#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsa s LYS 2 N 0.00 2.52 -0.24 2.12 1.02 -0.25 -1.04 119.74 123.86 2dsa s LYS 2 Ca 0.00 -0.90 -0.04 0.00 0.02 0.00 0.00 55.97 55.05 2dsa s LYS 2 Cb 0.00 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 2dsa s LYS 2 CO 0.00 0.40 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.63 2dsa s LEU 3 N -0.21 3.14 -0.11 3.17 2.96 -0.34 -0.80 118.68 126.48 2dsa s LEU 3 Ca -0.02 -0.58 -0.29 0.00 -0.22 0.00 0.00 54.13 53.02 2dsa s LEU 3 Cb -0.13 -1.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 2dsa s LEU 3 CO 0.03 -0.08 0.97 -0.31 -1.32 0.00 0.00 176.35 175.64 2dsa s TYR 4 N 1.44 3.50 0.08 5.38 1.51 -0.70 -0.88 117.35 127.68 2dsa s TYR 4 Ca 0.04 1.53 -0.03 0.00 -1.01 0.00 0.00 57.07 57.60 2dsa s TYR 4 Cb -0.15 -3.15 -0.03 0.00 -0.11 0.00 0.00 41.96 38.52 2dsa s TYR 4 CO -0.03 -0.22 0.05 1.52 -1.11 0.00 0.00 175.55 175.76 2dsa s TYR 5 N 2.00 0.51 -0.05 2.71 -0.85 -0.57 -3.44 117.35 117.67 2dsa s TYR 5 Ca 0.46 -0.99 0.03 0.00 -0.52 0.00 0.00 57.07 56.05 2dsa s TYR 5 Cb -0.18 -0.33 0.01 0.00 0.38 0.00 0.00 41.96 41.84 2dsa s TYR 5 CO 0.17 -0.46 -0.13 0.45 -1.52 0.00 0.00 175.55 174.06 2dsa s SER 6 N -2.94 1.69 -0.13 -0.18 0.15 -1.26 -0.53 113.70 110.50 2dsa s SER 6 Ca 0.11 -0.28 -0.39 0.00 0.70 0.00 0.00 55.95 56.10 2dsa s SER 6 Cb 0.07 -0.59 -0.16 0.00 -1.71 0.00 0.00 66.02 63.64 2dsa s SER 6 CO -0.07 0.08 1.60 -2.65 1.20 0.00 0.00 173.24 173.40 2dsa n PRO 7 N 3.45 1.22 0.00 5.44 -0.02 -1.26 -1.43 135.00 142.40 2dsa n PRO 7 Ca -0.20 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2dsa n PRO 7 Cb 0.53 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2dsa n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dsa n GLY 8 N 3.59 2.71 3.60 -1.23 0.00 -1.26 -5.01 105.19 107.59 2dsa n GLY 8 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 2dsa n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsa s ALA 9 N -2.53 0.63 0.16 4.61 0.00 -0.51 -4.84 121.76 119.27 2dsa s ALA 9 Ca 0.00 -1.01 0.32 0.00 0.00 0.00 0.00 51.96 51.28 2dsa s ALA 9 Cb 0.00 -2.86 1.70 0.00 0.00 0.00 0.00 23.12 21.96 2dsa s ALA 9 CO 0.00 -3.62 1.99 0.00 0.00 0.00 0.00 175.76 174.13 2dsa h SER 11 N 0.00 0.00 0.20 0.00 4.64 -1.85 -1.29 113.55 115.25 2dsa h SER 11 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2dsa h SER 11 Cb 0.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2dsa h SER 11 CO 0.00 0.00 -0.05 0.25 -0.87 0.00 0.00 176.83 176.16 2dsa h LEU 12 N 0.00 0.00 0.60 5.97 5.85 -1.48 -1.76 115.31 124.49 2dsa h LEU 12 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2dsa h LEU 12 Cb 0.11 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.14 2dsa h LEU 12 CO 0.00 0.05 -0.29 -1.28 -0.34 0.00 0.00 178.44 176.58 2dsa h SER 13 N 0.00 -0.68 -0.86 1.25 0.87 -1.46 -0.41 113.55 112.25 2dsa h SER 13 Ca -0.00 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.66 2dsa h SER 13 Cb 0.16 0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.24 2dsa h SER 13 CO 0.01 -0.33 0.56 1.55 -0.53 0.00 0.00 176.83 178.09 2dsa h PRO 14 N -1.14 0.88 -0.14 2.24 0.13 -1.73 -1.38 132.00 130.87 2dsa h PRO 14 Ca -0.08 -0.05 0.04 0.00 -0.87 0.00 0.00 66.00 65.03 2dsa h PRO 14 Cb 0.62 -0.20 -0.07 0.00 0.13 0.00 0.00 31.00 31.48 2dsa h PRO 14 CO 0.14 0.58 -0.46 1.25 -0.23 0.00 0.00 178.00 179.28 2dsa h HIS 15 N 0.91 -1.32 -0.73 1.56 2.76 -1.29 0.25 115.15 117.29 2dsa h HIS 15 Ca 0.38 0.05 0.06 0.00 -2.20 0.00 0.00 60.37 58.67 2dsa h HIS 15 Cb 0.31 0.60 -0.06 0.00 1.55 0.00 0.00 27.41 29.81 2dsa h HIS 15 CO -0.00 -0.50 0.42 0.82 -1.30 0.00 0.00 177.93 177.37 2dsa h ILE 16 N -0.52 0.99 -0.41 6.26 2.04 -0.89 -2.49 117.51 122.48 2dsa h ILE 16 Ca 0.07 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 2dsa h ILE 16 Cb 0.65 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2dsa h ILE 16 CO -0.41 0.14 0.25 0.00 0.00 0.00 0.00 178.15 178.13 2dsa h ALA 17 N 1.37 0.53 -0.81 1.87 0.00 -0.39 0.37 119.26 122.20 2dsa h ALA 17 Ca 0.33 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.27 2dsa h ALA 17 Cb 0.19 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 2dsa h ALA 17 CO -0.18 0.02 0.46 -0.07 0.00 0.00 0.00 179.25 179.48 2dsa h LEU 18 N 0.55 0.66 -0.34 0.00 3.38 -0.25 0.85 115.31 120.16 2dsa h LEU 18 Ca 0.15 0.05 -0.19 0.00 0.09 0.00 0.00 57.88 57.98 2dsa h LEU 18 Cb -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2dsa h LEU 18 CO -0.03 0.38 -0.59 0.03 0.09 0.00 0.00 178.44 178.32 2dsa h ARG 19 N 0.78 0.78 -1.00 1.13 3.08 -1.06 -1.40 114.38 116.68 2dsa h ARG 19 Ca 0.39 -0.51 0.02 0.00 0.07 0.00 0.00 59.98 59.95 2dsa h ARG 19 Cb 0.36 0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 2dsa h ARG 19 CO -0.25 1.14 0.66 0.93 -1.07 0.00 0.00 179.97 181.38 2dsa h GLU 20 N 0.58 1.27 0.00 0.04 4.39 -0.55 -2.36 114.58 117.95 2dsa h GLU 20 Ca 0.00 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 2dsa h GLU 20 Cb 1.18 -0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 29.54 2dsa h GLU 20 CO 0.12 0.84 -0.13 0.00 -1.16 0.00 0.00 179.01 178.68 2dsa h ALA 21 N 1.39 0.98 -0.26 3.43 0.00 -0.61 -3.47 119.26 120.71 2dsa h ALA 21 Ca 0.38 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 2dsa h ALA 21 Cb -0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2dsa h ALA 21 CO -0.10 0.16 -0.07 0.41 0.00 0.00 0.00 179.25 179.65 2dsa n GLY 22 N 0.35 0.54 3.86 0.00 0.00 -0.58 -4.92 105.19 104.45 2dsa n GLY 22 Ca 0.01 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 2dsa n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dsa s LEU 23 N -0.88 3.78 0.11 0.99 1.43 -0.90 -5.03 118.68 118.18 2dsa s LEU 23 Ca 0.00 1.29 -0.30 0.00 -1.03 0.00 0.00 54.13 54.09 2dsa s LEU 23 Cb 0.00 -4.18 -0.06 0.00 0.03 0.00 0.00 46.19 41.98 2dsa s LEU 23 CO 0.00 -0.45 0.96 0.20 0.23 0.00 0.00 176.35 177.30 2dsa s ASN 24 N -3.07 7.50 0.14 2.29 0.01 -1.26 -4.81 114.94 115.74 2dsa s ASN 24 Ca 0.54 1.80 -0.24 0.00 -0.71 0.00 0.00 52.86 54.25 2dsa s ASN 24 Cb -0.10 -2.59 0.07 0.00 0.41 0.00 0.00 41.25 39.04 2dsa s ASN 24 CO 0.30 -0.07 0.74 0.72 -1.51 0.00 0.00 177.10 177.29 2dsa s PHE 25 N -0.02 -0.37 -0.15 2.20 -0.71 -1.26 -4.57 117.98 113.10 2dsa s PHE 25 Ca 0.47 0.12 0.01 0.00 -1.04 0.00 0.00 56.93 56.49 2dsa s PHE 25 Cb -0.23 0.59 0.01 0.00 -1.21 0.00 0.00 43.02 42.18 2dsa s PHE 25 CO 0.30 -0.85 -0.19 -2.00 -1.34 0.00 0.00 175.22 171.14 2dsa s GLU 26 N -3.56 3.09 0.05 1.99 2.12 -0.21 -5.01 118.70 117.17 2dsa s GLU 26 Ca 0.05 -0.81 -0.30 0.00 0.36 0.00 0.00 54.97 54.27 2dsa s GLU 26 Cb -0.02 -2.52 -0.05 0.00 0.26 0.00 0.00 34.13 31.80 2dsa s GLU 26 CO -0.06 -0.02 1.12 -0.51 -0.54 0.00 0.00 175.26 175.25 2dsa s LEU 27 N 0.86 4.38 -0.25 2.70 1.43 -1.26 -1.20 118.68 125.34 2dsa s LEU 27 Ca -0.05 1.90 0.02 0.00 -1.03 0.00 0.00 54.13 54.97 2dsa s LEU 27 Cb -0.15 -3.58 0.06 0.00 0.03 0.00 0.00 46.19 42.55 2dsa s LEU 27 CO -0.02 -0.39 -0.08 -0.69 0.23 