#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 1.64 0.64 1.61 0.01 -1.26 -4.99 113.70 111.34 2daw s SER 2 Ca 0.00 -0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.10 2daw s SER 2 Cb 0.00 -0.27 0.09 0.00 0.21 0.00 0.00 66.02 66.05 2daw s SER 2 CO 0.00 -0.26 0.88 -0.94 0.41 0.00 0.00 173.24 173.33 2daw s SER 3 N 2.09 4.80 0.00 2.44 1.04 -1.26 -5.01 113.70 117.79 2daw s SER 3 Ca 0.04 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2daw s SER 3 Cb -0.13 -0.28 0.00 0.00 0.10 0.00 0.00 66.02 65.71 2daw s SER 3 CO -0.05 -1.52 0.00 0.61 0.98 0.00 0.00 173.24 173.26 2daw n GLY 4 N -2.56 -2.41 0.11 7.32 0.00 -1.26 -5.01 105.19 101.38 2daw n GLY 4 Ca 0.13 0.81 -0.12 0.00 0.00 0.00 0.00 46.02 46.83 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 -0.14 -4.52 1.61 0.87 -2.09 -3.47 113.55 105.81 2daw h SER 5 Ca 0.00 -0.40 -0.07 0.00 -1.23 0.00 0.00 61.79 60.09 2daw h SER 5 Cb 0.00 0.04 -0.20 0.00 -0.44 0.00 0.00 62.40 61.79 2daw h SER 5 CO 0.00 0.37 0.06 -0.55 -0.53 0.00 0.00 176.83 176.18 2daw s SER 6 N -5.51 -0.60 -0.03 6.23 0.15 -1.26 -5.18 113.70 107.50 2daw s SER 6 Ca -0.14 0.89 -0.21 0.00 0.70 0.00 0.00 55.95 57.19 2daw s SER 6 Cb 0.01 0.86 0.04 0.00 -1.71 0.00 0.00 66.02 65.22 2daw s SER 6 CO 0.57 -0.41 0.44 -0.83 1.20 0.00 0.00 173.24 174.22 2daw s GLY 7 N -0.51 -0.31 -0.17 9.45 0.00 -1.26 -4.99 107.32 109.53 2daw s GLY 7 Ca -0.06 0.69 -0.23 0.00 0.00 0.00 0.00 44.72 45.12 2daw s GLY 7 CO 0.05 0.43 0.43 1.98 0.00 0.00 0.00 173.10 176.00 2daw h MET 8 N 3.59 0.04 -4.50 2.90 1.85 -2.03 -3.46 114.93 113.31 2daw h MET 8 Ca -0.29 -0.07 -0.54 0.00 -0.61 0.00 0.00 59.70 58.20 2daw h MET 8 Cb 1.16 0.03 -0.35 0.00 0.43 0.00 0.00 31.60 32.87 2daw h MET 8 CO 0.39 1.03 -0.82 0.45 -0.40 0.00 0.00 176.91 177.57 2daw s SER 9 N -6.70 2.08 0.50 1.39 0.15 -1.26 -5.14 113.70 104.72 2daw s SER 9 Ca -0.24 -0.34 0.04 0.00 0.70 0.00 0.00 55.95 56.11 2daw s SER 9 Cb 0.03 -0.90 0.03 0.00 -1.71 0.00 0.00 66.02 63.46 2daw s SER 9 CO 0.65 -0.02 0.70 0.00 1.20 0.00 0.00 173.24 175.77 2daw s ALA 10 N 1.07 4.15 0.11 5.45 0.00 -1.26 -5.04 121.76 126.24 2daw s ALA 10 Ca -0.06 -1.47 -0.30 0.00 0.00 0.00 0.00 51.96 50.12 2daw s ALA 10 Cb -0.15 -1.90 -0.07 0.00 0.00 0.00 0.00 23.12 21.01 2daw s ALA 10 CO -0.01 -0.57 1.22 0.45 0.00 0.00 0.00 175.76 176.84 2daw s SER 11 N -4.40 7.05 0.31 0.00 0.15 -1.26 -4.88 113.70 110.67 2daw s SER 11 Ca 0.57 2.13 0.19 0.00 0.70 0.00 0.00 55.95 59.53 2daw s SER 11 Cb -0.10 -2.59 1.12 0.00 -1.71 0.00 0.00 66.02 62.74 2daw s SER 11 CO 0.36 -0.45 1.28 0.52 1.20 0.00 0.00 173.24 176.15 2daw n VAL 12 N 3.43 -0.32 -0.13 4.45 0.31 -1.26 -1.16 118.33 123.65 2daw n VAL 12 Ca 0.08 1.62 -0.03 0.00 -0.01 0.00 0.00 64.34 65.99 2daw n VAL 12 Cb 0.45 -2.63 -0.03 0.00 -0.91 0.00 0.00 33.84 30.72 2daw n VAL 12 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2daw n LYS 13 N -4.75 -0.13 -0.15 5.55 5.02 -1.26 -0.00 118.16 122.44 2daw n LYS 13 Ca 0.31 0.94 -0.04 0.00 -2.02 0.00 0.00 58.31 57.50 2daw n LYS 13 Cb 1.09 -1.40 0.02 0.00 -0.02 0.00 0.00 35.03 34.72 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 -0.08 -0.12 1.97 4.39 -1.53 0.39 114.58 119.60 2daw h GLU 14 Ca 0.05 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.79 2daw h GLU 14 Cb 0.12 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.72 2daw h GLU 14 CO -0.28 -0.05 -0.44 0.77 -1.16 0.00 0.00 179.01 177.84 2daw h SER 15 N -0.08 -1.39 -0.08 1.42 0.02 -0.50 -2.22 113.55 110.72 2daw h SER 15 Ca 0.23 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.39 2daw h SER 15 Cb 0.43 0.56 -0.04 0.00 0.14 0.00 0.00 62.40 63.49 2daw h SER 15 CO -0.53 -0.44 -0.15 -0.07 -1.14 0.00 0.00 176.83 174.49 2daw h LEU 16 N -0.52 -0.46 -1.00 5.07 3.38 -0.03 -1.65 115.31 120.11 2daw h LEU 16 Ca 0.07 0.08 0.36 0.00 0.09 0.00 0.00 57.88 58.48 2daw h LEU 16 Cb 0.64 0.21 -0.16 0.00 0.09 0.00 0.00 40.66 41.44 2daw h LEU 16 CO -0.40 -0.20 0.53 -0.61 0.09 0.00 0.00 178.44 177.85 2daw h GLN 17 N -0.21 0.15 -0.13 1.13 -0.00 -0.39 1.02 115.11 116.68 2daw h GLN 17 Ca 0.08 -0.01 -0.19 0.00 -0.00 0.00 0.00 58.65 58.52 2daw h GLN 17 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 27.76 2daw h GLN 17 CO -0.20 0.10 -0.71 -0.07 0.00 0.00 0.00 178.83 177.95 2daw h LEU 18 N 0.16 0.69 -0.95 -2.39 4.07 -0.75 -2.96 115.31 113.18 2daw h LEU 18 Ca 0.78 -0.43 0.11 0.00 0.08 0.00 0.00 57.88 58.42 2daw h LEU 18 Cb 1.92 -0.20 -0.08 0.00 1.08 0.00 0.00 40.66 43.38 2daw h LEU 18 CO -0.69 1.19 0.59 1.56 -1.08 0.00 0.00 178.44 180.00 2daw h GLN 19 N 0.41 0.93 0.00 1.13 4.20 0.16 -0.24 115.11 121.70 2daw h GLN 19 Ca -0.03 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.49 2daw h GLN 19 Cb 1.30 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 2daw h GLN 19 CO 0.13 0.61 -0.65 -0.07 -0.67 0.00 0.00 178.83 178.18 2daw h LEU 20 N 0.95 0.00 0.51 1.46 3.38 -1.38 -2.85 115.31 117.38 2daw h LEU 20 Ca 0.46 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.41 2daw h LEU 20 Cb 0.42 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.17 2daw h LEU 20 CO -0.25 0.65 -0.25 -0.07 0.09 0.00 0.00 178.44 178.62 2daw h LEU 