#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 1.91 -0.27 2.12 1.02 -0.16 -0.30 119.74 124.06 2dsa s LYS 2 Ca 0.00 -0.74 -0.05 0.00 0.02 0.00 0.00 55.97 55.20 2dsa s LYS 2 Cb 0.00 -1.73 0.01 0.00 -0.52 0.00 0.00 37.83 35.59 2dsa s LYS 2 CO 0.00 0.37 0.03 -1.17 -0.92 0.00 0.00 175.35 173.65 2dsa s LEU 3 N -0.24 3.48 -0.21 3.17 2.96 -0.51 -0.34 118.68 126.99 2dsa s LEU 3 Ca 0.02 -0.63 -0.28 0.00 -0.22 0.00 0.00 54.13 53.02 2dsa s LEU 3 Cb -0.10 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.78 2dsa s LEU 3 CO 0.01 -0.13 0.96 -0.31 -1.32 0.00 0.00 176.35 175.56 2dsa s TYR 4 N 1.47 3.36 0.12 5.38 1.51 0.23 -1.05 117.35 128.38 2dsa s TYR 4 Ca 0.03 1.37 -0.02 0.00 -1.01 0.00 0.00 57.07 57.45 2dsa s TYR 4 Cb -0.16 -3.18 -0.04 0.00 -0.11 0.00 0.00 41.96 38.47 2dsa s TYR 4 CO -0.00 -0.41 0.07 1.52 -1.11 0.00 0.00 175.55 175.62 2dsa s TYR 5 N 2.87 0.77 -0.03 2.71 -0.85 -0.20 -2.95 117.35 119.67 2dsa s TYR 5 Ca 0.41 -1.16 -0.00 0.00 -0.52 0.00 0.00 57.07 55.81 2dsa s TYR 5 Cb -0.16 -0.42 0.03 0.00 0.38 0.00 0.00 41.96 41.79 2dsa s TYR 5 CO 0.08 -0.52 0.02 0.45 -1.52 0.00 0.00 175.55 174.06 2dsa s SER 6 N -3.02 0.34 0.10 -0.18 0.15 -1.26 -2.33 113.70 107.49 2dsa s SER 6 Ca 0.21 0.01 -0.36 0.00 0.70 0.00 0.00 55.95 56.51 2dsa s SER 6 Cb 0.07 -0.15 -0.16 0.00 -1.71 0.00 0.00 66.02 64.07 2dsa s SER 6 CO 0.00 -0.13 1.38 -2.65 1.20 0.00 0.00 173.24 173.04 2dsa n PRO 7 N 4.27 1.32 0.00 5.44 -0.02 -1.26 -0.96 135.00 143.79 2dsa n PRO 7 Ca -0.25 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2dsa n PRO 7 Cb 0.50 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 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 2.67 2.76 3.72 -1.23 0.00 -1.26 -5.01 105.19 106.84 2dsa n GLY 8 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.33 1.25 0.44 4.61 0.00 -0.13 -4.87 121.76 120.73 2dsa s ALA 9 Ca 0.00 -1.01 0.39 0.00 0.00 0.00 0.00 51.96 51.34 2dsa s ALA 9 Cb 0.00 -2.86 2.10 0.00 0.00 0.00 0.00 23.12 22.37 2dsa s ALA 9 CO 0.00 -3.10 2.19 0.00 0.00 0.00 0.00 175.76 174.84 2dsa n SER 11 N -2.86 0.53 0.23 0.00 3.41 -1.26 -1.01 113.62 112.65 2dsa n SER 11 Ca -0.03 0.74 0.07 0.00 -0.26 0.00 0.00 58.87 59.40 2dsa n SER 11 Cb 0.06 -0.81 0.55 0.00 -0.26 0.00 0.00 64.21 63.75 2dsa n SER 11 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2dsa h LEU 12 N 0.00 0.00 0.79 1.04 5.85 -1.52 -2.34 115.31 119.14 2dsa h LEU 12 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2dsa h LEU 12 Cb 0.