0.00 0.00 176.35 175.40 2dsa s VAL 28 N 0.97 1.82 0.34 -1.59 1.01 -0.06 -4.93 120.40 117.97 2dsa s VAL 28 Ca 0.56 -1.40 -0.27 0.00 0.00 0.00 0.00 61.98 60.87 2dsa s VAL 28 Cb -0.27 -2.01 -0.09 0.00 0.00 0.00 0.00 36.38 34.01 2dsa s VAL 28 CO 0.29 -0.06 1.13 -1.58 0.00 0.00 0.00 175.10 174.88 2dsa s GLN 29 N 1.26 4.36 -0.09 2.72 0.74 -1.26 -1.51 119.66 125.88 2dsa s GLN 29 Ca -0.07 1.80 0.04 0.00 0.05 0.00 0.00 55.36 57.18 2dsa s GLN 29 Cb -0.19 -2.91 0.00 0.00 1.10 0.00 0.00 33.01 31.01 2dsa s GLN 29 CO -0.06 -0.04 -0.22 0.08 -0.55 0.00 0.00 175.29 174.50 2dsa s VAL 30 N -1.32 1.91 -0.58 1.34 1.01 0.30 -0.76 120.40 122.30 2dsa s VAL 30 Ca 0.51 -0.93 -0.27 0.00 0.00 0.00 0.00 61.98 61.29 2dsa s VAL 30 Cb -0.31 -1.66 0.03 0.00 0.00 0.00 0.00 36.38 34.45 2dsa s VAL 30 CO 0.39 0.53 1.12 -0.62 0.00 0.00 0.00 175.10 176.51 2dsa s ASP 31 N 0.39 6.40 0.28 3.32 -1.08 0.56 -4.59 116.67 121.96 2dsa s ASP 31 Ca -0.18 -0.07 0.25 0.00 -0.52 0.00 0.00 52.55 52.02 2dsa s ASP 31 Cb -0.18 -2.52 1.01 0.00 -1.46 0.00 0.00 42.92 39.78 2dsa s ASP 31 CO 0.08 -1.42 1.74 -0.07 0.52 0.00 0.00 175.17 176.02 2dsa h LEU 32 N 11.68 0.00 0.00 -1.34 3.38 -1.96 0.70 115.31 127.77 2dsa h LEU 32 Ca -0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2dsa h LEU 32 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2dsa h LEU 32 CO 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 179.69 2dsa h ALA 33 N 2.25 0.00 0.00 1.53 0.00 -1.97 -3.38 119.26 117.69 2dsa h ALA 33 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2dsa h ALA 33 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dsa h ALA 33 CO 0.00 0.00 -0.61 -1.13 0.00 0.00 0.00 179.25 177.51 2dsa n SER 34 N -4.65 0.69 -2.90 0.00 3.41 -1.18 -4.98 113.62 104.00 2dsa n SER 34 Ca -0.07 0.12 -0.20 0.00 -0.26 0.00 0.00 58.87 58.45 2dsa n SER 34 Cb 0.36 0.15 0.05 0.00 -0.26 0.00 0.00 64.21 64.50 2dsa n SER 34 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dsa n LYS 35 N -2.08 -5.44 -4.69 4.33 4.01 0.24 -4.96 118.16 109.56 2dsa n LYS 35 Ca 0.03 0.78 -0.33 0.00 -0.51 0.00 0.00 58.31 58.28 2dsa n LYS 35 Cb 0.43 -5.46 -0.12 0.00 -0.51 0.00 0.00 35.03 29.37 2dsa n LYS 35 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2dsa s LYS 36 N -5.80 2.88 1.05 1.97 -0.14 -1.19 -1.07 119.74 117.45 2dsa s LYS 36 Ca 0.37 -0.60 -0.18 0.00 -1.36 0.00 0.00 55.97 54.20 2dsa s LYS 36 Cb -0.16 -2.58 0.26 0.00 -1.68 0.00 0.00 37.83 33.67 2dsa s LYS 36 CO 0.46 0.54 0.99 0.25 -0.76 0.00 0.00 175.35 176.83 2dsa n THR 37 N 2.58 0.00 0.04 2.17 -2.24 -0.28 -0.32 114.28 116.23 2dsa n THR 37 Ca -0.18 -0.48 -0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2dsa n THR 37 Cb 0.53 -1.26 0.30 0.00 -2.10 0.00 0.00 70.33 67.79 2dsa n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dsa h ALA 38 N -2.54 1.33 -0.00 6.98 0.00 -1.28 -2.39 119.26 121.36 2dsa h ALA 38 Ca -0.36 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2dsa h ALA 38 Cb 1.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2dsa h ALA 38 CO 0.24 0.45 -0.00 -1.13 0.00 0.00 0.00 179.25 178.81 2dsa n SER 39 N -4.23 0.07 0.00 0.00 3.41 -1.26 -4.90 113.62 106.71 2dsa n SER 39 Ca 0.00 -0.81 0.00 0.00 -0.26 0.00 0.00 58.87 57.80 2dsa n SER 39 Cb 0.30 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 2dsa n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dsa n GLY 40 N 1.08 0.71 3.77 5.00 0.00 -0.90 -5.05 105.19 109.80 2dsa n GLY 40 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2dsa n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dsa s GLN 41 N -0.27 4.08 -0.27 1.61 0.74 -1.26 -4.75 119.66 119.54 2dsa s GLN 41 Ca 0.00 1.80 -0.29 0.00 0.05 0.00 0.00 55.36 56.93 2dsa s GLN 41 Cb 0.00 -2.68 -0.03 0.00 1.10 0.00 0.00 33.01 31.40 2dsa s GLN 41 CO 0.00 -0.28 1.83 0.34 -0.55 0.00 0.00 175.29 176.63 2dsa s ASP 42 N -1.17 5.96 0.47 6.67 2.15 -1.26 -1.12 116.67 128.36 2dsa s ASP 42 Ca 0.57 1.53 0.25 0.00 0.43 0.00 0.00 52.55 55.33 2dsa s ASP 42 Cb -0.30 -2.52 1.13 0.00 -0.30 0.00 0.00 42.92 40.92 2dsa s ASP 42 CO 0.38 -1.62 1.92 0.22 -0.17 0.00 0.00 175.17 175.90 2dsa h TYR 43 N 12.64 0.00 0.00 -5.34 3.20 -1.45 -1.64 116.97 124.38 2dsa h TYR 43 Ca -0.36 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.51 2dsa h TYR 43 Cb 1.18 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.45 2dsa h TYR 43 CO 0.94 0.19 0.00 -0.07 -1.64 0.00 0.00 178.16 177.59 2dsa h LEU 44 N 0.00 0.00 -1.48 2.82 4.07 -1.77 0.43 115.31 119.39 2dsa h LEU 44 Ca -0.00 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.91 2dsa h LEU 44 Cb 0.59 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 2dsa h LEU 44 CO 0.02 0.00 -0.21 -0.33 -1.08 0.00 0.00 178.44 176.85 2dsa h GLU 45 N 0.00 0.00 0.00 1.13 5.08 -1.69 -3.19 114.58 115.91 2dsa h GLU 45 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2dsa h GLU 45 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2dsa h GLU 45 CO 0.00 0.21 -1.07 0.28 -1.00 0.00 0.00 179.01 177.43 2dsa n VAL 46 N -3.58 1.48 -3.96 3.13 0.31 0.00 -4.84 118.33 110.88 2dsa n VAL 46 Ca -0.01 0.07 -0.34 0.00 -0.01 0.00 0.00 64.34 64.05 2dsa n VAL 46 Cb 0.35 -2.26 -0.14 0.00 -0.91 0.00 0.00 33.84 30.88 2dsa n VAL 46 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2dsa s ASN 47 N -6.19 4.73 0.55 4.52 2.47 -0.37 -5.00 114.94 115.65 2dsa s ASN 47 Ca -0.25 -1.29 0.27 0.00 0.42 0.00 0.00 52.86 52.01 2dsa s ASN 47 Cb 0.05 -1.66 1.45 0.00 -1.45 0.00 0.00 41.25 39.64 2dsa s ASN 47 CO 0.38 -0.23 1.99 -0.65 -3.72 0.00 0.00 177.10 174.87 2dsa h PRO 48 N 7.93 0.00 0.00 0.43 0.11 -1.83 -0.14 132.00 138.50 2dsa h PRO 48 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 2dsa h PRO 48 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dsa h PRO 48 CO 0.51 0.00 -0.11 0.00 -0.21 0.00 0.00 178.00 178.19 2dsa h ALA 49 N 1.68 0.94 0.00 -0.75 0.00 -1.95 -3.48 119.26 115.70 2dsa h ALA 49 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2dsa h ALA 49 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2dsa h ALA 49 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2dsa n GLY 50 N 1.18 0.75 3.74 0.00 0.00 -0.07 -5.05 105.19 105.75 2dsa n GLY 50 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 2dsa n GLY 50 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dsa s TYR 51 N -2.76 2.93 0.29 1.61 -0.85 -1.26 -4.95 117.35 112.36 2dsa s TYR 51 Ca 0.00 -0.16 0.02 0.00 -0.52 0.00 0.00 57.07 56.41 2dsa s TYR 51 Cb 0.00 -1.32 -0.03 0.00 0.38 0.00 0.00 41.96 40.99 2dsa s TYR 51 CO 0.00 0.56 0.47 0.14 -1.52 0.00 0.00 175.55 175.20 2dsa s VAL 52 N -2.19 5.17 0.65 -3.49 -7.23 -1.26 -4.57 120.40 107.47 2dsa s VAL 52 Ca 0.32 -0.61 -0.11 0.00 -1.81 0.00 0.00 61.98 59.77 2dsa s VAL 52 Cb -0.07 -3.84 -0.02 0.00 0.56 0.00 0.00 36.38 33.00 2dsa s VAL 52 CO 0.23 -0.43 1.05 -2.16 -0.31 0.00 0.00 175.10 173.47 2dsa s PRO 53 N -4.07 3.36 -0.02 4.82 0.04 -1.26 -4.73 135.00 133.14 2dsa s