21 N 0.00 -0.58 -1.34 1.67 3.38 -0.89 -2.87 115.31 114.68 2daw h LEU 21 Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2daw h LEU 21 Cb 1.18 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 2daw h LEU 21 CO 0.09 -0.34 0.34 1.05 0.09 0.00 0.00 178.44 179.67 2daw h GLU 22 N -0.80 0.79 -0.39 1.13 -0.00 -1.46 -2.73 114.58 111.12 2daw h GLU 22 Ca -0.07 -0.07 0.08 0.00 -0.00 0.00 0.00 59.36 59.30 2daw h GLU 22 Cb 0.57 -0.17 -0.08 0.00 -0.00 0.00 0.00 28.75 29.08 2daw h GLU 22 CO 0.12 0.56 -0.14 0.52 -0.00 0.00 0.00 179.01 180.07 2daw h MET 23 N 0.80 -0.06 -0.34 1.06 2.86 -1.32 -0.24 114.93 117.69 2daw h MET 23 Ca 0.21 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.91 2daw h MET 23 Cb -0.01 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.61 2daw h MET 23 CO -0.04 -0.04 0.02 0.93 1.06 0.00 0.00 176.91 178.84 2daw h GLU 24 N -0.06 0.12 -0.70 1.72 4.39 -1.27 -1.14 114.58 117.63 2daw h GLU 24 Ca 0.19 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.92 2daw h GLU 24 Cb 0.35 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.94 2daw h GLU 24 CO -0.44 0.08 0.46 0.52 -1.16 0.00 0.00 179.01 178.47 2daw h MET 25 N 0.12 0.81 -0.17 2.33 2.86 -1.30 -2.36 114.93 117.22 2daw h MET 25 Ca 0.16 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 2daw h MET 25 Cb 0.21 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2daw h MET 25 CO -0.26 0.54 0.08 -0.07 1.06 0.00 0.00 176.91 178.26 2daw h LEU 26 N 0.83 0.22 -0.17 1.22 3.38 0.13 -0.57 115.31 120.37 2daw h LEU 26 Ca 0.28 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.17 2daw h LEU 26 Cb 0.08 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2daw h LEU 26 CO -0.08 0.28 -0.11 -0.26 0.09 0.00 0.00 178.44 178.36 2daw h PHE 27 N 0.15 -0.28 -0.71 1.13 0.04 -0.86 -0.06 116.94 116.35 2daw h PHE 27 Ca 0.06 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 2daw h PHE 27 Cb 0.12 0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 2daw h PHE 27 CO -0.03 -0.17 0.42 0.77 -0.60 0.00 0.00 178.31 178.70 2daw h SER 28 N -0.12 0.87 0.13 2.17 0.02 -1.37 -1.92 113.55 113.34 2daw h SER 28 Ca 0.10 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 2daw h SER 28 Cb 0.26 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 2daw h SER 28 CO -0.24 0.69 -0.12 0.24 -1.14 0.00 0.00 176.83 176.26 2daw h MET 29 N 0.98 0.00 -3.19 3.45 2.86 -0.49 -3.30 114.93 115.24 2daw h MET 29 Ca 0.25 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.26 2daw h MET 29 Cb -0.01 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 31.24 2daw h MET 29 CO -0.05 0.12 -0.51 -0.06 1.06 0.00 0.00 176.91 177.48 2daw s PHE 30 N -4.75 3.55 0.07 -0.22 0.08 -0.09 -4.93 117.98 111.69 2daw s PHE 30 Ca -0.04 -3.25 -0.18 0.00 0.12 0.00 0.00 56.93 53.58 2daw s PHE 30 Cb 0.16 -2.82 -0.12 0.00 -0.57 0.00 0.00 43.02 39.67 2daw s PHE 30 CO 0.68 -0.62 1.38 -1.00 -0.10 0.00 0.00 175.22 175.57 2daw h PRO 31 N 5.72 0.52 -5.50 0.24 0.13 -1.64 -3.42 132.00 128.05 2daw h PRO 31 Ca 0.10 -0.27 -0.27 0.00 -0.87 0.00 0.00 66.00 64.69 2daw h PRO 31 Cb 0.79 0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.94 2daw h PRO 31 CO 0.73 0.85 0.97 0.09 -0.23 0.00 0.00 178.00 180.42 2daw n ASN 32 N -4.42 2.12 -4.49 1.44 3.02 -1.26 -4.86 115.26 106.80 2daw n ASN 32 Ca -0.05 -0.92 -0.54 0.00 -0.03 0.00 0.00 54.58 53.04 2daw n ASN 32 Cb 0.41 -1.62 -0.06 0.00 -0.61 0.00 0.00 39.78 37.90 2daw n ASN 32 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2daw n GLN 33 N 8.93 0.25 0.00 3.52 7.27 -1.26 -3.14 117.38 132.94 2daw n GLN 33 Ca 0.41 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.57 2daw n GLN 33 Cb 0.50 -1.45 0.00 0.00 2.41 0.00 0.00 30.24 31.70 2daw n GLN 33 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2daw n GLY 34 N 1.77 3.69 0.00 1.69 0.00 -1.26 -5.00 105.19 106.08 2daw n GLY 34 Ca 0.18 -0.93 -0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.00 -6.33 1.61 4.39 -1.89 -3.38 114.58 108.98 2daw h GLU 35 Ca 0.00 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.15 2daw h GLU 35 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2daw h GLU 35 CO 0.00 -0.00 0.56 0.08 -1.16 0.00 0.00 179.01 178.49 2daw s VAL 36 N -3.00 4.57 -0.47 3.13 1.01 -1.26 -2.49 120.40 121.89 2daw s VAL 36 Ca -0.00 1.85 -0.02 0.00 0.00 0.00 0.00 61.98 63.81 2daw s VAL 36 Cb 0.00 -4.19 0.12 0.00 0.00 0.00 0.00 36.38 32.32 2daw s VAL 36 CO 0.00 0.05 0.25 -0.54 0.00 0.00 0.00 175.10 174.86 2daw s LYS 37 N 1.75 2.09 -0.49 2.72 1.02 -0.62 -4.97 119.74 121.23 2daw s LYS 37 Ca 0.52 -2.08 -0.21 0.00 0.02 0.00 0.00 55.97 54.23 2daw s LYS 37 Cb -0.22 -3.56 0.04 0.00 -0.52 0.00 0.00 37.83 33.57 2daw s LYS 37 CO 0.22 -1.09 0.70 -0.51 -0.92 0.00 0.00 175.35 173.76 2daw s LEU 38 N 0.69 4.62 0.39 3.17 1.43 -1.26 -3.25 118.68 124.46 2daw s LEU 38 Ca 0.11 -0.59 0.17 0.00 -1.03 0.00 0.00 54.13 52.80 2daw s LEU 38 Cb -0.22 -2.63 0.95 0.00 0.03 0.00 0.00 46.19 44.32 2daw s LEU 38 CO -0.04 -0.93 1.47 -0.33 0.23 0.00 0.00 176.35 176.75 2daw h GLU 39 N 9.03 0.00 -0.50 1.70 3.07 -1.98 -3.37 114.58 122.53 2daw h GLU 39 Ca -0.26 0.00 0.21 0.00 -0.50 0.00 0.00 59.36 58.81 