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2dsa h LEU 12 CO 0.00 0.21 -0.43 -1.28 -0.34 0.00 0.00 178.44 176.60 2dsa h SER 13 N 0.00 -1.05 -0.23 1.25 0.87 -1.31 0.63 113.55 113.72 2dsa h SER 13 Ca -0.00 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.63 2dsa h SER 13 Cb 0.42 0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2dsa h SER 13 CO 0.03 -0.69 0.15 -0.65 -0.53 0.00 0.00 176.83 175.14 2dsa h PRO 14 N -1.12 0.20 0.40 2.24 0.11 -1.72 -0.76 132.00 131.35 2dsa h PRO 14 Ca -0.11 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 2dsa h PRO 14 Cb 0.88 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 2dsa h PRO 14 CO 0.15 0.13 -0.34 1.25 -0.21 0.00 0.00 178.00 178.98 2dsa h HIS 15 N 0.20 -0.91 -0.58 0.65 2.76 -1.26 0.90 115.15 116.92 2dsa h HIS 15 Ca 0.09 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.34 2dsa h HIS 15 Cb 0.12 0.35 -0.06 0.00 1.55 0.00 0.00 27.41 29.37 2dsa h HIS 15 CO -0.00 -0.49 0.26 0.82 -1.30 0.00 0.00 177.93 177.22 2dsa h ILE 16 N -0.74 0.86 -0.30 6.26 2.04 -0.49 -2.66 117.51 122.47 2dsa h ILE 16 Ca -0.03 -0.16 0.05 0.00 1.00 0.00 0.00 64.86 65.71 2dsa h ILE 16 Cb 0.65 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 2dsa h ILE 16 CO -0.03 0.09 0.03 0.00 0.00 0.00 0.00 178.15 178.24 2dsa h ALA 17 N 1.36 0.29 -0.48 1.87 0.00 -0.77 0.75 119.26 122.28 2dsa h ALA 17 Ca 0.28 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.32 2dsa h ALA 17 Cb 0.27 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2dsa h ALA 17 CO -0.24 -0.38 0.17 -0.07 0.00 0.00 0.00 179.25 178.73 2dsa h LEU 18 N 0.12 0.17 -0.77 0.00 3.38 -0.61 0.92 115.31 118.52 2dsa h LEU 18 Ca 0.14 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 2dsa h LEU 18 Cb 0.18 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2dsa h LEU 18 CO -0.22 0.13 0.37 0.03 0.09 0.00 0.00 178.44 178.84 2dsa h ARG 19 N 0.34 1.11 -0.21 1.13 3.08 -1.11 -1.56 114.38 117.15 2dsa h ARG 19 Ca 0.23 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2dsa h ARG 19 Cb 0.24 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2dsa h ARG 19 CO -0.23 0.86 -0.11 0.93 -1.07 0.00 0.00 179.97 180.35 2dsa h GLU 20 N 1.08 0.34 0.00 0.04 4.39 -0.12 -2.05 114.58 118.27 2dsa h GLU 20 Ca 0.26 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.85 2dsa h GLU 20 Cb 0.11 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2dsa h GLU 20 CO -0.03 0.46 -0.13 0.00 -1.16 0.00 0.00 179.01 178.14 2dsa h ALA 21 N 1.57 0.94 -0.18 3.43 0.00 -0.45 -3.48 119.26 121.10 2dsa h ALA 21 Ca 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2dsa h ALA 21 Cb 0.39 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2dsa h ALA 21 CO 0.02 0.17 -0.04 0.41 0.00 0.00 0.00 179.25 179.81 2dsa n GLY 22 N 0.77 0.43 3.90 0.00 0.00 -0.62 -4.91 105.19 104.75 2dsa n GLY 22 Ca 0.02 -0.91 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.50 3.59 -0.16 0.99 1.43 -1.01 -5.05 118.68 117.98 2dsa s LEU 23 Ca 0.00 1.03 -0.11 0.00 -1.03 0.00 0.00 54.13 54.02 