PRO 53 Ca 0.38 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.09 2dsa s PRO 53 Cb -0.10 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.41 2dsa s PRO 53 CO 0.33 -0.72 0.01 0.00 0.04 0.00 0.00 177.00 176.66 2dsa s LEU 55 N 0.90 3.79 -0.24 0.00 2.96 0.12 -1.73 118.68 124.47 2dsa s LEU 55 Ca -0.08 -0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 53.75 2dsa s LEU 55 Cb -0.11 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 2dsa s LEU 55 CO -0.02 0.07 0.07 -1.58 -1.32 0.00 0.00 176.35 173.57 2dsa s GLN 56 N 1.01 3.69 0.55 1.98 0.74 0.01 -0.52 119.66 127.13 2dsa s GLN 56 Ca 0.05 -0.46 -0.14 0.00 0.05 0.00 0.00 55.36 54.86 2dsa s GLN 56 Cb -0.14 -3.32 -0.06 0.00 1.10 0.00 0.00 33.01 30.59 2dsa s GLN 56 CO 0.03 -0.14 0.98 -0.51 -0.55 0.00 0.00 175.29 175.11 2dsa s LEU 57 N 1.49 3.48 0.29 3.68 1.43 0.12 -1.09 118.68 128.07 2dsa s LEU 57 Ca 0.06 1.46 0.00 0.00 -1.03 0.00 0.00 54.13 54.62 2dsa s LEU 57 Cb -0.15 -4.44 0.68 0.00 0.03 0.00 0.00 46.19 42.31 2dsa s LEU 57 CO 0.04 -0.69 1.49 0.47 0.23 0.00 0.00 176.35 177.88 2dsa n ASP 58 N -2.06 -0.15 0.00 2.29 10.43 -1.26 -0.48 116.55 125.32 2dsa n ASP 58 Ca 0.06 1.62 0.12 0.00 2.57 0.00 0.00 54.79 59.16 2dsa n ASP 58 Cb 0.54 -0.57 0.73 0.00 1.84 0.00 0.00 41.12 43.66 2dsa n ASP 58 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 2dsa n ASP 59 N -5.43 0.00 0.00 -2.24 3.85 -1.26 -4.89 116.55 106.58 2dsa n ASP 59 Ca 0.21 -1.14 0.00 0.00 -0.71 0.00 0.00 54.79 53.15 2dsa n ASP 59 Cb 0.69 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.46 2dsa n ASP 59 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2dsa n GLY 60 N 0.83 2.79 3.74 6.12 0.00 0.37 -5.08 105.19 113.96 2dsa n GLY 60 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2dsa n GLY 60 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dsa s ARG 61 N -0.94 2.65 0.17 1.61 0.52 -1.26 -4.69 118.95 117.01 2dsa s ARG 61 Ca 0.00 1.96 0.10 0.00 -0.52 0.00 0.00 55.73 57.27 2dsa s ARG 61 Cb 0.00 -1.87 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 2dsa s ARG 61 CO 0.00 -1.49 -0.23 0.95 0.02 0.00 0.00 175.30 174.55 2dsa s THR 62 N -1.52 2.16 -0.05 0.02 -4.23 -1.26 0.11 115.64 110.88 2dsa s THR 62 Ca 0.80 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 59.38 2dsa s THR 62 Cb -0.34 -2.00 0.02 0.00 1.34 0.00 0.00 72.50 71.52 2dsa s THR 62 CO 0.38 -0.14 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.04 2dsa s LEU 63 N -2.56 1.41 0.51 4.79 2.96 0.32 -4.99 118.68 121.12 2dsa s LEU 63 Ca 0.18 -0.16 0.06 0.00 -0.22 0.00 0.00 54.13 53.99 2dsa s LEU 63 Cb -0.08 -0.51 0.01 0.00 0.50 0.00 0.00 46.19 46.12 2dsa s LEU 63 CO 0.08 -0.03 0.33 0.42 -1.32 0.00 0.00 176.35 175.83 2dsa s THR 64 N 0.83 1.83 0.02 3.68 -4.23 -1.26 -0.71 115.64 115.81 2dsa s THR 64 Ca -0.12 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 2dsa s THR 64 Cb -0.15 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.32 2dsa s THR 64 CO 0.01 0.00 0.00 -0.62 -0.54 0.00 0.00 174.62 173.47 2dsa n GLU 65 N -1.62 -1.41 -0.38 3.99 -0.58 -1.26 -4.36 120.64 115.02 2dsa n GLU 65 Ca -0.02 1.38 -0.04 0.00 -0.42 0.00 0.00 57.16 58.06 2dsa n GLU 65 Cb 0.64 -1.45 -0.00 0.00 -0.57 0.00 0.00 31.44 30.06 2dsa n GLU 65 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2dsa h GLY 66 N 1.13 -0.21 0.80 0.62 0.00 -1.94 -1.23 103.07 102.24 2dsa h GLY 66 Ca 0.00 0.60 0.11 0.00 0.00 0.00 0.00 47.33 48.04 2dsa h GLY 66 CO 0.00 -0.13 0.51 -2.55 0.00 0.00 0.00 176.54 174.36 2dsa h PRO 67 N -0.02 0.60 -0.04 4.80 0.11 -1.90 -0.47 132.00 135.08 2dsa h PRO 67 Ca 0.28 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 2dsa h PRO 67 Cb 0.54 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 2dsa h PRO 67 CO -0.95 0.40 -0.04 0.00 -0.21 0.00 0.00 178.00 177.20 2dsa h ALA 68 N 1.62 0.06 -0.24 -0.75 0.00 -1.51 -3.13 119.26 115.31 2dsa h ALA 68 Ca 0.36 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2dsa h ALA 68 Cb 0.57 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2dsa h ALA 68 CO -0.14 -0.17 -0.06 0.82 0.00 0.00 0.00 179.25 179.70 2dsa h ILE 69 N -0.36 0.75 0.00 0.00 2.04 -0.98 -1.64 117.51 117.32 2dsa h ILE 69 Ca 0.01 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 2dsa h ILE 69 Cb 0.53 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2dsa h ILE 69 CO 0.01 0.00 -0.29 -0.37 0.00 0.00 0.00 178.15 177.50 2dsa h VAL 70 N -0.01 0.83 -0.09 1.67 -1.51 -1.20 -0.77 116.25 115.17 2dsa h VAL 70 Ca 0.12 -1.15 -0.14 0.00 -1.23 0.00 0.00 66.70 64.29 2dsa h VAL 70 Cb 0.18 1.70 0.01 0.00 -2.13 0.00 0.00 31.29 31.05 2dsa h VAL 70 CO -0.25 0.28 -0.51 1.56 -1.23 0.00 0.00 177.57 177.42 2dsa h GLN 71 N 0.00 0.51 -0.21 5.19 4.20 -1.45 -1.71 115.11 121.64 2dsa h GLN 71 Ca -0.00 -0.42 0.05 0.00 0.06 0.00 0.00 58.65 58.33 2dsa h GLN 71 Cb 0.68 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.50 2dsa h GLN 71 CO 0.04 1.05 -0.10 -0.92 -0.67 0.00 0.00 178.83 178.23 2dsa h TYR 72 N 0.09 -0.23 -0.06 2.96 5.03 -0.91 -1.28 116.97 122.57 2dsa h TYR 72 Ca -0.04 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.32 2dsa h TYR 72 Cb 1.16 0.14 -0.03 0.00 1.55 0.00 0.00 36.73 39.54 2dsa h TYR 72 CO 0.12 -0.15 -0.12 0.28 -1.32 0.00 0.00 178.16 176.96 2dsa h VAL 73 N -0.07 0.68 -0.97 1.81 2.07 -1.16 -2.45 116.25 116.17 2dsa h VAL 73 Ca 0.11 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 2dsa h VAL 73 Cb 0.24 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 2dsa h VAL 73 CO -0.25 0.00 0.63 0.00 0.02 0.00 0.00 177.57 177.97 2dsa h ALA 74 N 0.84 1.42 0.00 1.67 0.00 -1.19 -2.27 119.26 119.71 2dsa h ALA 74 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2dsa h ALA 74 Cb 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2dsa h ALA 74 CO -0.16 0.46 0.00 -0.44 0.00 0.00 0.00 179.25 179.11 2dsa h ASP 75 N 1.16 0.00 0.71 0.00 3.45 -0.76 -2.53 116.42 118.45 2dsa h ASP 75 Ca 0.41 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.76 2dsa h ASP 75 Cb 0.11 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 2dsa h ASP 75 CO -0.15 0.00 -0.52 1.56 -1.57 0.00 0.00 179.24 178.56 2dsa h GLN 76 N 0.00 0.00 -2.10 3.56 1.08 -1.14 -3.37 115.11 113.14 2dsa h GLN 76 Ca 0.00 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.63 2dsa h GLN 76 Cb 0.37 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.40 2dsa h GLN 76 CO 0.00 0.52 -0.87 0.28 -0.95 0.00 0.00 178.83 177.81 2dsa n VAL 77 N -3.70 0.87 0.25 -0.54 0.31 -0.95 -4.95 118.33 109.61 2dsa n VAL 77 Ca -0.01 -4.67 0.14 0.00 -0.01 0.00 0.00 64.34 59.80 2dsa n VAL 77 Cb 0.57 -1.85 0.82 0.00 -0.91 0.00 0.00 33.84 32.48 2dsa n VAL 77 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2dsa h PRO 78 N 3.92 0.00 -0.19 5.55 0.13 -1.73 -0.28 132.00 139.40 2dsa h PRO 78 Ca 0.13 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.30 2dsa h PRO 78 Cb 0.77 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 2dsa h PRO 78 CO 