2daw h GLU 39 Cb 1.09 0.00 -0.22 0.00 -0.84 0.00 0.00 28.75 28.78 2daw h GLU 39 CO 0.97 0.00 0.11 -0.51 -1.40 0.00 0.00 179.01 178.18 2daw s ASP 40 N -3.70 -0.57 0.11 1.42 1.01 -1.26 -5.00 116.67 108.68 2daw s ASP 40 Ca -0.02 0.43 0.10 0.00 0.71 0.00 0.00 52.55 53.77 2daw s ASP 40 Cb 0.05 1.51 0.50 0.00 1.01 0.00 0.00 42.92 45.98 2daw s ASP 40 CO 0.16 -0.11 1.31 1.33 0.21 0.00 0.00 175.17 178.07 2daw n VAL 41 N 5.37 1.49 0.74 -1.27 0.24 -1.26 -1.08 118.33 122.56 2daw n VAL 41 Ca -0.07 0.51 0.12 0.00 -2.04 0.00 0.00 64.34 62.86 2daw n VAL 41 Cb 0.53 -1.46 0.48 0.00 -1.47 0.00 0.00 33.84 31.92 2daw n VAL 41 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2daw n ASN 42 N -1.77 0.20 0.20 -1.34 3.02 -1.26 -3.20 115.26 111.10 2daw n ASN 42 Ca 0.00 0.53 0.07 0.00 -0.03 0.00 0.00 54.58 55.15 2daw n ASN 42 Cb 0.05 -0.58 0.57 0.00 -0.61 0.00 0.00 39.78 39.21 2daw n ASN 42 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2daw h ALA 43 N 2.71 1.88 0.14 5.41 0.00 -1.42 -0.80 119.26 127.18 2daw h ALA 43 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.56 2daw h ALA 43 Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2daw h ALA 43 CO 0.00 0.10 -1.51 -0.07 0.00 0.00 0.00 179.25 177.77 2daw h LEU 44 N 0.12 0.47 0.50 0.00 3.38 -1.78 -3.33 115.31 114.67 2daw h LEU 44 Ca 0.03 -0.62 -0.02 0.00 0.09 0.00 0.00 57.88 57.36 2daw h LEU 44 Cb 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2daw h LEU 44 CO -0.00 1.51 -0.24 0.74 0.09 0.00 0.00 178.44 180.53 2daw h THR 45 N 0.08 0.00 -0.87 0.22 2.02 -1.56 -3.05 112.91 109.75 2daw h THR 45 Ca -0.24 -0.21 0.22 0.00 0.77 0.00 0.00 66.41 66.95 2daw h THR 45 Cb 2.04 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 68.28 2daw h THR 45 CO 0.18 0.00 -0.03 0.59 0.37 0.00 0.00 175.52 176.63 2daw n ASN 46 N -4.39 -0.15 -0.03 4.18 3.02 -0.35 0.87 115.26 118.42 2daw n ASN 46 Ca -0.08 1.48 -0.08 0.00 -0.03 0.00 0.00 54.58 55.86 2daw n ASN 46 Cb 0.27 -0.52 -0.02 0.00 -0.61 0.00 0.00 39.78 38.89 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 0.66 0.00 2.41 2.04 -1.66 0.71 117.51 121.66 2daw h ILE 47 Ca 0.50 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.36 2daw h ILE 47 Cb 0.98 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 2daw h ILE 47 CO -0.83 0.00 0.43 0.11 0.00 0.00 0.00 178.15 177.86 2daw h LYS 48 N -0.11 0.00 0.09 2.37 1.57 0.60 0.55 116.57 121.64 2daw h LYS 48 Ca 0.11 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.60 2daw h LYS 48 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2daw h LYS 48 CO -0.26 0.00 -1.41 0.00 -0.57 0.00 0.00 179.45 177.21 2daw h ARG 49 N 0.00 0.19 -0.28 3.15 2.47 -0.64 -3.35 114.38 115.93 2daw h ARG 49 Ca 0.00 -0.33 -0.12 0.00 -1.26 0.00 0.00 59.98 58.27 2daw h ARG 49 Cb 0.87 0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 29.31 2daw h ARG 49 CO 0.00 1.06 -0.29 -0.92 0.56 0.00 0.00 179.97 180.39 2daw h TYR 50 N 0.05 0.82 -0.68 3.04 3.20 0.31 -1.97 116.97 121.74 2daw h TYR 50 Ca -0.19 -0.25 0.20 0.00 3.14 0.00 0.00 58.73 61.63 2daw h TYR 50 Cb 1.97 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 40.04 2daw h TYR 50 CO 0.05 0.99 0.56 -0.07 -1.64 0.00 0.00 178.16 178.04 2daw h LEU 51 N 0.41 0.00 0.00 2.82 3.38 -1.55 0.16 115.31 120.54 2daw h LEU 51 Ca 0.04 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.71 2daw h LEU 51 Cb 0.86 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 2daw h LEU 51 CO 0.07 0.00 -1.80 1.21 0.09 0.00 0.00 178.44 178.01 2daw n GLU 52 N -4.06 0.64 -0.72 1.13 2.13 -1.12 -5.00 120.64 113.64 2daw n GLU 52 Ca 0.14 0.26 0.00 0.00 0.66 0.00 0.00 57.16 58.21 2daw n GLU 52 Cb 0.81 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.76 2daw n GLU 52 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2daw n GLY 53 N 1.59 1.30 0.02 8.31 0.00 0.56 -4.98 105.19 111.98 2daw n GLY 53 Ca -0.19 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.18 0.09 -3.79 2.61 5.66 -0.97 -4.62 114.28 111.09 2daw n THR 54 Ca 0.00 -0.24 -0.28 0.00 -3.05 0.00 0.00 64.05 60.48 2daw n THR 54 Cb 0.17 0.36 -0.11 0.00 -1.55 0.00 0.00 70.33 69.20 2daw n THR 54 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2daw n ARG 55 N -1.91 1.77 -0.32 1.09 0.63 -1.25 -4.96 116.66 111.71 2daw n ARG 55 Ca 0.01 -4.39 0.04 0.00 -0.92 0.00 0.00 57.85 52.60 2daw n ARG 55 Cb 0.44 -2.22 0.11 0.00 0.45 0.00 0.00 32.46 31.24 2daw n ARG 55 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2daw n GLU 56 N 1.88 -0.10 -1.67 -0.14 -0.58 -1.26 -4.26 120.64 114.51 2daw n GLU 56 Ca 0.22 1.37 -0.46 0.00 -0.42 0.00 0.00 57.16 57.87 2daw n GLU 56 Cb 0.37 -2.04 -0.04 0.00 -0.57 0.00 0.00 31.44 29.16 2daw n GLU 56 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2daw n ALA 57 N -3.66 1.11 -1.66 0.62 0.00 -1.26 -4.86 120.51 110.81 2daw n ALA 57 Ca 0.13 0.26 -0.50 0.00 0.00 0.00 0.00 53.44 53.33 2daw n ALA 57 Cb 0.43 -2.56 -0.05 0.00 0.00 0.00 0.00 19.45 17.26 2daw n ALA 57 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2daw n LEU 58 N 6.96 2.68 -4.77 0.00 -0.00 -1.26 -4.94 117.00 115.67 2daw n LEU 58 Ca 0.22 1.06 -0.31 0.00 -0.00 0.00 0.00 56.01 56.98 2daw