Ca 0.21 -3.69 -0.06 0.00 -0.53 0.00 0.00 54.58 50.52 2daw n ASN 137 Cb 0.68 -0.65 -0.02 0.00 -2.08 0.00 0.00 39.78 37.71 2daw n ASN 137 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2daw n SER 138 N -0.22 1.63 -0.20 0.53 2.88 0.60 -4.69 113.62 114.15 2daw n SER 138 Ca 0.33 0.26 -0.01 0.00 -1.33 0.00 0.00 58.87 58.12 2daw n SER 138 Cb 0.37 -0.59 0.09 0.00 -0.75 0.00 0.00 64.21 63.33 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 -0.63 0.76 -1.09 -1.46 0.00 -1.81 -0.93 119.26 114.09 2daw h ALA 139 Ca -0.00 0.06 0.32 0.00 0.00 0.00 0.00 54.91 55.29 2daw h ALA 139 Cb 0.63 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2daw h ALA 139 CO -0.00 -0.15 1.18 1.03 0.00 0.00 0.00 179.25 181.31 2daw h SER 140 N 0.45 0.00 0.01 0.00 0.87 -1.89 0.45 113.55 113.44 2daw h SER 140 Ca 0.28 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 60.58 2daw h SER 140 Cb 0.30 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.23 2daw h SER 140 CO -0.26 0.00 -1.46 -1.22 -0.53 0.00 0.00 176.83 173.36 2daw n TYR 141 N -3.36 0.91 -0.19 2.24 4.02 -0.37 -4.35 117.16 116.06 2daw n TYR 141 Ca 0.24 0.38 -0.01 0.00 -0.01 0.00 0.00 57.90 58.50 2daw n TYR 141 Cb 1.52 -1.09 0.09 0.00 -0.02 0.00 0.00 39.34 39.84 2daw n TYR 141 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 2daw h PHE 142 N -0.94 0.34 -0.05 -0.72 -1.00 -0.06 -3.41 116.94 111.10 2daw h PHE 142 Ca -0.40 0.03 -0.62 0.00 2.81 0.00 0.00 57.97 59.79 2daw h PHE 142 Cb 1.38 -0.07 -0.07 0.00 3.61 0.00 0.00 35.95 40.81 2daw h PHE 142 CO 0.07 0.08 1.56 1.28 -1.61 0.00 0.00 178.31 179.70 2daw n LEU 143 N -5.02 0.56 -3.67 1.54 4.77 0.19 -4.85 117.00 110.52 2daw n LEU 143 Ca 0.08 0.39 -0.10 0.00 -0.03 0.00 0.00 56.01 56.34 2daw n LEU 143 Cb 0.26 -0.93 -0.04 0.00 -2.33 0.00 0.00 43.42 40.38 2daw n LEU 143 CO 0.22 -0.75 0.22 0.54 -1.33 0.00 0.00 177.39 176.29 2daw s ASN 144 N 7.73 -0.27 -0.57 -1.43 4.22 -1.26 -5.02 114.94 118.34 2daw s ASN 144 Ca 1.28 -0.38 -0.27 0.00 -2.14 0.00 0.00 52.86 51.35 2daw s ASN 144 Cb -1.34 0.53 -0.02 0.00 1.28 0.00 0.00 41.25 41.70 2daw s ASN 144 CO 0.56 -0.95 1.86 -0.13 -2.04 0.00 0.00 177.10 176.40 2daw s ARG 145 N -3.84 2.72 0.01 3.55 0.52 -1.26 -4.92 118.95 115.73 2daw s ARG 145 Ca 0.06 0.75 -0.19 0.00 -0.52 0.00 0.00 55.73 55.82 2daw s ARG 145 Cb 0.00 -4.36 0.04 0.00 0.52 0.00 0.00 34.95 31.15 2daw s ARG 145 CO -0.08 -2.61 0.42 -1.59 0.02 0.00 0.00 175.30 171.46 2daw s LYS 146 N 6.86 0.86 -0.06 3.54 0.00 -1.26 -5.17 119.74 124.51 2daw s LYS 146 Ca 0.70 -0.20 -0.02 0.00 0.00 0.00 0.00 55.97 56.44 2daw s LYS 146 Cb -0.14 0.39 0.04 0.00 0.00 0.00 0.00 37.83 38.11 2daw s LYS 146 CO 0.23 -0.27 0.13 -1.17 0.00 0.00 0.00 175.35 174.26 2daw s LEU 147 N -1.63 0.82 -0.26 2.77 0.20 -1.26 -5.13 118.68 114.20 2daw s LEU 147 Ca -0.09 0.26 0.02 0.00 0.69 0.00 0.00 54.13 55.00 2daw s LEU 147 Cb -0.02 0.30 0.07 0.00 -0.43 0.00 0.00 46.19 46.11 2daw s LEU 147 CO 0.02 -0.14 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.21 2daw s VAL 148 N 1.09 1.72 0.97 1.68 1.01 -1.26 -5.12 120.40 120.49 2daw s VAL 148 Ca -0.09 -1.47 -0.13 0.00 0.00 0.00 0.00 61.98 60.29 2daw s VAL 148 Cb -0.11 -2.01 0.17 0.00 0.00 0.00 0.00 36.38 34.43 2daw s VAL 148 CO -0.05 -0.19 1.13 -0.44 0.00 0.00 0.00 175.10 175.55 2daw s SER 149 N 1.28 2.96 -0.29 3.32 0.01 -1.26 -5.08 113.70 114.63 2daw s SER 149 Ca -0.03 0.99 -0.27 0.00 1.31 0.00 0.00 55.95 57.94 2daw s SER 149 Cb -0.19 -1.56 0.19 0.00 0.21 0.00 0.00 66.02 64.68 2daw s SER 149 CO -0.07 -2.90 1.41 -0.83 0.41 0.00 0.00 173.24 171.26 2daw s GLY 150 N -3.84 0.23 0.53 3.44 0.00 -1.26 -5.18 107.32 101.24 2daw s GLY 150 Ca 0.65 3.18 -0.09 0.00 0.00 0.00 0.00 44.72 48.46 2daw s GLY 150 CO 0.55 1.49 0.47 -1.55 0.00 0.00 0.00 173.10 174.06 2daw n PRO 151 N 0.98 -1.93 -4.39 2.90 -0.04 -1.26 -5.08 135.00 126.18 2daw n PRO 151 Ca -0.04 -0.76 -0.24 0.00 -0.04 0.00 0.00 63.50 62.42 2daw n PRO 151 Cb 0.58 -0.71 -0.09 0.00 -0.04 0.00 0.00 33.50 33.24 2daw n PRO 151 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2daw s SER 152 N -2.79 4.00 -0.03 3.54 0.15 -1.26 -5.09 113.70 112.23 2daw s SER 152 Ca 0.31 -0.84 -0.01 0.00 0.70 0.00 0.00 55.95 56.11 2daw s SER 152 Cb -0.03 -0.54 -0.00 0.00 -1.71 0.00 0.00 66.02 63.74 2daw s SER 152 CO 0.24 0.04 -0.03 0.28 1.20 0.00 0.00 173.24 174.96 2daw h SER 153 N 2.23 0.00 0.00 5.45 0.02 -2.10 -3.58 113.55 115.57 2daw h SER 153 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2daw h SER 153 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2daw h SER 153 CO 0.59 0.16 0.00 0.61 -1.14 0.00 0.00 176.83 177.05