0.64 0.00 0.14 0.78 -0.23 0.00 0.00 178.00 179.33 2dsa h GLY 79 N 0.00 0.07 1.93 1.56 0.00 -1.92 -2.01 103.07 102.70 2dsa h GLY 79 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2dsa h GLY 79 CO -0.00 0.02 -0.05 0.28 0.00 0.00 0.00 176.54 176.79 2dsa n LYS 80 N -4.49 0.22 -3.79 4.80 5.02 -0.11 -4.95 118.16 114.86 2dsa n LYS 80 Ca 0.01 0.17 -0.28 0.00 -2.02 0.00 0.00 58.31 56.20 2dsa n LYS 80 Cb 0.23 -1.75 0.05 0.00 -0.02 0.00 0.00 35.03 33.54 2dsa n LYS 80 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2dsa n GLN 81 N -2.13 -6.35 0.08 1.97 6.02 -0.76 -4.88 117.38 111.33 2dsa n GLN 81 Ca 0.06 0.68 0.11 0.00 -0.01 0.00 0.00 57.00 57.84 2dsa n GLN 81 Cb 0.42 -5.62 0.45 0.00 1.02 0.00 0.00 30.24 26.51 2dsa n GLN 81 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2dsa n LEU 82 N -4.77 0.47 -3.79 1.08 4.77 -1.26 -4.71 117.00 108.79 2dsa n LEU 82 Ca 0.01 0.59 -0.13 0.00 -0.03 0.00 0.00 56.01 56.46 2dsa n LEU 82 Cb 0.55 -0.50 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 2dsa n LEU 82 CO 0.72 -0.35 -0.04 0.00 -1.33 0.00 0.00 177.39 176.38 2dsa s ALA 83 N -3.17 -0.65 0.78 -1.18 0.00 -1.26 -0.65 121.76 115.63 2dsa s ALA 83 Ca 0.07 0.30 -0.13 0.00 0.00 0.00 0.00 51.96 52.19 2dsa s ALA 83 Cb 0.11 -0.02 0.07 0.00 0.00 0.00 0.00 23.12 23.28 2dsa s ALA 83 CO 0.42 -0.22 1.19 -2.14 0.00 0.00 0.00 175.76 175.00 2dsa s PRO 84 N -1.07 1.82 0.27 0.00 0.02 -1.26 -4.93 135.00 129.84 2dsa s PRO 84 Ca -0.11 1.70 -0.31 0.00 0.02 0.00 0.00 61.00 62.30 2dsa s PRO 84 Cb -0.05 -1.80 -0.12 0.00 0.02 0.00 0.00 34.50 32.55 2dsa s PRO 84 CO 0.03 -2.07 1.63 0.00 -0.33 0.00 0.00 177.00 176.27 2dsa n ALA 85 N -3.17 2.66 -1.58 -1.55 0.00 -1.26 -4.63 120.51 110.98 2dsa n ALA 85 Ca 0.13 0.38 -0.46 0.00 0.00 0.00 0.00 53.44 53.49 2dsa n ALA 85 Cb 0.51 -2.48 -0.02 0.00 0.00 0.00 0.00 19.45 17.45 2dsa n ALA 85 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2dsa n ASN 86 N 2.62 1.25 0.00 0.00 3.02 -1.26 -1.47 115.26 119.42 2dsa n ASN 86 Ca 0.10 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.82 2dsa n ASN 86 Cb 0.36 -1.26 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 2dsa n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dsa n GLY 87 N 1.53 3.12 3.81 7.41 0.00 -1.26 -5.04 105.19 114.77 2dsa n GLY 87 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2dsa n GLY 87 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dsa s SER 88 N -1.12 6.20 0.21 1.61 1.04 -0.54 -4.97 113.70 116.14 2dsa s SER 88 Ca 0.00 1.76 -0.09 0.00 0.48 0.00 0.00 55.95 58.10 2dsa s SER 88 Cb 0.00 -2.53 0.25 0.00 0.10 0.00 0.00 66.02 63.84 2dsa s SER 88 CO 0.00 -0.88 1.81 0.15 0.98 0.00 0.00 173.24 175.31 2dsa h PHE 89 N 0.87 0.71 0.00 5.02 3.57 -1.96 -2.48 116.94 122.67 2dsa h PHE 89 Ca -0.47 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 2dsa h PHE 89 Cb 1.21 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.72 2dsa h PHE 89 CO 0.60 0.35 -0.06 0.93 -2.23 0.00 0.00 178.31 177.89 2dsa h GLU 90 N 0.72 0.00 -0.50 1.11 4.39 -1.93 -1.41 114.58 116.96 2dsa h GLU 90 Ca 0.30 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.88 2dsa h GLU 90 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2dsa h GLU 90 CO -0.18 0.06 -0.19 -0.09 -1.16 0.00 0.00 179.01 177.46 2dsa h ARG 91 N 0.00 1.01 -0.76 2.33 9.65 -1.66 -0.09 114.38 124.85 2dsa h ARG 91 Ca -0.00 -0.41 -0.04 0.00 -1.10 0.00 0.00 59.98 58.42 2dsa h ARG 91 Cb 0.18 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 2dsa h ARG 91 CO 0.01 1.09 0.30 1.88 2.80 0.00 0.00 179.97 186.05 2dsa h TYR 92 N 0.87 1.16 -0.89 2.20 -1.99 -1.30 -2.02 116.97 115.01 2dsa h TYR 92 Ca 0.12 -0.09 0.00 0.00 2.00 0.00 0.00 58.73 60.77 2dsa h TYR 92 Cb 0.76 -0.35 -0.04 0.00 2.00 0.00 0.00 36.73 39.10 2dsa h TYR 92 CO 0.05 0.88 0.57 1.25 -0.00 0.00 0.00 178.16 180.91 2dsa h HIS 93 N 1.11 1.14 -0.65 4.88 2.76 -1.20 0.48 115.15 123.67 2dsa h HIS 93 Ca 0.25 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.44 2dsa h HIS 93 Cb 0.22 -0.38 -0.03 0.00 1.55 0.00 0.00 27.41 28.76 2dsa h HIS 93 CO 0.02 0.73 0.41 1.25 -1.30 0.00 0.00 177.93 179.04 2dsa h LEU 94 N 1.21 0.76 -0.97 0.26 5.85 -0.61 -1.96 115.31 119.86 2dsa h LEU 94 Ca 0.32 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.91 2dsa h LEU 94 Cb -0.11 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 2dsa h LEU 94 CO -0.07 0.58 -0.18 1.56 -0.34 0.00 0.00 178.44 180.00 2dsa h GLN 95 N 0.88 0.55 0.41 1.25 4.20 -0.69 0.26 115.11 121.97 2dsa h GLN 95 Ca 0.23 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2dsa h GLN 95 Cb -0.06 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2dsa h GLN 95 CO -0.05 0.70 -0.33 0.37 -0.67 0.00 0.00 178.83 178.86 2dsa h GLN 96 N 0.49 -0.71 -0.80 1.46 4.15 -0.83 -0.57 115.11 118.30 2dsa h GLN 96 Ca 0.08 0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.55 2dsa h GLN 96 Cb 0.59 0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.40 2dsa h GLN 96 CO 0.04 -0.47 0.50 -1.49 -1.93 0.00 0.00 178.83 175.47 2dsa h TRP 97 N -0.74 1.03 -0.64 3.99 4.06 -0.93 -0.77 115.95 121.95 2dsa h TRP 97 Ca -0.04 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 2dsa h TRP 97 Cb 0.64 -0.34 -0.03 0.00 -1.00 0.00 0.00 29.16 28.42 2dsa h TRP 97 CO -0.15 0.68 0.33 -0.07 -3.56 0.00 0.00 178.44 175.67 2dsa h LEU 98 N 1.09 0.81 -0.63 -4.49 3.38 -0.46 -0.31 115.31 114.71 2dsa h LEU 98 Ca 0.29 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2dsa h LEU 98 Cb -0.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2dsa h LEU 98 CO -0.06 0.69 -0.35 -1.13 0.09 0.00 0.00 178.44 177.69 2dsa h ASN 99 N 0.87 0.73 -0.16 -0.43 -1.24 -0.81 -2.28 115.58 112.27 2dsa h ASN 99 Ca 0.22 -0.31 0.04 0.00 0.71 0.00 0.00 56.30 56.96 2dsa h ASN 99 Cb 0.08 -0.20 -0.04 0.00 0.73 0.00 0.00 38.32 38.88 2dsa h ASN 99 CO -0.03 1.01 -0.10 0.15 -1.29 0.00 0.00 177.43 177.17 2dsa h PHE 100 N 0.58 -0.23 -0.64 0.67 3.57 -0.91 -0.03 116.94 119.96 2dsa h PHE 100 Ca 0.06 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2dsa h PHE 100 Cb 0.87 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2dsa h PHE 100 CO 0.04 -0.15 0.39 0.82 -2.23 0.00 0.00 178.31 177.18 2dsa h ILE 101 N -0.09 1.18 0.14 1.41 2.04 -0.98 0.23 117.51 121.45 2dsa h ILE 101 Ca 0.09 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 2dsa h ILE 101 Cb 0.23 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2dsa h ILE 101 CO -0.21 0.19 -0.07 -1.28 0.00 0.00 0.00 178.15 176.78 2dsa h SER 102 N 0.87 -0.16 0.60 1.72 0.87 -1.29 0.26 113.55 116.41 2dsa h SER 102 Ca 0.23 -0.26 -0.27 0.00 -1.23 0.00 0.00 61.79 60.25 2dsa h SER 102 Cb -0.03 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 2dsa h SER 102 CO -0.04 0.19 -1.56 0.77 -0.53 0.00 0.00 176.83 175.66 2dsa h SER 103 N -0.53 0.01 0.00 6.23 4.64 -1.00 -2.27 113.55 120.63 2dsa h SER 103 Ca -0.02 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2dsa h SER 103 