n LEU 58 Cb 0.33 -1.30 0.08 0.00 -0.00 0.00 0.00 43.42 42.53 2daw n LEU 58 CO 0.72 -0.46 0.71 -2.16 -0.00 0.00 0.00 177.39 176.20 2daw s PRO 59 N 2.01 2.34 0.07 1.96 0.04 -1.26 -4.98 135.00 135.19 2daw s PRO 59 Ca 0.87 1.21 -0.31 0.00 0.04 0.00 0.00 61.00 62.81 2daw s PRO 59 Cb -0.82 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 31.74 2daw s PRO 59 CO 0.48 -1.58 1.39 -1.25 0.04 0.00 0.00 177.00 176.08 2daw s PRO 60 N -4.76 4.31 1.29 0.56 0.04 -1.26 -4.97 135.00 130.21 2daw s PRO 60 Ca 0.62 2.03 -0.20 0.00 0.04 0.00 0.00 61.00 63.49 2daw s PRO 60 Cb -0.18 -3.37 0.30 0.00 0.04 0.00 0.00 34.50 31.30 2daw s PRO 60 CO 0.53 -0.48 0.69 0.36 0.04 0.00 0.00 177.00 178.14 2daw n LYS 61 N 4.45 -3.85 -3.50 4.56 2.85 -1.26 -4.80 118.16 116.61 2daw n LYS 61 Ca 0.12 -1.14 -0.42 0.00 -1.05 0.00 0.00 58.31 55.82 2daw n LYS 61 Cb 0.43 -1.75 -0.07 0.00 -0.65 0.00 0.00 35.03 32.99 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 -2.10 4.51 -0.06 0.58 1.01 -1.14 -4.89 121.20 119.12 2daw s ILE 62 Ca 0.55 -2.03 0.05 0.00 0.00 0.00 0.00 60.65 59.22 2daw s ILE 62 Cb -0.10 -3.92 -0.00 0.00 0.01 0.00 0.00 42.46 38.44 2daw s ILE 62 CO 0.47 -0.85 -0.21 -0.70 0.00 0.00 0.00 174.94 173.65 2daw s GLU 63 N 0.99 2.25 0.30 2.79 -6.30 -1.26 -2.38 118.70 115.10 2daw s GLU 63 Ca 0.09 -0.74 -0.19 0.00 -2.50 0.00 0.00 54.97 51.63 2daw s GLU 63 Cb -0.23 -1.88 0.06 0.00 0.00 0.00 0.00 34.13 32.08 2daw s GLU 63 CO -0.02 0.26 0.88 -0.59 0.02 0.00 0.00 175.26 175.81 2daw s PHE 64 N 0.07 0.08 -0.11 5.30 -0.71 -1.10 -4.43 117.98 117.07 2daw s PHE 64 Ca -0.07 -0.63 0.03 0.00 -1.04 0.00 0.00 56.93 55.22 2daw s PHE 64 Cb -0.14 0.78 -0.00 0.00 -1.21 0.00 0.00 43.02 42.45 2daw s PHE 64 CO 0.04 -1.30 -0.22 0.08 -1.34 0.00 0.00 175.22 172.47 2daw s VAL 65 N -2.39 2.22 -0.20 -2.49 1.01 -1.20 -1.03 120.40 116.31 2daw s VAL 65 Ca 0.17 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 61.13 2daw s VAL 65 Cb -0.04 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2daw s VAL 65 CO 0.09 0.55 0.02 -0.63 0.00 0.00 0.00 175.10 175.13 2daw s ILE 66 N 0.38 4.15 -0.66 2.22 1.01 0.42 -1.59 121.20 127.12 2daw s ILE 66 Ca -0.17 -0.24 -0.25 0.00 0.00 0.00 0.00 60.65 59.99 2daw s ILE 66 Cb -0.17 -2.89 0.05 0.00 0.01 0.00 0.00 42.46 39.46 2daw s ILE 66 CO 0.08 0.42 1.09 -0.89 0.00 0.00 0.00 174.94 175.63 2daw s THR 67 N 0.97 4.11 -0.54 2.92 2.01 -1.04 -0.92 115.64 123.16 2daw s THR 67 Ca 0.02 0.12 -0.26 0.00 0.31 0.00 0.00 61.69 61.88 2daw s THR 67 Cb -0.14 -4.74 -0.04 0.00 0.01 0.00 0.00 72.50 67.59 2daw s THR 67 CO 0.02 -1.52 2.06 -0.76 -0.69 0.00 0.00 174.62 173.73 2daw s LEU 68 N 4.68 3.35 -1.28 4.42 2.01 0.02 -4.87 118.68 127.01 2daw s LEU 68 Ca 0.30 0.70 -0.18 0.00 0.01 0.00 0.00 54.13 54.97 2daw s LEU 68 Cb -0.12 -2.61 0.02 0.00 0.01 0.00 0.00 46.19 43.48 2daw s LEU 68 CO 0.15 -2.50 1.95 1.67 1.01 0.00 0.00 176.35 178.63 2daw n GLN 69 N 9.06 2.70 -1.67 1.70 0.00 -1.26 -3.41 117.38 124.49 2daw n GLN 69 Ca 0.27 -2.79 -0.46 0.00 -0.00 0.00 0.00 57.00 54.02 2daw n GLN 69 Cb 0.53 -3.39 -0.04 0.00 0.00 0.00 0.00 30.24 27.33 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 6.07 0.06 -0.07 1.69 2.08 -1.17 -4.90 119.36 123.13 2daw n ILE 70 Ca 0.50 -0.02 -0.14 0.00 0.56 0.00 0.00 62.75 63.65 2daw n ILE 70 Cb 0.43 -1.56 -0.06 0.00 -0.75 0.00 0.00 39.64 37.70 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 5.87 0.64 -1.92 0.38 4.11 -1.89 -3.30 114.58 118.46 2daw h GLU 71 Ca -0.45 -0.40 0.07 0.00 0.07 0.00 0.00 59.36 58.64 2daw h GLU 71 Cb 1.25 0.05 -0.21 0.00 0.50 0.00 0.00 28.75 30.34 2daw h GLU 71 CO 0.88 1.02 -0.04 -2.00 0.07 0.00 0.00 179.01 178.95 2daw s GLU 72 N -4.10 0.60 0.33 1.06 2.12 -1.26 -3.38 118.70 114.07 2daw s GLU 72 Ca -0.12 1.31 -0.28 0.00 0.36 0.00 0.00 54.97 56.23 2daw s GLU 72 Cb 0.08 0.56 -0.10 0.00 0.26 0.00 0.00 34.13 34.93 2daw s GLU 72 CO 0.83 -0.17 1.22 -1.25 -0.54 0.00 0.00 175.26 175.35 2daw s PRO 73 N 2.37 4.40 -0.97 4.30 0.04 -1.26 -4.55 135.00 139.32 2daw s PRO 73 Ca -0.07 2.03 -0.26 0.00 0.04 0.00 0.00 61.00 62.73 2daw s PRO 73 Cb -0.09 -3.05 -0.18 0.00 0.04 0.00 0.00 34.50 31.23 2daw s PRO 73 CO -0.19 -0.08 2.22 0.21 0.04 0.00 0.00 177.00 179.19 2daw s LYS 74 N -1.76 1.44 0.28 4.56 2.47 -1.22 -4.73 119.74 120.78 2daw s LYS 74 Ca 0.49 -0.10 0.03 0.00 -1.56 0.00 0.00 55.97 54.83 2daw s LYS 74 Cb -0.36 -4.92 -0.06 0.00 -1.46 0.00 0.00 37.83 31.03 2daw s LYS 74 CO 0.47 -4.96 0.03 0.14 0.16 0.00 0.00 175.35 171.19 2daw s VAL 75 N 15.67 1.07 -0.02 4.02 -7.23 -1.24 -5.03 120.40 127.63 2daw s VAL 75 Ca 0.85 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 59.01 2daw s VAL 75 Cb -0.08 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 2daw s VAL 75 CO 0.13 -0.14 -0.05 -0.75 -0.31 0.00 0.00 175.10 173.98 2daw s LYS 76 N -3.89 2.67 -0.15 4.82 2.20 -1.26 -3.03 119.74 121.10 2daw s LYS 76 Ca 0.33 -0.63 -0.04 0.00 -0.36 0.00 0.00 55.97 55.27 2daw s LYS 76 Cb 0.07 -2.57 0.07 0.00 -1.51 0.00 0.00 37.83 33.89 2daw s LYS 76 CO 0.13 0.63 0.18 0.42 -0.36 0.00 0.00 175.35 176.35 2daw s ILE 77 N -0.95 -0.27 -0.33 5.43 1.01 -1.22 -4.90 121.20 119.98 2daw s ILE 77 Ca 0.16 