2dsa s LEU 23 Cb 0.00 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.18 2dsa s LEU 23 CO 0.00 -0.60 0.21 0.20 0.23 0.00 0.00 176.35 176.39 2dsa s ASN 24 N -3.99 6.37 0.14 2.29 0.02 -1.26 -4.76 114.94 113.75 2dsa s ASN 24 Ca 0.49 0.43 -0.18 0.00 -1.02 0.00 0.00 52.86 52.58 2dsa s ASN 24 Cb -0.10 -2.13 0.04 0.00 0.02 0.00 0.00 41.25 39.08 2dsa s ASN 24 CO 0.44 0.21 0.47 0.72 0.02 0.00 0.00 177.10 178.96 2dsa s PHE 25 N 0.02 -0.29 -0.15 2.20 -0.71 -1.26 -4.54 117.98 113.25 2dsa s PHE 25 Ca 0.13 -0.01 -0.03 0.00 -1.04 0.00 0.00 56.93 55.99 2dsa s PHE 25 Cb -0.12 0.36 -0.02 0.00 -1.21 0.00 0.00 43.02 42.02 2dsa s PHE 25 CO 0.02 -0.77 -0.06 -1.21 -1.34 0.00 0.00 175.22 171.87 2dsa s GLU 26 N -3.80 3.57 0.16 1.99 0.41 0.59 -4.99 118.70 116.63 2dsa s GLU 26 Ca 0.03 -0.57 -0.30 0.00 -0.41 0.00 0.00 54.97 53.72 2dsa s GLU 26 Cb 0.01 -2.85 -0.07 0.00 -1.78 0.00 0.00 34.13 29.43 2dsa s GLU 26 CO -0.11 0.19 1.09 -0.51 -0.49 0.00 0.00 175.26 175.43 2dsa s LEU 27 N 0.46 4.48 -0.13 1.80 1.43 -1.26 -1.42 118.68 124.05 2dsa s LEU 27 Ca -0.05 2.05 0.00 0.00 -1.03 0.00 0.00 54.13 55.10 2dsa s LEU 27 Cb -0.15 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.49 2dsa s LEU 27 CO 0.03 -0.21 -0.12 -0.69 0.23 0.00 0.00 176.35 175.59 2dsa s VAL 28 N -0.15 1.38 0.29 -1.59 1.01 -0.21 -4.93 120.40 116.20 2dsa s VAL 28 Ca 0.49 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 2dsa s VAL 28 Cb -0.29 -1.31 -0.09 0.00 0.00 0.00 0.00 36.38 34.69 2dsa s VAL 28 CO 0.34 0.42 0.79 -1.58 0.00 0.00 0.00 175.10 175.07 2dsa s GLN 29 N 1.40 4.21 -0.05 2.72 0.74 -1.26 -1.03 119.66 126.39 2dsa s GLN 29 Ca 0.02 0.90 0.06 0.00 0.05 0.00 0.00 55.36 56.38 2dsa s GLN 29 Cb -0.13 -2.64 -0.01 0.00 1.10 0.00 0.00 33.01 31.33 2dsa s GLN 29 CO -0.07 0.25 -0.23 0.08 -0.55 0.00 0.00 175.29 174.76 2dsa s VAL 30 N -1.77 1.89 -0.54 1.34 1.01 -0.99 -1.35 120.40 120.00 2dsa s VAL 30 Ca 0.50 -0.98 -0.25 0.00 0.00 0.00 0.00 61.98 61.24 2dsa s VAL 30 Cb -0.14 -1.60 0.04 0.00 0.00 0.00 0.00 36.38 34.68 2dsa s VAL 30 CO 0.19 0.53 0.98 -0.62 0.00 0.00 0.00 175.10 176.18 2dsa s ASP 31 N -0.20 6.39 0.00 3.32 3.68 0.19 -4.82 116.67 125.23 2dsa s ASP 31 Ca -0.01 -0.19 0.12 0.00 2.13 0.00 0.00 52.55 54.60 2dsa s ASP 31 Cb -0.12 -2.46 0.67 0.00 -1.45 0.00 0.00 42.92 39.55 2dsa s ASP 31 CO 0.02 -1.23 1.22 0.18 0.13 0.00 0.00 175.17 175.49 2dsa n LEU 32 N 7.56 0.00 -0.09 -1.34 4.77 -1.26 -0.91 117.00 125.74 2dsa n LEU 32 Ca 0.04 0.13 -0.11 0.00 -0.03 0.00 0.00 56.01 56.04 2dsa n LEU 32 Cb 0.48 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 2dsa n LEU 32 CO 0.65 -0.08 -0.74 0.00 -1.33 0.00 0.00 177.39 175.89 2dsa n ALA 33 N -1.13 1.07 0.83 -1.18 0.00 -1.26 -4.60 120.51 114.24 2dsa n ALA 33 Ca 0.07 -0.80 0.13 0.00 0.00 0.00 0.00 53.44 52.84 2dsa n ALA 33 Cb 0.07 0.06 0.39 0.00 0.00 0.00 0.00 19.45 19.97 2dsa n ALA 33 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dsa n SER 34 N -4.36 0.45 -3.40 0.00 3.41 -1.20 -4.96 113.62 103.55 2dsa n SER 34 Ca -0.18 0.26 -0.20 0.00 -0.26 0.00 0.00 58.87 58.48 2dsa n SER 34 Cb 0.54 -0.25 0.06 0.00 -0.26 0.00 0.00 64.21 64.30 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 -1.79 -2.47 -4.16 4.33 4.76 -0.08 -4.91 118.16 113.84 2dsa n LYS 35 Ca 0.06 0.74 -0.15 0.00 -2.87 0.00 0.00 58.31 56.09 2dsa n LYS 35 Cb 0.38 -5.35 -0.14 0.00 -1.84 0.00 0.00 35.03 28.08 2dsa n LYS 35 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2dsa s LYS 36 N -4.98 0.50 1.12 1.97 1.02 -1.21 -0.95 119.74 117.21 2dsa s LYS 36 Ca 0.40 -0.39 -0.18 0.00 0.02 0.00 0.00 55.97 55.82 2dsa s LYS 36 Cb -0.08 -0.43 0.26 0.00 -0.52 0.00 0.00 37.83 37.06 2dsa s LYS 36 CO 0.78 0.11 1.21 0.95 -0.92 0.00 0.00 175.35 177.47 2dsa s THR 37 N -0.52 1.75 0.36 2.17 -4.23 -0.03 -0.64 115.64 114.49 2dsa s THR 37 Ca -0.01 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 60.55 2dsa s THR 37 Cb -0.05 -2.71 0.20 0.00 1.34 0.00 0.00 72.50 71.28 2dsa s THR 37 CO 0.00 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 176.02 2dsa h ALA 38 N -2.24 1.49 0.00 3.99 0.00 -1.57 -2.55 119.26 118.39 2dsa h ALA 38 Ca -0.44 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2dsa h ALA 38 Cb 1.26 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2dsa h ALA 38 CO 0.33 0.38 -0.00 -1.13 0.00 0.00 0.00 179.25 178.83 2dsa n SER 39 N -4.35 0.30 0.00 0.00 3.41 -1.26 -4.94 113.62 106.78 2dsa n SER 39 Ca 0.02 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 2dsa n SER 39 Cb 0.17 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 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 1.43 1.36 3.92 5.00 0.00 -0.96 -5.11 105.19 110.83 2dsa n GLY 40 Ca 0.06 -0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 2dsa n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dsa s GLN 41 N -1.46 3.57 -0.57 1.61 -1.52 -1.26 -4.83 119.66 115.20 2dsa s GLN 41 Ca 0.00 -0.03 -0.26 0.00 -1.95 0.00 0.00 55.36 53.12 2dsa s GLN 41 Cb 0.00 -2.57 0.04 0.00 -0.22 0.00 0.00 33.01 30.26 2dsa s GLN 41 CO 0.00 0.07 1.06 0.34 -0.25 0.00 0.00 175.29 176.52 2dsa s ASP 42 N -3.69 6.39 0.55 5.90 2.15 -1.26 -0.86 116.67 125.86 2dsa s ASP 42 Ca 0.44 -0.14 0.29 0.00 0.43 0.00 0.00 52.55 53.56 2dsa s ASP 42 Cb -0.10 -2.49 1.63 0.00 -0.30 0.00 0.00 42.92 41.66 2dsa s ASP 42 CO 0.36 -1.36 2.16 0.22 -0.17 0.00 0.00 175.17 176.38 2dsa h TYR 43 N 9.43 0.00 0.00 -5.34 3.20 -1.37 -2.33 116.97 120.56 2dsa h TYR 43 Ca -0.26 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.61 2dsa h TYR 