Cb 0.42 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2dsa h SER 103 CO 0.03 1.01 -1.91 -0.62 -0.87 0.00 0.00 176.83 174.48 2dsa n GLU 104 N -3.12 0.61 0.01 4.77 -0.58 0.06 -4.48 120.64 117.91 2dsa n GLU 104 Ca -0.13 -0.17 -0.01 0.00 -0.42 0.00 0.00 57.16 56.43 2dsa n GLU 104 Cb 1.03 -1.47 -0.00 0.00 -0.57 0.00 0.00 31.44 30.43 2dsa n GLU 104 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2dsa n LEU 105 N -2.20 0.54 -0.09 -4.62 4.77 -0.94 -4.66 117.00 109.81 2dsa n LEU 105 Ca -0.05 0.07 -0.07 0.00 -0.03 0.00 0.00 56.01 55.94 2dsa n LEU 105 Cb 0.54 -0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.41 2dsa n LEU 105 CO 0.41 -0.58 0.71 -0.74 -1.33 0.00 0.00 177.39 175.86 2dsa h HIS 106 N -0.07 -0.55 0.00 -1.77 2.76 -0.57 -1.55 115.15 113.40 2dsa h HIS 106 Ca 0.00 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2dsa h HIS 106 Cb 0.07 0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.32 2dsa h HIS 106 CO -0.03 -0.29 0.00 0.87 -1.30 0.00 0.00 177.93 177.18 2dsa h LYS 107 N -0.17 0.00 0.00 5.26 1.79 -1.63 -1.86 116.57 119.95 2dsa h LYS 107 Ca 0.17 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.47 2dsa h LYS 107 Cb 0.43 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.05 2dsa h LYS 107 CO -0.43 0.00 -1.15 0.77 -1.08 0.00 0.00 179.45 177.56 2dsa h SER 108 N 0.00 0.00 0.13 0.86 0.02 -1.57 -3.28 113.55 109.71 2dsa h SER 108 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 2dsa h SER 108 Cb 0.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2dsa h SER 108 CO 0.00 0.64 -0.34 -0.26 -1.14 0.00 0.00 176.83 175.73 2dsa h PHE 109 N 0.00 0.35 -0.55 3.45 0.04 -0.66 -3.37 116.94 116.20 2dsa h PHE 109 Ca -0.12 -0.08 0.11 0.00 2.80 0.00 0.00 57.97 60.68 2dsa h PHE 109 Cb 1.59 -0.08 -0.11 0.00 2.20 0.00 0.00 35.95 39.55 2dsa h PHE 109 CO 0.00 0.62 -0.18 0.77 -0.60 0.00 0.00 178.31 178.92 2dsa h SER 110 N 0.27 -0.65 0.21 2.17 0.02 -1.55 -1.26 113.55 112.77 2dsa h SER 110 Ca 0.03 0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 2dsa h SER 110 Cb 0.74 0.39 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 2dsa h SER 110 CO 0.06 -0.22 -0.20 -0.65 -1.14 0.00 0.00 176.83 174.68 2dsa h PRO 111 N -0.05 0.00 0.00 3.45 0.11 -1.77 -2.76 132.00 130.98 2dsa h PRO 111 Ca 0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.33 2dsa h PRO 111 Cb 0.45 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.55 2dsa h PRO 111 CO -0.59 0.20 -0.16 -0.07 -0.21 0.00 0.00 178.00 177.17 2dsa h LEU 112 N 0.00 0.00 -0.51 2.35 3.38 -1.43 -1.79 115.31 117.30 2dsa h LEU 112 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dsa h LEU 112 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2dsa h LEU 112 CO 0.03 0.16 -0.03 0.49 0.09 0.00 0.00 178.44 179.17 2dsa n PHE 113 N -4.30 0.00 -3.45 1.13 3.01 -1.04 -4.81 117.46 108.00 2dsa n PHE 113 Ca -0.02 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.05 2dsa n PHE 113 Cb 0.23 -0.04 -0.09 0.00 -0.01 0.00 0.00 39.48 39.57 2dsa n PHE 113 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2dsa s ASN 114 N -2.11 6.29 0.30 4.37 2.47 -0.67 -4.98 114.94 120.60 2dsa s ASN 114 Ca 0.39 0.33 0.04 0.00 0.42 0.00 0.00 52.86 54.04 2dsa s ASN 114 Cb 0.21 -2.20 0.47 0.00 -1.45 0.00 0.00 41.25 38.29 2dsa s ASN 114 CO 0.38 -0.09 1.75 -0.65 -3.72 0.00 0.00 177.10 174.77 2dsa h PRO 115 N 7.75 0.41 -0.03 0.43 0.11 -1.87 -3.21 132.00 135.59 2dsa h PRO 115 Ca -0.35 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2dsa h PRO 115 Cb 1.16 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2dsa h PRO 115 CO 0.67 0.64 0.00 0.00 -0.21 0.00 0.00 178.00 179.10 2dsa n ALA 116 N -2.48 2.62 -2.51 -0.75 0.00 -1.26 -4.81 120.51 111.31 2dsa n ALA 116 Ca -0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 2dsa n ALA 116 Cb 0.39 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 2dsa n ALA 116 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dsa s SER 117 N -1.85 7.16 0.59 0.00 0.01 -1.22 -5.03 113.70 113.36 2dsa s SER 117 Ca 0.39 1.89 -0.18 0.00 1.31 0.00 0.00 55.95 59.36 2dsa s SER 117 Cb 0.19 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 2dsa s SER 117 CO 0.31 -0.43 1.14 -0.94 0.41 0.00 0.00 173.24 173.74 2dsa s SER 118 N 1.09 5.39 0.65 2.44 1.04 -1.26 -4.88 113.70 118.18 2dsa s SER 118 Ca 0.56 2.19 0.43 0.00 0.48 0.00 0.00 55.95 59.61 2dsa s SER 118 Cb -0.26 -2.58 2.25 0.00 0.10 0.00 0.00 66.02 65.53 2dsa s SER 118 CO 0.28 -1.44 2.31 0.44 0.98 0.00 0.00 173.24 175.81 2dsa h ASP 119 N 0.79 0.00 -0.06 7.02 3.32 -1.97 -1.35 116.42 124.17 2dsa h ASP 119 Ca -0.49 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.54 2dsa h ASP 119 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.82 2dsa h ASP 119 CO 0.55 0.00 -0.01 -0.33 -1.72 0.00 0.00 179.24 177.74 2dsa h GLU 120 N 0.00 0.12 -0.14 3.56 4.39 -1.99 -1.30 114.58 119.22 2dsa h GLU 120 Ca -0.00 -0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.68 2dsa h GLU 120 Cb 0.08 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2dsa h GLU 120 CO 0.00 0.44 -0.02 2.35 -1.16 0.00 0.00 179.01 180.62 2dsa h TRP 121 N -0.21 -0.04 -0.88 4.33 2.91 -1.63 -2.31 115.95 118.13 2dsa h TRP 121 Ca 0.02 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.03 2dsa h TRP 121 Cb 0.39 0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 29.04 2dsa h TRP 121 CO 0.05 -0.04 0.48 0.87 -1.03 0.00 0.00 178.44 178.77 2dsa h LYS 122 N 0.02 1.22 -0.37 2.65 1.57 -1.45 -1.76 116.57 118.45 2dsa h LYS 122 Ca 0.07 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.59 2dsa h LYS 122 Cb 0.09 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2dsa h LYS 122 CO -0.13 0.89 -0.24 -0.91 -0.57 0.00 0.00 179.45 178.49 2dsa h ASN 123 N 1.22 0.76 -0.08 0.86 2.35 -1.08 -1.07 115.58 118.54 2dsa h ASN 123 Ca 0.31 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2dsa h ASN 123 Cb 0.03 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.18 2dsa h ASN 123 CO -0.05 0.97 -0.00 0.00 -1.65 0.00 0.00 177.43 176.70 2dsa h ALA 124 N 1.08 0.11 -0.83 -0.83 0.00 -1.17 -2.68 119.26 114.94 2dsa h ALA 124 Ca 0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2dsa h ALA 124 Cb 0.75 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2dsa h ALA 124 CO 0.06 -0.20 0.39 0.28 0.00 0.00 0.00 179.25 179.78 2dsa h VAL 125 N -0.15 1.26 -0.19 0.00 2.07 -1.29 -0.77 116.25 117.17 2dsa h VAL 125 Ca 0.02 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 2dsa h VAL 125 Cb 0.36 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2dsa h VAL 125 CO 0.00 0.31 -0.02 0.03 0.02 0.00 0.00 177.57 177.92 2dsa h ARG 126 N 1.19 0.29 -0.04 1.57 3.08 -1.17 -0.68 114.38 118.61 2dsa h ARG 126 Ca 0.29 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 60.11 2dsa h ARG 126 Cb 0.13 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.15 2dsa h ARG 126 CO -0.03 0.33 -0.65 0.37 -1.07 0.00 0.00 179.97 178.91 2dsa