0.07 -0.29 0.00 0.00 0.00 0.00 60.65 60.60 2daw s ILE 77 Cb -0.11 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.87 2daw s ILE 77 CO 0.06 -0.07 1.06 1.51 0.00 0.00 0.00 174.94 177.50 2daw s ASP 78 N 2.29 6.90 -0.37 3.58 1.47 -1.26 -0.80 116.67 128.48 2daw s ASP 78 Ca 0.04 0.99 -0.11 0.00 1.18 0.00 0.00 52.55 54.66 2daw s ASP 78 Cb -0.14 -2.53 0.03 0.00 -0.34 0.00 0.00 42.92 39.93 2daw s ASP 78 CO -0.09 -0.88 0.20 -0.22 0.68 0.00 0.00 175.17 174.86 2daw s LEU 79 N 3.64 4.66 -0.95 2.11 2.96 -0.09 -3.11 118.68 127.90 2daw s LEU 79 Ca 0.45 -0.96 -0.22 0.00 -0.22 0.00 0.00 54.13 53.17 2daw s LEU 79 Cb -0.12 -2.02 0.07 0.00 0.50 0.00 0.00 46.19 44.62 2daw s LEU 79 CO 0.16 -0.37 1.32 -1.10 -1.32 0.00 0.00 176.35 175.04 2daw s GLN 80 N 1.55 3.52 0.30 1.98 -0.21 -0.70 -0.44 119.66 125.66 2daw s GLN 80 Ca 0.02 -1.17 -0.17 0.00 0.02 0.00 0.00 55.36 54.06 2daw s GLN 80 Cb -0.19 -5.06 -0.09 0.00 1.00 0.00 0.00 33.01 28.67 2daw s GLN 80 CO 0.06 -2.07 0.76 0.54 -2.12 0.00 0.00 175.29 172.46 2daw s VAL 81 N 4.44 4.60 -0.19 1.09 0.11 -0.20 -2.64 120.40 127.61 2daw s VAL 81 Ca 0.40 1.14 -0.05 0.00 -2.93 0.00 0.00 61.98 60.54 2daw s VAL 81 Cb -0.03 -3.71 0.07 0.00 -1.53 0.00 0.00 36.38 31.19 2daw s VAL 81 CO -0.06 -0.05 0.13 -0.89 -3.33 0.00 0.00 175.10 170.90 2daw s THR 82 N -1.83 -0.16 -0.39 5.04 2.01 -1.02 -2.71 115.64 116.58 2daw s THR 82 Ca 0.51 -0.21 -0.08 0.00 0.31 0.00 0.00 61.69 62.21 2daw s THR 82 Cb -0.13 -0.65 0.07 0.00 0.01 0.00 0.00 72.50 71.80 2daw s THR 82 CO 0.18 -0.31 0.21 -0.04 -0.69 0.00 0.00 174.62 173.98 2daw s MET 83 N 2.19 2.60 0.00 4.92 -1.94 -1.00 -2.64 119.30 123.43 2daw s MET 83 Ca 0.04 -1.37 0.00 0.00 -1.71 0.00 0.00 55.69 52.65 2daw s MET 83 Cb -0.16 -3.69 0.00 0.00 2.01 0.00 0.00 34.83 32.99 2daw s MET 83 CO -0.13 -0.87 0.00 -0.35 -0.01 0.00 0.00 175.02 173.66 2daw n PRO 84 N 4.88 -0.80 0.17 2.03 -0.04 -1.26 -2.86 135.00 137.13 2daw n PRO 84 Ca -0.10 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.42 2daw n PRO 84 Cb 0.44 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 33.98 2daw n PRO 84 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2daw h HIS 85 N -1.40 0.00 0.01 0.54 3.86 -1.98 -3.34 115.15 112.84 2daw h HIS 85 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2daw h HIS 85 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2daw h HIS 85 CO 0.00 0.28 -0.01 0.77 0.86 0.00 0.00 177.93 179.83 2daw h SER 86 N 0.00 -0.01 -1.05 2.45 0.02 -1.94 -3.40 113.55 109.62 2daw h SER 86 Ca -0.00 -0.69 -0.40 0.00 -0.84 0.00 0.00 61.79 59.85 2daw h SER 86 Cb 1.22 0.00 0.10 0.00 0.14 0.00 0.00 62.40 63.86 2daw h SER 86 CO 0.04 0.81 -0.59 0.00 -1.14 0.00 0.00 176.83 175.95 2daw n TYR 87 N -4.68 -1.28 0.22 3.45 4.19 -1.25 -2.45 117.16 115.36 2daw n TYR 87 Ca -0.07 0.42 0.10 0.00 3.31 0.00 0.00 57.90 61.65 2daw n TYR 87 Cb 0.34 -1.16 0.50 0.00 0.49 0.00 0.00 39.34 39.51 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 0.24 0.00 -0.59 2.98 0.13 -1.82 -3.41 132.00 129.53 2daw h PRO 88 Ca -0.23 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.12 2daw h PRO 88 Cb 0.94 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.96 2daw h PRO 88 CO 0.31 0.23 0.23 0.66 -0.23 0.00 0.00 178.00 179.20 2daw n TYR 89 N -3.51 0.60 -3.74 1.56 4.02 -1.03 -4.20 117.16 110.86 2daw n TYR 89 Ca -0.01 0.70 -0.21 0.00 -0.01 0.00 0.00 57.90 58.37 2daw n TYR 89 Cb 0.39 -1.08 -0.01 0.00 -0.02 0.00 0.00 39.34 38.62 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 -8.89 4.18 -0.77 7.72 0.20 -1.25 -4.59 118.68 115.28 2daw s LEU 90 Ca -0.06 0.12 -0.22 0.00 0.69 0.00 0.00 54.13 54.66 2daw s LEU 90 Cb 0.19 -2.95 0.07 0.00 -0.43 0.00 0.00 46.19 43.07 2daw s LEU 90 CO 0.46 -0.19 1.10 0.00 -0.29 0.00 0.00 176.35 177.43 2daw s ALA 91 N -2.10 3.07 1.05 5.97 0.00 -1.26 -4.32 121.76 124.18 2daw s ALA 91 Ca 0.37 -2.01 -0.22 0.00 0.00 0.00 0.00 51.96 50.10 2daw s ALA 91 Cb -0.09 -4.03 -0.03 0.00 0.00 0.00 0.00 23.12 18.97 2daw s ALA 91 CO 0.31 -2.99 -0.68 1.47 0.00 0.00 0.00 175.76 173.87 2daw n LEU 92 N 7.85 -2.60 -4.17 0.00 -0.00 -1.26 -4.96 117.00 111.85 2daw n LEU 92 Ca 0.07 -0.09 -0.34 0.00 -0.00 0.00 0.00 56.01 55.65 2daw n LEU 92 Cb 0.47 -0.73 -0.15 0.00 -0.00 0.00 0.00 43.42 43.01 2daw n LEU 92 CO 0.62 -2.80 -0.44 -1.10 -0.00 0.00 0.00 177.39 173.68 2daw s GLN 93 N -2.78 2.83 -0.05 1.47 -0.21 -1.08 -4.97 119.66 114.87 2daw s GLN 93 Ca 0.45 -0.97 0.02 0.00 0.02 0.00 0.00 55.36 54.88 2daw s GLN 93 Cb -0.01 -2.89 -0.03 0.00 1.00 0.00 0.00 33.01 31.08 2daw s GLN 93 CO 0.63 -0.37 -0.09 -0.51 -2.12 0.00 0.00 175.29 172.83 2daw s LEU 94 N 1.30 3.03 -0.22 2.90 1.43 -1.26 -2.42 118.68 123.43 2daw s LEU 94 Ca 0.00 -0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 52.97 2daw s LEU 94 Cb -0.16 -1.67 0.12 0.00 0.03 0.00 0.00 46.19 44.51 2daw s LEU 94 CO -0.06 0.34 0.35 0.12 0.23 0.00 0.00 176.35 177.33 2daw s PHE 95 N -0.83 -0.70 -0.04 0.29 2.19 -1.08 -4.84 117.98 112.96 2daw s PHE 95 Ca 0.13 0.82 0.00 0.00 0.33 0.00 0.00 56.93 58.21 2daw s PHE 95 Cb -0.11 -0.02 -0.03 0.00 -1.31 0.00 0.00 43.02 41.55 2daw s PHE 95 CO 0.02 -0.65 -0.02 0.20 1.83 0.00 