43 Cb 1.07 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2dsa h TYR 43 CO 0.97 0.06 0.00 -0.07 -1.64 0.00 0.00 178.16 177.49 2dsa h LEU 44 N 0.00 0.00 0.00 2.82 3.38 -1.73 0.20 115.31 119.98 2dsa h LEU 44 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dsa h LEU 44 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2dsa h LEU 44 CO 0.01 0.00 -0.20 -0.62 0.09 0.00 0.00 178.44 177.72 2dsa n GLU 45 N -2.30 0.26 -0.02 1.13 1.02 -0.87 -3.14 120.64 116.72 2dsa n GLU 45 Ca 0.02 0.17 -0.01 0.00 -0.02 0.00 0.00 57.16 57.31 2dsa n GLU 45 Cb 0.21 -1.76 -0.00 0.00 -0.02 0.00 0.00 31.44 29.87 2dsa n GLU 45 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2dsa n VAL 46 N -2.19 0.37 -3.91 2.62 0.31 0.49 -4.87 118.33 111.14 2dsa n VAL 46 Ca 0.05 0.42 -0.34 0.00 -0.01 0.00 0.00 64.34 64.46 2dsa n VAL 46 Cb 0.43 -1.73 -0.13 0.00 -0.91 0.00 0.00 33.84 31.50 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 -4.14 4.93 0.57 4.52 2.47 0.12 -5.00 114.94 118.41 2dsa s ASN 47 Ca -0.04 -1.80 0.27 0.00 0.42 0.00 0.00 52.86 51.71 2dsa s ASN 47 Cb 0.01 -1.71 1.57 0.00 -1.45 0.00 0.00 41.25 39.67 2dsa s ASN 47 CO 0.06 -0.38 2.08 1.55 -3.72 0.00 0.00 177.10 176.69 2dsa h PRO 48 N 7.88 0.00 0.00 0.43 0.13 -1.77 0.15 132.00 138.82 2dsa h PRO 48 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2dsa h PRO 48 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2dsa h PRO 48 CO 0.58 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.35 2dsa h ALA 49 N 1.78 1.00 0.00 -0.56 0.00 -1.94 -3.47 119.26 116.07 2dsa h ALA 49 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2dsa h ALA 49 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 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 -0.09 0.50 3.86 0.00 0.00 0.52 -5.02 105.19 104.96 2dsa n GLY 50 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.25 2.97 0.19 1.61 -0.85 -1.26 -4.94 117.35 112.82 2dsa s TYR 51 Ca 0.00 -0.25 0.04 0.00 -0.52 0.00 0.00 57.07 56.34 2dsa s TYR 51 Cb 0.00 -1.74 -0.03 0.00 0.38 0.00 0.00 41.96 40.57 2dsa s TYR 51 CO 0.00 0.23 0.26 0.14 -1.52 0.00 0.00 175.55 174.66 2dsa s VAL 52 N -2.25 5.00 0.64 -3.49 -7.23 -1.26 -4.60 120.40 107.20 2dsa s VAL 52 Ca 0.40 -0.96 -0.07 0.00 -1.81 0.00 0.00 61.98 59.54 2dsa s VAL 52 Cb -0.07 -3.62 0.03 0.00 0.56 0.00 0.00 36.38 33.28 2dsa s VAL 52 CO 0.27 -0.19 0.96 -2.16 -0.31 0.00 0.00 175.10 173.66 2dsa s PRO 53 N -3.49 2.63 -0.02 4.82 0.04 -1.26 -4.65 135.00 133.08 2dsa s PRO 53 Ca 0.33 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.31 2dsa s PRO 53 Cb -0.10 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 32.26 2dsa s PRO 53 CO 0.27 -0.94 0.02 0.00 0.04 0.00 0.00 177.00 176.39 2dsa s LEU 55 N 0.90 3.85 -0.16 0.00 2.96 -0.16 -0.60 118.68 125.48 2dsa s LEU 55 Ca -0.08 0.03 -0.04 0.00 -0.22 0.00 0.00 54.13 53.82 2dsa s LEU 55 Cb -0.11 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 2dsa s LEU 55 CO -0.02 0.08 -0.02 -1.58 -1.32 0.00 0.00 176.35 173.49 2dsa s GLN 56 N 0.93 3.70 0.62 1.98 0.74 0.54 -0.49 119.66 127.67 2dsa s GLN 56 Ca 0.05 -0.48 -0.10 0.00 0.05 0.00 0.00 55.36 54.89 2dsa s GLN 56 Cb -0.14 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 30.98 2dsa s GLN 56 CO 0.03 0.28 1.01 -0.51 -0.55 0.00 0.00 175.29 175.54 2dsa s LEU 57 N 0.28 3.21 0.38 3.68 1.43 0.20 -0.99 118.68 126.87 2dsa s LEU 57 Ca -0.02 1.24 0.18 0.00 -1.03 0.00 0.00 54.13 54.51 2dsa s LEU 57 Cb -0.14 -4.21 1.13 0.00 0.03 0.00 0.00 46.19 43.00 2dsa s LEU 57 CO 0.02 -0.95 1.71 0.44 0.23 0.00 0.00 176.35 177.80 2dsa h ASP 58 N -0.32 0.46 0.22 2.29 3.45 -1.93 -0.72 116.42 119.87 2dsa h ASP 58 Ca -0.45 0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.14 2dsa h ASP 58 Cb 1.21 0.06 0.00 0.00 -0.56 0.00 0.00 39.33 40.04 2dsa h ASP 58 CO 0.62 -0.01 -0.14 -0.90 -1.57 0.00 0.00 179.24 177.25 2dsa n ASP 59 N -4.77 0.85 0.00 6.45 5.68 -1.26 -4.88 116.55 118.62 2dsa n ASP 59 Ca 0.29 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.69 2dsa n ASP 59 Cb 0.99 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.99 2dsa n ASP 59 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dsa n GLY 60 N 1.26 2.80 3.76 6.12 0.00 -0.28 -5.08 105.19 113.78 2dsa n GLY 60 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.62 3.41 0.20 1.61 0.52 -1.26 -4.66 118.95 118.15 2dsa s ARG 61 Ca 0.00 2.09 0.10 0.00 -0.52 0.00 0.00 55.73 57.39 2dsa s ARG 61 Cb 0.00 -2.35 -0.04 0.00 0.52 0.00 0.00 34.95 33.08 2dsa s ARG 61 CO 0.00 -0.93 -0.19 0.95 0.02 0.00 0.00 175.30 175.15 2dsa s THR 62 N -1.38 2.04 -0.02 0.02 -4.23 -1.26 0.61 115.64 111.43 2dsa s THR 62 Ca 0.68 -2.09 0.03 0.00 -1.18 0.00 0.00 61.69 59.12 2dsa s THR 62 Cb -0.36 -2.03 -0.00 0.00 1.34 0.00 0.00 72.50 71.45 2dsa s THR 62 CO 0.44 -0.35 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.85 2dsa s LEU 63 N -2.96 1.88 0.00 4.79 2.96 0.36 -5.00 118.68 120.71 2dsa s LEU 63 Ca 0.21 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 2dsa s LEU 63 Cb -0.05 -0.61 0.00 0.00 0.50 0.00 0.00 46.19 46.03 2dsa s LEU 63 CO 0.09 0.10 0.01 0.35 -1.32 0.00 0.00 176.35 175.58 2dsa n THR 64 N 3.10 0.00 -1.64 3.68 -2.24 -1.26 -0.99 114.28 114.93 2dsa n THR 64 Ca -0.17 -1.88 0.00 0.00 -2.27 0.00 0.00 64.05 59.73 2dsa n THR 64 Cb 0.55 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2dsa n THR 64 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dsa n GLU 65 N -1.02 -3.96 -0.22 -0.78 -0.58 -1.26 -4.34 120.64 108.48 2dsa n GLU 65 Ca -0.16 2.95 -0.12 0.00 -0.42 0.00 0.00 57.16 59.42 2dsa n GLU 65 Cb 0.51 -3.07 -0.08 0.00 -0.57 0.00 0.00 31.44 28.23 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 3.06 -0.83 0.27 0.62 0.00 -1.94 -1.74 103.07 102.52 2dsa h GLY 66 Ca 0.00 0.70 0.22 0.00 0.00 0.00 0.00 47.33 48.25 2dsa h GLY 66 CO 0.00 -0.09 0.61 -2.55 0.00 0.00 0.00 176.54 174.51 2dsa h PRO 67 N -0.26 0.30 -0.03 4.80 0.11 -1.91 0.34 132.00 135.35 2dsa h PRO 67 Ca 0.12 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.12 2dsa h PRO 67 Cb 0.55 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 31.60 2dsa h PRO 67 CO -0.70 0.20 -0.33 0.00 -0.21 0.00 0.00 178.00 176.95 2dsa h ALA 68 N 1.60 0.08 -0.04 -0.75 0.00 -1.65 -3.16 119.26 115.34 2dsa h ALA 68 Ca 0.46 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dsa h ALA 68 Cb 1.31 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2dsa h ALA 68 CO -0.14 0.16 0.02 0.82 0.00 0.00 0.00 179.25 180.11 2dsa h ILE 69 N -0.29 1.06 -0.08 0.00 2.04 -0.64 -1.45 117.51 118.15 2dsa h ILE 69 Ca -0.03 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 2dsa h ILE 69 Cb 1.02 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 2dsa h ILE 69 CO 0.07 0.05 -0.20 -0.37 0.00 0.00 0.00 178.15 177.69 2dsa h VAL 70 N -0.02 1.19 -0.21 1.67 -1.51 -1.10 -1.08 116.25 115.20 2dsa h VAL 70 Ca 0.01 -0.88 -0.05 0.00 -1.23 0.00 0.00 66.70 64.55 2dsa h VAL 70 Cb 0.06 1.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.58 2dsa h VAL 70 CO -0.00 0.26 -0.07 1.56 -1.23 0.00 0.00 177.57 178.10 2dsa h GLN 71 N 0.13 0.41 -0.44 5.19 4.20 -1.48 -1.58 115.11 121.54 2dsa h GLN 71 Ca 0.02 -0.16 0.08 0.00 0.06 0.00 0.00 58.65 58.65 2dsa h GLN 71 Cb 0.44 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.13 2dsa h GLN 71 CO 0.03 0.67 0.01 -0.92 -0.67 0.00 0.00 178.83 177.95 2dsa h TYR 72 N 0.13 -0.01 0.03 2.96 5.03 -0.73 -1.53 116.97 122.85 2dsa h TYR 72 Ca 0.05 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.40 2dsa h TYR 72 Cb 0.53 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.87 2dsa h TYR 72 CO 0.06 -0.08 -0.04 0.28 -1.32 0.00 0.00 178.16 177.05 2dsa h VAL 73 N 0.12 0.90 -0.71 1.81 2.07 -1.17 -2.62 116.25 116.66 2dsa h VAL 73 Ca 0.22 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.82 2dsa h VAL 73 Cb 0.31 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 2dsa h VAL 73 CO -0.35 0.00 0.37 0.00 0.02 0.00 0.00 177.57 177.60 2dsa h ALA 74 N 0.88 0.98 0.00 1.67 0.00 -1.19 -2.47 119.26 119.14 2dsa h ALA 74 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dsa h ALA 74 Cb 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dsa h ALA 74 CO -0.02 -0.02 0.00 -0.25 0.00 0.00 0.00 179.25 178.96 2dsa n ASP 75 N -4.84 0.00 0.08 0.00 10.43 -0.58 -2.09 116.55 119.54 