h GLN 127 N 0.28 0.52 -0.40 0.04 5.75 -1.03 -1.63 115.11 118.64 2dsa h GLN 127 Ca 0.06 -0.50 0.05 0.00 -0.15 0.00 0.00 58.65 58.12 2dsa h GLN 127 Cb 0.23 0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.86 2dsa h GLN 127 CO 0.01 1.13 0.13 0.77 -2.65 0.00 0.00 178.83 178.22 2dsa h SER 128 N 0.09 0.12 -0.65 -0.69 0.02 -0.93 -2.70 113.55 108.81 2dsa h SER 128 Ca -0.07 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 2dsa h SER 128 Cb 1.33 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.89 2dsa h SER 128 CO 0.13 0.10 0.22 -0.07 -1.14 0.00 0.00 176.83 176.07 2dsa h LEU 129 N 0.28 0.93 -0.80 5.07 3.38 -1.13 -1.03 115.31 122.01 2dsa h LEU 129 Ca 0.19 -0.20 0.13 0.00 0.09 0.00 0.00 57.88 58.09 2dsa h LEU 129 Cb 0.19 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 40.61 2dsa h LEU 129 CO -0.21 0.88 0.40 -1.13 0.09 0.00 0.00 178.44 178.47 2dsa h ASN 130 N 0.93 0.48 -0.02 -0.43 -0.73 -1.07 0.29 115.58 115.03 2dsa h ASN 130 Ca 0.21 0.08 -0.02 0.00 1.87 0.00 0.00 56.30 58.45 2dsa h ASN 130 Cb 0.27 0.01 0.00 0.00 0.27 0.00 0.00 38.32 38.87 2dsa h ASN 130 CO -0.01 0.22 -0.05 0.74 -0.37 0.00 0.00 177.43 177.96 2dsa h THR 131 N 0.60 1.47 -0.28 -3.57 2.02 -1.16 -2.81 112.91 109.18 2dsa h THR 131 Ca 0.42 -1.45 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 2dsa h THR 131 Cb 0.56 2.39 -0.01 0.00 -1.74 0.00 0.00 68.15 69.35 2dsa h THR 131 CO -0.34 0.39 0.04 -0.09 0.37 0.00 0.00 175.52 175.88 2dsa h ARG 132 N -0.50 0.47 -0.03 6.66 9.65 -0.90 -1.92 114.38 127.81 2dsa h ARG 132 Ca -0.00 -0.13 0.01 0.00 -1.10 0.00 0.00 59.98 58.76 2dsa h ARG 132 Cb 0.66 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.18 2dsa h ARG 132 CO 0.01 0.59 0.02 -0.07 2.80 0.00 0.00 179.97 183.33 2dsa h LEU 133 N 0.28 0.00 -0.34 3.80 3.38 -0.55 -1.73 115.31 120.15 2dsa h LEU 133 Ca 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2dsa h LEU 133 Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2dsa h LEU 133 CO 0.01 0.00 0.18 1.23 0.09 0.00 0.00 178.44 179.95 2dsa h GLY 134 N 0.00 0.51 0.93 0.83 0.00 -1.09 -1.04 103.07 103.22 2dsa h GLY 134 Ca 0.01 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 47.13 2dsa h GLY 134 CO -0.00 0.23 0.66 -1.61 0.00 0.00 0.00 176.54 175.81 2dsa h GLN 135 N 0.43 1.26 -0.13 4.80 4.15 -0.74 -1.66 115.11 123.22 2dsa h GLN 135 Ca 0.12 -0.08 -0.20 0.00 0.77 0.00 0.00 58.65 59.27 2dsa h GLN 135 Cb 0.07 -0.28 0.00 0.00 0.21 0.00 0.00 27.48 27.48 2dsa h GLN 135 CO -0.02 0.83 -0.72 0.28 -1.93 0.00 0.00 178.83 177.27 2dsa h VAL 136 N 1.30 1.33 -0.83 2.39 2.07 -1.35 -2.24 116.25 118.90 2dsa h VAL 136 Ca 0.39 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 2dsa h VAL 136 Cb -0.05 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 2dsa h VAL 136 CO -0.11 0.62 0.47 0.00 0.02 0.00 0.00 177.57 178.57 2dsa h ALA 137 N 0.79 1.07 -0.53 1.67 0.00 -0.88 -0.49 119.26 120.88 2dsa h ALA 137 Ca -0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2dsa h ALA 137 Cb 1.31 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2dsa h ALA 137 CO 0.14 0.57 0.03 0.00 0.00 0.00 0.00 179.25 179.99 2dsa h ARG 138 N 1.16 0.88 -0.72 0.00 3.08 -1.24 -1.84 114.38 115.70 2dsa h ARG 138 Ca 0.29 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2dsa h ARG 138 Cb 0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 2dsa h ARG 138 CO -0.05 0.85 0.26 0.37 -1.07 0.00 0.00 179.97 180.33 2dsa h GLN 139 N 0.82 1.08 -0.29 0.04 5.75 -0.79 -2.83 115.11 118.89 2dsa h GLN 139 Ca 0.16 -0.20 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 2dsa h GLN 139 Cb 0.44 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.82 2dsa h GLN 139 CO 0.02 0.90 0.00 1.28 -2.65 0.00 0.00 178.83 178.38 2dsa n LEU 140 N -4.27 2.18 -0.11 -2.39 4.77 -0.25 -4.29 117.00 112.64 2dsa n LEU 140 Ca 0.06 -0.98 -0.12 0.00 -0.03 0.00 0.00 56.01 54.94 2dsa n LEU 140 Cb 0.20 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2dsa n LEU 140 CO 0.41 0.49 0.63 -0.33 -1.33 0.00 0.00 177.39 177.26 2dsa h GLU 141 N 2.71 0.73 -0.06 3.23 5.08 -1.07 -3.35 114.58 121.85 2dsa h GLU 141 Ca 0.00 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2dsa h GLU 141 Cb 0.60 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2dsa h GLU 141 CO 0.00 0.95 0.00 0.72 -1.00 0.00 0.00 179.01 179.68 2dsa n HIS 142 N -4.29 0.07 -3.95 4.33 8.25 -1.26 -5.00 115.22 113.37 2dsa n HIS 142 Ca -0.03 -0.19 -0.11 0.00 -0.26 0.00 0.00 57.72 57.13 2dsa n HIS 142 Cb 0.42 -0.02 -0.13 0.00 1.12 0.00 0.00 29.99 31.39 2dsa n HIS 142 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dsa s ALA 143 N -0.61 0.13 0.32 -1.41 0.00 -1.26 -5.07 121.76 113.87 2dsa s ALA 143 Ca 0.07 -0.29 0.12 0.00 0.00 0.00 0.00 51.96 51.85 2dsa s ALA 143 Cb 0.04 0.04 0.55 0.00 0.00 0.00 0.00 23.12 23.75 2dsa s ALA 143 CO 0.06 -0.05 1.72 -1.00 0.00 0.00 0.00 175.76 176.50 2dsa h PRO 144 N 5.48 0.00 -5.17 0.00 0.13 -1.83 -3.41 132.00 127.19 2dsa h PRO 144 Ca -0.28 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.43 2dsa h PRO 144 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 2dsa h PRO 144 CO 0.47 0.49 -0.64 0.71 -0.23 0.00 0.00 178.00 178.79 2dsa s TYR 145 N -3.91 1.74 0.32 1.56 1.51 -0.50 -4.90 117.35 113.16 2dsa s TYR 145 Ca -0.02 -0.92 0.01 0.00 -1.01 0.00 0.00 57.07 55.13 2dsa s TYR 145 Cb 0.14 -1.05 0.56 0.00 -0.11 0.00 0.00 41.96 41.50 2dsa s TYR 145 CO 0.74 -0.00 1.96 -0.07 -1.11 0.00 0.00 175.55 177.07 2dsa h LEU 146 N 2.33 0.85 -2.14 -1.29 4.07 -1.89 -2.23 115.31 115.01 2dsa h LEU 146 Ca -0.39 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.56 2dsa h LEU 146 Cb 1.23 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.78 2dsa h LEU 146 CO 0.66 0.58 0.00 0.18 -1.08 0.00 0.00 178.44 178.78 2dsa n LEU 147 N -4.45 3.22 0.00 1.67 4.77 -1.26 -5.05 117.00 115.90 2dsa n LEU 147 Ca 0.10 -1.34 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 2dsa n LEU 147 Cb 0.11 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2dsa n LEU 147 CO 0.35 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2dsa n GLY 148 N 1.45 0.30 0.06 -0.72 0.00 -0.84 -4.72 105.19 100.71 2dsa n GLY 148 Ca 0.18 -1.14 0.12 0.00 0.00 0.00 0.00 46.02 45.19 2dsa n GLY 148 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dsa n ASP 149 N 0.00 0.67 -4.62 1.61 8.00 -1.26 -1.42 116.55 119.53 2dsa n ASP 149 Ca 0.00 0.07 -0.36 0.00 0.71 0.00 0.00 54.79 55.21 2dsa n ASP 149 Cb 0.00 0.20 -0.10 0.00 -0.02 0.00 0.00 41.12 41.20 2dsa n ASP 149 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2dsa s GLN 150 N -3.15 3.99 0.25 -1.24 2.00 -1.26 -4.88 119.66 115.37 2dsa s GLN 150 Ca 0.07 -0.31 -0.31 0.00 -2.00 0.00 0.00 55.36 52.81 2dsa s GLN 150 Cb 0.14 -3.49 -0.11 0.00 0.80 0.00 0.00 33.01 30.35 2dsa s GLN 150 CO 0.72 0.02 1.57 -1.17 -0.50 0.00 0.00 175.29 175.94 2dsa s LEU 151 N 1.13 4.36 0.39 3.68 0.20 -1.26 -4.57 118.68 122.61 2dsa s LEU 151 Ca 0.07 2.81 