0.00 175.22 176.61 2daw s GLY 96 N 2.51 1.82 -0.11 13.12 0.00 -1.26 -1.72 107.32 121.68 2daw s GLY 96 Ca 0.09 -0.90 -0.07 0.00 0.00 0.00 0.00 44.72 43.84 2daw s GLY 96 CO -0.14 -0.71 0.27 0.50 0.00 0.00 0.00 173.10 173.02 2daw s ARG 97 N -1.17 0.27 0.18 2.90 0.52 -1.18 -4.91 118.95 115.56 2daw s ARG 97 Ca 0.16 0.49 -0.02 0.00 -0.52 0.00 0.00 55.73 55.83 2daw s ARG 97 Cb -0.11 0.01 -0.04 0.00 0.52 0.00 0.00 34.95 35.33 2daw s ARG 97 CO 0.06 -0.11 0.13 -1.12 0.02 0.00 0.00 175.30 174.28 2daw s SER 98 N 0.77 0.19 -0.11 0.23 0.01 -1.26 -4.12 113.70 109.41 2daw s SER 98 Ca -0.05 -1.28 -0.19 0.00 1.31 0.00 0.00 55.95 55.74 2daw s SER 98 Cb -0.06 0.37 -0.16 0.00 0.21 0.00 0.00 66.02 66.37 2daw s SER 98 CO -0.05 -0.82 0.58 0.28 0.41 0.00 0.00 173.24 173.64 2daw h SER 99 N 2.68 -0.04 -0.55 2.44 0.02 -2.01 -3.35 113.55 112.73 2daw h SER 99 Ca -0.35 -0.57 0.10 0.00 -0.84 0.00 0.00 61.79 60.13 2daw h SER 99 Cb 1.23 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 63.67 2daw h SER 99 CO 0.54 0.71 -0.33 -0.08 -1.14 0.00 0.00 176.83 176.53 2daw h GLU 100 N -0.96 -0.17 -7.25 3.45 4.22 -1.98 -3.41 114.58 108.48 2daw h GLU 100 Ca -0.00 0.01 -0.52 0.00 0.08 0.00 0.00 59.36 58.93 2daw h GLU 100 Cb 0.60 0.04 0.14 0.00 0.50 0.00 0.00 28.75 30.03 2daw h GLU 100 CO 0.01 -0.11 0.33 -0.51 -2.18 0.00 0.00 179.01 176.54 2daw s LEU 101 N -10.68 3.15 0.48 1.64 1.43 -1.26 -5.06 118.68 108.39 2daw s LEU 101 Ca -0.14 2.02 0.07 0.00 -1.03 0.00 0.00 54.13 55.04 2daw s LEU 101 Cb 0.15 -4.55 0.01 0.00 0.03 0.00 0.00 46.19 41.83 2daw s LEU 101 CO 0.69 -2.13 0.37 1.51 0.23 0.00 0.00 176.35 177.03 2daw s ASP 102 N -2.81 4.76 0.12 2.29 -4.77 -1.26 -4.80 116.67 110.20 2daw s ASP 102 Ca 0.66 -1.03 -0.21 0.00 -3.30 0.00 0.00 52.55 48.67 2daw s ASP 102 Cb -0.21 -0.08 -0.06 0.00 -1.09 0.00 0.00 42.92 41.48 2daw s ASP 102 CO 0.50 -0.87 1.71 -0.09 0.70 0.00 0.00 175.17 177.13 2daw h ARG 103 N 0.93 -0.01 0.58 2.11 9.65 -1.96 0.64 114.38 126.32 2daw h ARG 103 Ca -0.39 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.47 2daw h ARG 103 Cb 1.28 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.85 2daw h ARG 103 CO 0.59 -0.01 -0.43 1.25 2.80 0.00 0.00 179.97 184.17 2daw h HIS 104 N -0.01 -1.17 0.15 2.20 2.76 -2.00 -2.42 115.15 114.66 2daw h HIS 104 Ca 0.07 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2daw h HIS 104 Cb 0.12 0.44 -0.04 0.00 1.55 0.00 0.00 27.41 29.47 2daw h HIS 104 CO -0.18 -0.63 -0.48 1.96 -1.30 0.00 0.00 177.93 177.30 2daw h GLN 105 N -0.99 -0.71 -0.98 5.26 1.08 -1.94 -2.39 115.11 114.46 2daw h GLN 105 Ca -0.07 0.05 0.16 0.00 -1.45 0.00 0.00 58.65 57.34 2daw h GLN 105 Cb 0.83 0.16 -0.17 0.00 -0.05 0.00 0.00 27.48 28.25 2daw h GLN 105 CO 0.02 -0.47 -0.34 1.04 -0.95 0.00 0.00 178.83 178.13 2daw n GLN 106 N -5.49 -0.19 -0.33 1.46 6.02 0.21 0.13 117.38 119.19 2daw n GLN 106 Ca -0.08 1.51 0.15 0.00 -0.01 0.00 0.00 57.00 58.56 2daw n GLN 106 Cb 0.40 -2.24 0.34 0.00 1.02 0.00 0.00 30.24 29.76 2daw n GLN 106 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2daw h LEU 107 N 0.00 0.57 -0.31 1.08 3.38 -0.91 0.24 115.31 119.36 2daw h LEU 107 Ca 0.38 0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.42 2daw h LEU 107 Cb 0.62 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2daw h LEU 107 CO -0.98 0.11 -0.02 -0.07 0.09 0.00 0.00 178.44 177.57 2daw h LEU 108 N 0.56 0.56 0.37 1.67 3.38 0.12 -0.73 115.31 121.24 2daw h LEU 108 Ca 0.59 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 2daw h LEU 108 Cb 1.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2daw h LEU 108 CO -0.47 0.75 -0.18 0.25 0.09 0.00 0.00 178.44 178.88 2daw h LEU 109 N 0.36 -0.42 0.46 1.67 5.85 0.03 -2.10 115.31 121.17 2daw h LEU 109 Ca 0.09 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2daw h LEU 109 Cb 0.47 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 2daw h LEU 109 CO 0.02 -0.17 -0.31 0.78 -0.34 0.00 0.00 178.44 178.42 2daw h ASN 110 N -0.66 -0.79 -0.95 1.25 2.35 -0.67 -1.01 115.58 115.10 2daw h ASN 110 Ca -0.05 0.05 0.21 0.00 -0.55 0.00 0.00 56.30 55.96 2daw h ASN 110 Cb 0.47 0.24 -0.18 0.00 0.05 0.00 0.00 38.32 38.90 2daw h ASN 110 CO 0.08 -0.46 -0.13 0.11 -1.65 0.00 0.00 177.43 175.38 2daw h LYS 111 N -0.73 0.01 -0.53 0.81 1.57 -1.21 0.51 116.57 116.99 2daw h LYS 111 Ca -0.06 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2daw h LYS 111 Cb 0.59 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 2daw h LYS 111 CO 0.05 0.01 0.32 0.78 -0.57 0.00 0.00 179.45 180.03 2daw h GLY 112 N 0.01 0.78 0.22 3.86 0.00 -1.16 -2.33 103.07 104.45 2daw h GLY 112 Ca 0.50 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2daw h GLY 112 CO -0.94 0.32 -0.10 -2.00 0.00 0.00 0.00 176.54 173.82 2daw h LEU 113 N 0.72 -0.25 -0.86 3.11 5.85 0.12 -1.93 115.31 122.07 2daw h LEU 113 Ca 0.19 0.01 0.16 0.00 0.84 0.00 0.00 57.88 59.08 2daw h LEU 113 Cb -0.00 0.06 -0.16 0.00 0.37 0.00 0.00 40.66 40.94 2daw h LEU 113 CO -0.03 -0.09 -0.25 0.35 -0.34 0.00 0.00 178.44 178.08 2daw n THR 114 N -3.25 -0.38 -0.09 1.05 -2.24 0.99 0.91 114.28 111.27 2daw n THR 114 Ca -0.04 1.97 -0.10 0.00 -2.27 0.00 0.00 64.05 63.62 2daw n THR 114 Cb 0.11 -2.70 -0.02 0.00 -2.10 0.00 0.00 70.33 65.62 2daw n THR 114 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2daw h SER 115 N 0.00 0.38 -0.78 3.42 0.02 -1.49 0.22 113.55 115.33 2daw h SER 115 Ca 0.38 -0.11 0.14 0.00 -0.84 0.00 0.00 61.79 61.35 2daw h SER 115 Cb 0.60 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.98 2daw h SER 115 CO -0.87 0.39 0.51 0.22 -1.14 0.00 0.00 176.83 175.94 2daw h TYR 116 N 0.35 0.58 0.01 3.45 3.20 0.14 -0.18 116.97 124.52 2daw h TYR 116 Ca 0.10 0.02 -0.23 0.00 3.14 0.00 0.00 58.73 61.76 2daw h TYR 116 Cb 0.10 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 2daw h TYR 116 CO -0.02 0.23 -1.14 0.82 -1.64 0.00 0.00 178.16 176.41 2daw h ILE 117 N 0.51 1.55 0.00 1.81 1.08 -0.56 -3.24 117.51 118.67 2daw h ILE 117 Ca 0.38 -3.28 0.00 0.00 -0.39 0.00 0.00 64.86 61.57 2daw h ILE 117 Cb 0.75 2.78 0.00 0.00 -3.07 0.00 0.00 36.82 37.28 2daw h ILE 117 CO -0.14 0.89 0.00 0.61 -0.69 0.00 0.00 178.15 178.82 2daw n GLY 118 N 1.40 -0.78 0.10 5.37 0.00 0.02 -2.41 105.19 108.89 2daw n GLY 118 Ca -0.04 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 2daw n GLY 118 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2daw n THR 119 N -1.31 1.58 -0.96 2.61 -2.24 -1.02 -4.97 114.28 107.97 2daw n THR 119 Ca 0.06 -0.77 -0.35 0.00 -2.27 0.00 0.00 64.05 60.72 2daw n THR 119 Cb 0.12 -1.05 0.06 0.00 -2.10 0.00 0.00 70.33 67.36 2daw n THR 119 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2daw n PHE 120 N -3.07 -4.34 -3.36 4.78 3.01 -1.01 -4.92 117.46 108.54 2daw n PHE 120 Ca -0.26 0.03 -0.38 0.00 1.01 0.00 0.00 57.45 57.85 2daw n PHE 120 Cb 1.07 -1.52 -0.06 0.00 -0.01 0.00 0.00 39.48 38.97 2daw n PHE 120 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2daw s ASP 121 N -1.23 6.94 -0.71 4.37 2.15 -1.26 -5.00 116.67 121.93 2daw s ASP 121 Ca 0.44 1.13 -0.26 0.00 0.43 0.00 0.00 52.55 54.30 2daw s ASP 121 Cb -0.19 -2.31 -0.03 0.00 -0.30 0.00 0.00 42.92 40.09 2daw s ASP 121 CO 0.79 0.26 1.89 -2.16 -0.17 0.00 0.00 175.17 175.79 2daw s PRO 122 N -1.25 2.60 0.00 4.34 0.04 -1.26 -3.07 135.00 136.41 2daw s PRO 122 Ca 0.29 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.64 2daw s PRO 122 Cb -0.18 -4.61 0.00 0.00 0.04 0.00 0.00 34.50 29.75 2daw s PRO 122 CO 0.17 -2.95 0.00 0.41 0.04 0.00 0.00 177.00 174.67 2daw n GLY 123 N 6.09 0.30 3.83 0.56 0.00 -1.26 -4.70 105.19 110.00 2daw n GLY 123 Ca 0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.03 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 0.41 1.61 -1.05 -1.17 -4.93 118.70 115.84 2daw s GLU 124 Ca 0.00 -1.94 -0.23 0.00 -0.15 0.00 0.00 54.97 52.65 2daw s GLU 124 Cb 0.00 -2.03 -0.10 0.00 -0.44 0.00 0.00 34.13 31.56 2daw s GLU 124 CO 0.00 -0.36 0.98 -0.51 0.95 0.00 0.00 175.26 176.32 2daw s LEU 125 N -4.08 4.05 0.00 1.83 1.43 -1.26 -4.61 118.68 116.04 2daw s LEU 125 Ca 0.35 1.83 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 2daw s LEU 125 Cb 0.00 -4.36 0.00 0.00 0.03 0.00 0.00 46.19 41.86 2daw s LEU 125 CO 0.20 -0.39 0.00 0.00 0.23 0.00 0.00 176.35 176.39 2daw h VAL 127 N 0.00 0.70 0.00 0.00 3.04 -2.00 0.18 116.25 118.18 2daw h VAL 127 Ca 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.65 2daw h VAL 127 Cb 0.78 0.76 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2daw h VAL 127 CO 0.00 0.00 -0.18 0.00 -1.01 0.00 0.00 177.57 176.38 2daw h ALA 129 N 1.82 0.25 -1.44 0.00 0.00 -0.98 -3.37 119.26 115.53 2daw h ALA 129 Ca -0.00 -1.15 0.47 0.00 0.00 0.00 0.00 54.91 54.23 2daw h ALA 129 Cb 0.36 0.64 -0.12 0.00 0.00 0.00 0.00 17.79 18.67 2daw h ALA 129 CO 0.02 0.70 0.95 0.00 0.00 0.00 0.00 179.25 180.93 2daw h ALA 130 N -0.35 2.96 0.46 0.00 0.00 -1.29 0.31 119.26 121.34 2daw h ALA 130 Ca -0.32 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2daw h ALA 130 Cb 1.38 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2daw h ALA 130 CO -0.14 -1.59 -0.22 0.82 0.00 0.00 0.00 179.25 178.12 2daw h ILE 131 N 0.04 0.47 0.25 0.00 2.04 -1.69 -2.58 117.51 116.03 2daw h ILE 131 Ca 0.85 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 66.29 2daw h ILE 131 Cb 2.85 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 39.57 2daw h ILE 131 CO -0.36 0.06 -0.12 -0.61 0.00 0.00 0.00 178.15 177.12 2daw h GLN 132 N -0.88 -0.32 -0.87 2.37 5.75 -0.68 -2.37 115.11 118.10 2daw h GLN 132 Ca -0.06 0.02 0.22 0.00 -0.15 0.00 0.00 58.65 58.68 2daw h GLN 132 Cb 0.57 0.07 -0.15 0.00 1.07 0.00 0.00 27.48 29.04 2daw h GLN 132 CO 0.10 -0.11 0.04 2.35 -2.65 0.00 0.00 178.83 178.57 2daw h TRP 133 N -0.48 -0.01 0.42 3.99 7.01 -0.86 -1.06 115.95 124.96 2daw h TRP 133 Ca -0.03 0.06 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2daw h TRP 133 Cb 0.36 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.57 2daw h TRP 133 CO -0.02 -0.32 -0.20 -0.07 -2.79 0.00 0.00 178.44 175.05 2daw h LEU 134 N 0.08 -0.47 -0.84 0.65 3.38 -1.32 0.25 115.31 117.04 2daw h LEU 134 Ca 0.51 0.02 0.19 0.00 0.09 0.00 0.00 57.88 58.68 2daw h LEU 134 Cb 0.97 0.12 -0.16 0.00 0.09 0.00 0.00 40.66 41.69 2daw h LEU 134 CO -0.78 -0.29 -0.14 0.00 0.09 0.00 0.00 178.44 177.32 2daw