0.04 0.00 0.69 0.00 0.00 54.13 57.73 2dsa s LEU 151 Cb -0.14 -3.62 -0.04 0.00 -0.43 0.00 0.00 46.19 41.96 2dsa s LEU 151 CO 0.05 -0.86 0.08 -0.94 -0.29 0.00 0.00 176.35 174.40 2dsa s SER 152 N 0.68 2.78 0.64 3.68 1.04 -1.26 -4.55 113.70 116.71 2dsa s SER 152 Ca 0.65 -1.54 0.43 0.00 0.48 0.00 0.00 55.95 55.97 2dsa s SER 152 Cb -0.46 0.25 2.35 0.00 0.10 0.00 0.00 66.02 68.26 2dsa s SER 152 CO 0.41 -0.78 2.33 -0.37 0.98 0.00 0.00 173.24 175.81 2dsa h VAL 153 N 1.88 0.00 -0.49 5.02 -1.51 -1.24 -2.26 116.25 117.64 2dsa h VAL 153 Ca -0.39 -0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 64.97 2dsa h VAL 153 Cb 1.27 0.96 -0.02 0.00 -2.13 0.00 0.00 31.29 31.37 2dsa h VAL 153 CO 0.64 0.00 -0.14 0.00 -1.23 0.00 0.00 177.57 176.84 2dsa h ALA 154 N 2.00 0.82 -0.44 5.19 0.00 -1.90 -1.77 119.26 123.15 2dsa h ALA 154 Ca 0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2dsa h ALA 154 Cb 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2dsa h ALA 154 CO 0.00 0.65 -0.10 -0.44 0.00 0.00 0.00 179.25 179.36 2dsa h ASP 155 N 0.83 0.77 -0.26 0.00 5.19 -1.82 -0.53 116.42 120.60 2dsa h ASP 155 Ca 0.13 -0.23 -0.04 0.00 -0.62 0.00 0.00 57.03 56.27 2dsa h ASP 155 Cb 0.69 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 2dsa h ASP 155 CO 0.05 0.90 0.01 0.40 -3.12 0.00 0.00 179.24 177.48 2dsa h ILE 156 N 0.71 1.25 -0.04 0.35 2.04 -1.42 -0.18 117.51 120.23 2dsa h ILE 156 Ca 0.12 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 2dsa h ILE 156 Cb 0.58 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2dsa h ILE 156 CO 0.04 0.28 0.02 0.22 0.00 0.00 0.00 178.15 178.71 2dsa h TYR 157 N 0.23 0.05 -0.42 1.37 3.20 -1.19 -2.48 116.97 117.74 2dsa h TYR 157 Ca 0.07 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.01 2dsa h TYR 157 Cb 0.40 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.61 2dsa h TYR 157 CO 0.03 0.09 0.11 1.25 -1.64 0.00 0.00 178.16 178.00 2dsa h LEU 158 N -0.01 0.06 -1.09 2.82 5.85 -1.02 -2.12 115.31 119.79 2dsa h LEU 158 Ca 0.01 0.06 0.13 0.00 0.84 0.00 0.00 57.88 58.93 2dsa h LEU 158 Cb 0.06 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.08 2dsa h LEU 158 CO -0.00 0.07 0.61 0.15 -0.34 0.00 0.00 178.44 178.93 2dsa h PHE 159 N 0.25 1.04 -0.05 1.25 3.57 -0.86 0.59 116.94 122.72 2dsa h PHE 159 Ca 0.20 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 2dsa h PHE 159 Cb 0.23 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.64 2dsa h PHE 159 CO -0.19 0.39 -0.08 0.28 -2.23 0.00 0.00 178.31 176.48 2dsa h VAL 160 N 0.89 1.41 -0.36 1.41 2.07 -0.93 -1.97 116.25 118.77 2dsa h VAL 160 Ca 0.49 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.69 2dsa h VAL 160 Cb 0.59 2.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 2dsa h VAL 160 CO -0.26 0.37 0.19 0.58 0.02 0.00 0.00 177.57 178.48 2dsa h VAL 161 N -0.33 1.01 -0.83 2.57 2.07 -1.21 -2.45 116.25 117.08 2dsa h VAL 161 Ca 0.00 -0.14 0.10 0.00 0.82 0.00 0.00 66.70 67.48 2dsa h VAL 161 Cb 0.64 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 30.93 2dsa h VAL 161 CO 0.02 0.07 0.54 -0.07 0.02 0.00 0.00 177.57 178.15 2dsa h LEU 162 N 0.40 0.71 -2.90 2.57 3.38 -0.87 -1.51 115.31 117.09 2dsa h LEU 162 Ca 0.15 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2dsa h LEU 162 Cb 0.03 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2dsa h LEU 162 CO -0.08 0.42 -0.00 1.23 0.09 0.00 0.00 178.44 180.10 2dsa h GLY 163 N 0.78 0.00 2.00 0.83 0.00 -0.85 -2.13 103.07 103.70 2dsa h GLY 163 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2dsa h GLY 163 CO -0.15 0.00 0.00 1.49 0.00 0.00 0.00 176.54 177.88 2dsa h TRP 164 N 0.00 0.00 -0.57 5.60 6.55 -1.23 -3.34 115.95 122.96 2dsa h TRP 164 Ca -0.00 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.79 2dsa h TRP 164 Cb 0.01 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 28.28 2dsa h TRP 164 CO 0.00 0.00 0.14 0.66 -1.05 0.00 0.00 178.44 178.19 2dsa h SER 165 N 0.00 0.81 -0.62 -3.49 4.64 -1.53 -1.85 113.55 111.51 2dsa h SER 165 Ca 0.00 -0.15 0.03 0.00 -0.47 0.00 0.00 61.79 61.20 2dsa h SER 165 Cb 0.55 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2dsa h SER 165 CO 0.00 0.79 0.41 0.00 -0.87 0.00 0.00 176.83 177.17 2dsa h ALA 166 N 1.31 1.66 0.00 5.18 0.00 -1.75 0.40 119.26 126.06 2dsa h ALA 166 Ca 0.18 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2dsa h ALA 166 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2dsa h ALA 166 CO -0.00 0.27 -0.23 1.88 0.00 0.00 0.00 179.25 181.17 2dsa h TYR 167 N 0.74 0.00 -0.13 0.00 -1.99 -1.58 -3.20 116.97 110.81 2dsa h TYR 167 Ca 0.25 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.97 2dsa h TYR 167 Cb 0.08 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.81 2dsa h TYR 167 CO -0.00 0.23 -0.01 1.33 -0.00 0.00 0.00 178.16 179.70 2dsa n VAL 168 N -3.17 2.10 -2.64 -2.88 0.24 -1.12 -5.00 118.33 105.87 2dsa n VAL 168 Ca 0.03 -2.13 -0.21 0.00 -2.04 0.00 0.00 64.34 59.99 2dsa n VAL 168 Cb 0.61 -0.25 0.01 0.00 -1.47 0.00 0.00 33.84 32.73 2dsa n VAL 168 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2dsa n ASN 169 N -1.00 -5.83 -4.62 -1.34 3.02 -0.46 -4.98 115.26 100.06 2dsa n ASN 169 Ca 0.19 -0.13 -0.41 0.00 -0.03 0.00 0.00 54.58 54.20 2dsa n ASN 169 Cb 0.77 -4.76 -0.06 0.00 -0.61 0.00 0.00 39.78 35.12 2dsa n ASN 169 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2dsa s ILE 170 N -3.07 4.94 -0.11 2.41 1.01 0.13 -5.01 121.20 121.50 2dsa s ILE 170 Ca 0.12 1.12 -0.25 0.00 0.00 0.00 0.00 60.65 61.64 2dsa s ILE 170 Cb -0.05 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 38.41 2dsa s ILE 170 CO 0.15 -0.04 0.81 -0.62 0.00 0.00 0.00 174.94 175.24 2dsa s ASP 171 N 1.51 7.02 0.00 3.58 3.68 -1.26 -4.33 116.67 126.86 2dsa s ASP 171 Ca 0.27 1.24 0.23 0.00 2.13 0.00 0.00 52.55 56.42 2dsa s ASP 171 Cb -0.15 -2.45 0.58 0.00 -1.45 0.00 0.00 42.92 39.44 2dsa s ASP 171 CO 0.09 -0.29 1.49 0.18 0.13 0.00 0.00 175.17 176.78 2dsa n LEU 172 N 4.59 3.71 -0.28 -1.34 4.77 -1.26 -4.56 117.00 122.63 2dsa n LEU 172 Ca 0.03 -1.78 0.11 0.00 -0.03 0.00 0.00 56.01 54.34 2dsa n LEU 172 Cb 0.50 -0.41 0.36 0.00 -2.33 0.00 0.00 43.42 41.54 2dsa n LEU 172 CO 0.48 0.89 1.22 0.28 -1.33 0.00 0.00 177.39 178.93 2dsa h SER 173 N 4.27 0.69 0.50 -1.43 0.02 -2.01 0.30 113.55 115.90 2dsa h SER 173 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2dsa h SER 173 Cb 0.97 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.41 2dsa h SER 173 CO 0.00 0.36 0.00 -2.65 -1.14 0.00 0.00 176.83 173.40 2dsa n PRO 174 N -4.57 0.18 -3.47 3.45 -0.02 -1.26 -4.00 135.00 125.32 2dsa n PRO 174 Ca 0.17 0.50 -0.27 0.00 -2.02 0.00 0.00 63.50 61.88 2dsa n PRO 174 Cb 0.44 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 31.93 2dsa n PRO 174 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2dsa n TRP 175 N -2.26 2.93 -0.10 6.00 8.01 0.09 -4.94 117.44 127.17 2dsa n TRP 175 Ca 0.01 -4.08 0.20 0.00 -1.31 0.00 0.00 57.50 52.32 2dsa n TRP 175 Cb 0.17 -0.52 0.63 0.00 -2.01 0.00 0.00 31.31 29.58 2dsa n TRP 175 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dsa h PRO 176 N 4.40 0.14 0.00 -0.99 0.13 -1.69 -1.22 132.00 132.77 2dsa h PRO 176 Ca 0.18 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 65.26 2dsa h PRO 176 Cb 0.71 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 2dsa h PRO 176 CO 0.76 0.10 -0.20 0.66 -0.23 0.00 0.00 178.00 179.08 2dsa h SER 177 N 0.15 0.00 0.03 1.44 4.64 -1.91 -0.97 113.55 116.93 2dsa h SER 177 Ca 0.34 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.38 2dsa h SER 177 Cb 1.12 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.23 2dsa h SER 177 CO -0.05 0.20 -1.09 -0.07 -0.87 0.00 0.00 176.83 174.94 2dsa h LEU 178 N 0.00 0.91 -0.72 5.97 3.38 -1.53 -1.58 115.31 121.74 2dsa h LEU 178 Ca -0.00 -0.76 -0.08 0.00 0.09 0.00 0.00 57.88 57.14 2dsa h LEU 178 Cb 0.46 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2dsa h LEU 178 CO 0.03 1.56 0.12 1.56 0.09 0.00 0.00 178.44 181.79 2dsa h GLN 179 N 0.37 1.10 -0.77 1.13 4.20 -1.41 -0.60 115.11 119.12 2dsa h GLN 179 Ca -0.14 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.27 2dsa h GLN 179 Cb 1.75 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 29.36 2dsa h GLN 179 CO 0.21 1.00 0.46 0.00 -0.67 0.00 0.00 178.83 179.83 2dsa h ALA 180 N 1.09 0.99 -0.57 3.87 0.00 -1.20 -2.38 119.26 121.04 2dsa h ALA 180 Ca 0.21 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2dsa h ALA 180 Cb 0.43 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2dsa h ALA 180 CO 0.01 0.46 0.21 0.35 0.00 0.00 0.00 179.25 180.29 2dsa h PHE 181 N 1.06 0.89 -0.80 0.00 3.57 -1.03 -1.97 116.94 118.66 2dsa h PHE 181 Ca 0.28 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.76 2dsa h PHE 181 Cb -0.02 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.40 2dsa h PHE 181 CO -0.01 0.73 0.49 1.96 -2.23 0.00 0.00 178.31 179.25 2dsa h GLN 182 N 0.80 0.87 -0.05 1.11 4.20 -0.83 -1.31 115.11 119.89 2dsa h GLN 182 Ca 0.19 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.71 2dsa h GLN 182 Cb 0.23 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2dsa h GLN 182 CO -0.01 0.57 -0.61 0.78 -0.67 0.00 0.00 178.83 178.89 2dsa h GLY 183 N 0.89 0.19 0.89 3.46 0.00 -1.27 0.24 103.07 107.47 2dsa h GLY 183 Ca 0.35 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 2dsa h GLY 183 CO -0.17 0.21 -0.02 -0.09 0.00 0.00 0.00 176.54 176.47 2dsa h ARG 184 N 0.13 0.56 0.10 4.80 2.43 -0.87 -3.08 114.38 118.45 2dsa h ARG 184 Ca -0.01 -0.19 -0.24 0.00 -0.81 0.00 0.00 59.98 58.74 2dsa h ARG 184 Cb 1.11 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2dsa h ARG 184 CO 0.09 0.71 -1.21 0.28 -1.51 0.00 0.00 179.97 178.34 2dsa h VAL 185 N 0.35 1.16 0.00 0.20 2.07 -1.24 -3.36 116.25 115.42 2dsa h VAL 185 Ca 0.09 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.20 2dsa h VAL 185 Cb 0.47 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 2dsa h VAL 185 CO 0.02 0.67 0.00 1.23 0.02 0.00 0.00 177.57 179.51 2dsa h GLY 186 N -0.15 0.00 0.68 2.17 0.00 -0.65 -2.03 103.07 103.09 2dsa h GLY 186 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2dsa h GLY 186 CO 0.05 0.00 -0.14 0.61 0.00 0.00 0.00 176.54 177.06 2dsa n GLY 187 N -0.95 -0.82 3.77 4.60 0.00 -1.16 -4.32 105.19 106.31 2dsa n GLY 187 Ca -0.02 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 2dsa n GLY 187 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dsa s ARG 188 N -2.45 4.30 0.33 1.61 0.52 -0.77 -4.95 118.95 117.53 2dsa s ARG 188 Ca 0.28 1.77 0.03 0.00 -0.52 0.00 0.00 55.73 57.29 2dsa s ARG 188 Cb 0.20 -2.84 0.57 0.00 0.52 0.00 0.00 34.95 33.39 2dsa s ARG 188 CO 0.48 -0.08 1.87 1.05 0.02 0.00 0.00 175.30 178.63 2dsa h GLU 189 N 3.05 0.59 -0.42 3.54 4.11 -1.90 -1.88 114.58 121.68 2dsa h GLU 189 Ca -0.48 -0.12 -0.12 0.00 0.07 0.00 0.00 59.36 58.71 2dsa h GLU 189 Cb 1.22 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2dsa h GLU 189 CO 0.64 0.59 -0.22 0.00 0.07 0.00 0.00 179.01 180.09 2dsa h ALA 190 N 1.47 0.83 0.01 1.06 0.00 -1.93 -0.45 119.26 120.26 2dsa h ALA 190 Ca 0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2dsa h ALA 190 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2dsa h ALA 190 CO 0.01 0.64 -0.01 0.28 0.00 0.00 0.00 179.25 180.17 2dsa h VAL 191 N 0.72 1.15 -0.24 0.00 2.07 -1.74 -1.57 116.25 116.65 2dsa h VAL 191 Ca 0.10 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 67.07 2dsa h VAL 191 Cb 0.74 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2dsa h VAL 191 CO 0.06 0.12 -0.18 1.56 0.02 0.00 0.00 177.57 179.15 2dsa h GLN 192 N -0.22 0.41 -0.70 1.57 1.08 -1.36 -2.01 115.11 113.89 2dsa h GLN 192 Ca -0.00 -0.13 -0.06 0.00 -1.45 0.00 0.00 58.65 57.01 2dsa h GLN 192 Cb 0.21 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.57 2dsa h GLN 192 CO 0.00 0.58 0.20 0.77 -0.95 0.00 0.00 178.83 179.43 2dsa h SER 193 N 0.38 1.02 -0.26 1.46 0.02 -1.02 -1.84 113.55 113.31 2dsa h SER 193 Ca 0.07 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.72 2dsa h SER 193 Cb 0.53 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2dsa h SER 193 CO 0.03 0.96 -0.21 0.00 -1.14 0.00 0.00 176.83 176.48 2dsa h ALA 194 N 1.17 0.38 -0.38 3.77 0.00 -0.96 -0.22 119.26 123.02 2dsa h ALA 194 Ca 0.22 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2dsa h ALA 194 Cb 0.32 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2dsa h ALA 194 CO -0.00 0.32 0.10 -0.07 0.00 0.00 0.00 179.25 179.60 2dsa h LEU 195 N 0.33 0.06 -0.11 0.00 4.07 -1.33 -0.69 115.31 117.63 2dsa h LEU 195 Ca 0.05 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2dsa h LEU 195 Cb 0.75 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 2dsa h LEU 195 CO 0.05 0.07 0.07 -0.09 -1.08 0.00 0.00 178.44 177.47 2dsa h ARG 196 N 0.24 0.14 0.00 1.13 2.43 -1.27 -0.93 114.38 116.12 2dsa h ARG 196 Ca 0.18 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2dsa h ARG 196 Cb 0.19 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2dsa h ARG 196 CO -0.22 0.09 -0.03 0.00 -1.51 0.00 0.00 179.97 178.30 2dsa h ALA 197 N 1.04 1.55 -0.06 2.80 0.00 -0.56 -0.25 119.26 123.78 2dsa h ALA 197 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2dsa h ALA 197 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2dsa h ALA 197 CO -0.01 0.04 0.00 0.39 0.00 0.00 0.00 179.25 179.67 2dsa n GLU 198 N -3.92 1.69 -2.62 0.00 1.02 -0.31 -4.93 120.64 111.57 2dsa n GLU 198 Ca -0.03 -1.01 -0.09 0.00 -0.02 0.00 0.00 57.16 56.02 2dsa n GLU 198 Cb 0.12 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.10 2dsa n GLU 198 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dsa n GLY 199 N 1.16 0.26 0.51 0.62 0.00 -0.10 -4.80 105.19 102.85 2dsa n GLY 199 Ca 0.18 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.85 2dsa n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36