n GLN 135 N -3.75 -0.07 0.03 1.13 6.02 -0.81 -0.01 117.38 119.92 2daw n GLN 135 Ca -0.07 1.30 -0.12 0.00 -0.01 0.00 0.00 57.00 58.09 2daw n GLN 135 Cb 0.22 -1.98 -0.09 0.00 1.02 0.00 0.00 30.24 29.41 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 -0.11 -0.84 1.08 3.58 -1.19 -3.25 116.42 115.68 2daw h ASP 136 Ca 0.44 -0.41 -0.43 0.00 0.42 0.00 0.00 57.03 57.04 2daw h ASP 136 Cb 0.75 0.03 -0.16 0.00 1.72 0.00 0.00 39.33 41.67 2daw h ASP 136 CO -0.84 0.39 0.34 0.59 -2.88 0.00 0.00 179.24 176.83 2daw n ASN 137 N -4.92 6.38 -0.07 2.28 3.02 0.98 -4.21 115.26 118.73 2daw n ASN 137 Ca -0.08 -3.12 -0.15 0.00 -0.03 0.00 0.00 54.58 51.19 2daw n ASN 137 Cb 0.26 -1.20 -0.05 0.00 -0.61 0.00 0.00 39.78 38.18 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 0.86 1.06 -0.02 6.41 2.88 0.69 -4.65 113.62 120.84 2daw n SER 138 Ca 0.44 0.18 -0.11 0.00 -1.33 0.00 0.00 58.87 58.05 2daw n SER 138 Cb 0.59 -0.44 -0.06 0.00 -0.75 0.00 0.00 64.21 63.55 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 -0.53 0.14 -0.95 -1.46 0.00 -1.79 -2.82 119.26 111.86 2daw h ALA 139 Ca -0.36 -0.10 0.38 0.00 0.00 0.00 0.00 54.91 54.84 2daw h ALA 139 Cb 1.30 -0.04 -0.17 0.00 0.00 0.00 0.00 17.79 18.87 2daw h ALA 139 CO -0.22 -0.27 0.47 -1.13 0.00 0.00 0.00 179.25 178.10 2daw n SER 140 N -4.91 0.29 0.04 0.00 3.41 -1.26 -0.32 113.62 110.86 2daw n SER 140 Ca -0.05 1.58 -0.09 0.00 -0.26 0.00 0.00 58.87 60.04 2daw n SER 140 Cb 0.11 -0.75 -0.07 0.00 -0.26 0.00 0.00 64.21 63.25 2daw n SER 140 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2daw h TYR 141 N 0.00 -0.18 -0.46 7.33 -1.99 -1.77 -3.34 116.97 116.56 2daw h TYR 141 Ca 0.78 -0.00 0.09 0.00 2.00 0.00 0.00 58.73 61.60 2daw h TYR 141 Cb 2.04 0.06 -0.10 0.00 2.00 0.00 0.00 36.73 40.73 2daw h TYR 141 CO -0.05 0.22 -0.33 0.74 -0.00 0.00 0.00 178.16 178.74 2daw h PHE 142 N -0.93 -0.91 0.00 4.88 -1.00 -0.44 -3.40 116.94 115.14 2daw h PHE 142 Ca -0.02 0.06 -0.54 0.00 2.81 0.00 0.00 57.97 60.28 2daw h PHE 142 Cb 0.49 0.47 -0.04 0.00 3.61 0.00 0.00 35.95 40.47 2daw h PHE 142 CO 0.08 -0.38 1.12 1.28 -1.61 0.00 0.00 178.31 178.81 2daw n LEU 143 N -5.42 0.48 -3.70 1.54 4.77 0.35 -4.83 117.00 110.19 2daw n LEU 143 Ca 0.02 0.42 -0.06 0.00 -0.03 0.00 0.00 56.01 56.36 2daw n LEU 143 Cb 0.34 -0.70 -0.02 0.00 -2.33 0.00 0.00 43.42 40.71 2daw n LEU 143 CO 0.05 -0.59 0.64 0.21 -1.33 0.00 0.00 177.39 176.37 2daw s ASN 144 N 5.32 -0.26 -0.21 -1.43 3.04 -1.26 -5.01 114.94 115.13 2daw s ASN 144 Ca 0.97 -0.34 -0.04 0.00 0.04 0.00 0.00 52.86 53.48 2daw s ASN 144 Cb -1.11 0.53 -0.02 0.00 -1.54 0.00 0.00 41.25 39.11 2daw s ASN 144 CO 0.48 -0.95 -0.03 -0.60 -3.04 0.00 0.00 177.10 172.96 2daw s ARG 145 N -3.42 3.49 0.11 0.43 3.52 -1.26 -5.10 118.95 116.71 2daw s ARG 145 Ca 0.10 -0.58 0.10 0.00 -0.13 0.00 0.00 55.73 55.22 2daw s ARG 145 Cb -0.02 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.31 2daw s ARG 145 CO 0.00 -0.08 -0.26 0.15 -0.81 0.00 0.00 175.30 174.30 2daw s LYS 146 N 1.21 1.55 0.66 5.12 -0.14 -1.26 -5.15 119.74 121.73 2daw s LYS 146 Ca 0.03 -1.27 0.03 0.00 -1.36 0.00 0.00 55.97 53.41 2daw s LYS 146 Cb -0.14 -1.95 0.12 0.00 -1.68 0.00 0.00 37.83 34.18 2daw s LYS 146 CO -0.00 0.47 0.90 1.28 -0.76 0.00 0.00 175.35 177.24 2daw n LEU 147 N 1.12 0.00 -3.58 3.17 7.99 -1.26 -5.14 117.00 119.30 2daw n LEU 147 Ca -0.17 -2.20 -0.13 0.00 -0.01 0.00 0.00 56.01 53.50 2daw n LEU 147 Cb 0.53 -0.55 -0.05 0.00 -0.11 0.00 0.00 43.42 43.24 2daw n LEU 147 CO 0.24 -0.88 0.26 0.54 -1.51 0.00 0.00 177.39 176.04 2daw s VAL 148 N -2.82 0.04 0.46 4.08 0.11 -1.26 -5.18 120.40 115.83 2daw s VAL 148 Ca 0.63 -0.30 0.03 0.00 -2.93 0.00 0.00 61.98 59.40 2daw s VAL 148 Cb -0.04 -1.01 -0.03 0.00 -1.53 0.00 0.00 36.38 33.77 2daw s VAL 148 CO 0.41 -0.17 0.03 -0.94 -3.33 0.00 0.00 175.10 171.10 2daw s SER 149 N -2.21 3.73 0.01 3.54 1.04 -1.26 -5.17 113.70 113.39 2daw s SER 149 Ca -0.03 -1.60 0.00 0.00 0.48 0.00 0.00 55.95 54.80 2daw s SER 149 Cb -0.00 0.33 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 2daw s SER 149 CO -0.05 -0.79 -0.02 -0.83 0.98 0.00 0.00 173.24 172.54 2daw s GLY 150 N -3.78 0.15 0.98 7.32 0.00 -1.26 -5.16 107.32 105.57 2daw s GLY 150 Ca 0.16 -0.35 -0.16 0.00 0.00 0.00 0.00 44.72 44.36 2daw s GLY 150 CO 0.08 -0.40 0.87 -1.55 0.00 0.00 0.00 173.10 172.11 2daw n PRO 151 N 2.20 -2.72 -4.59 2.90 -0.04 -1.26 -5.10 135.00 126.39 2daw n PRO 151 Ca -0.19 -1.40 -0.28 0.00 -0.04 0.00 0.00 63.50 61.60 2daw n PRO 151 Cb 0.57 -1.31 -0.09 0.00 -0.04 0.00 0.00 33.50 32.64 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 -3.86 3.24 0.32 3.54 0.15 -1.26 -5.17 113.70 110.66 2daw s SER 152 Ca 0.57 -1.60 -0.16 0.00 0.70 0.00 0.00 55.95 55.46 2daw s SER 152 Cb -0.06 0.34 0.03 0.00 -1.71 0.00 0.00 66.02 64.62 2daw s SER 152 CO 0.43 -0.82 0.68 -0.55 1.20 0.00 0.00 173.24 174.19 2daw s SER 153 N -3.68 -0.02 0.00 5.45 0.15 -1.26 -5.38 113.70 108.95 2daw s SER 153 Ca 0.21 -0.94 0.00 0.00 0.70 0.00 0.00 55.95 55.92 2daw s SER 153 Cb 0.04 0.75 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 2daw s SER 153 CO 0.11 -1.44 0.04 0.61 1.20 0.00 0.00 173.24 173.76