2dsa n ASP 75 Ca 0.11 0.43 -0.08 0.00 2.57 0.00 0.00 54.79 57.82 2dsa n ASP 75 Cb 0.25 -0.47 -0.07 0.00 1.84 0.00 0.00 41.12 42.67 2dsa n ASP 75 CO 0.00 0.00 0.00 1.56 -1.07 0.00 0.00 177.20 177.69 2dsa h GLN 76 N 0.00 0.06 -2.33 -1.24 1.08 -1.14 -3.39 115.11 108.16 2dsa h GLN 76 Ca 0.00 -0.09 -0.59 0.00 -1.45 0.00 0.00 58.65 56.52 2dsa h GLN 76 Cb 0.33 0.03 -0.41 0.00 -0.05 0.00 0.00 27.48 27.38 2dsa h GLN 76 CO 0.00 0.98 -0.74 0.28 -0.95 0.00 0.00 178.83 178.40 2dsa n VAL 77 N -3.47 1.19 -0.33 -0.54 0.31 -0.89 -4.97 118.33 109.63 2dsa n VAL 77 Ca -0.02 -4.71 0.11 0.00 -0.01 0.00 0.00 64.34 59.71 2dsa n VAL 77 Cb 0.89 -2.04 0.29 0.00 -0.91 0.00 0.00 33.84 32.08 2dsa n VAL 77 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2dsa h PRO 78 N 4.50 0.68 -0.03 5.55 0.11 -1.76 -0.80 132.00 140.24 2dsa h PRO 78 Ca 0.17 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.24 2dsa h PRO 78 Cb 0.75 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.71 2dsa h PRO 78 CO 0.69 0.45 0.11 0.78 -0.21 0.00 0.00 178.00 179.81 2dsa h GLY 79 N 0.70 0.00 2.00 -0.55 0.00 -1.93 0.40 103.07 103.69 2dsa h GLY 79 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.88 2dsa h GLY 79 CO -0.39 0.00 0.00 0.50 0.00 0.00 0.00 176.54 176.65 2dsa h LYS 80 N 0.00 0.00 -6.11 4.80 1.79 -1.50 -3.48 116.57 112.08 2dsa h LYS 80 Ca 0.01 0.00 -0.42 0.00 -2.18 0.00 0.00 60.65 58.06 2dsa h LYS 80 Cb 0.23 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 30.93 2dsa h LYS 80 CO -0.00 0.00 -0.82 1.04 -1.08 0.00 0.00 179.45 178.59 2dsa n GLN 81 N -2.52 -5.04 0.00 3.15 6.02 0.13 -4.92 117.38 114.20 2dsa n GLN 81 Ca 0.05 0.62 0.12 0.00 -0.01 0.00 0.00 57.00 57.78 2dsa n GLN 81 Cb 0.43 -5.23 0.20 0.00 1.02 0.00 0.00 30.24 26.67 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 -4.33 0.95 -3.74 1.08 4.77 -1.26 -4.69 117.00 109.79 2dsa n LEU 82 Ca -0.25 -0.27 -0.13 0.00 -0.03 0.00 0.00 56.01 55.33 2dsa n LEU 82 Cb 0.66 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2dsa n LEU 82 CO 0.69 0.20 0.06 0.00 -1.33 0.00 0.00 177.39 177.01 2dsa s ALA 83 N -2.76 -0.92 0.69 -1.18 0.00 -1.26 -0.62 121.76 115.70 2dsa s ALA 83 Ca 0.16 0.72 -0.17 0.00 0.00 0.00 0.00 51.96 52.67 2dsa s ALA 83 Cb 0.18 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.06 2dsa s ALA 83 CO 0.65 -0.23 1.13 -2.30 0.00 0.00 0.00 175.76 175.01 2dsa n PRO 84 N 1.95 0.77 -1.69 0.00 -0.02 -1.26 -4.92 135.00 129.82 2dsa n PRO 84 Ca -0.18 0.32 -0.43 0.00 -2.02 0.00 0.00 63.50 61.19 2dsa n PRO 84 Cb 0.57 -2.37 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 2dsa n PRO 84 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dsa n ALA 85 N -2.26 1.26 -1.74 3.55 0.00 -1.26 -4.69 120.51 115.37 2dsa n ALA 85 Ca 0.14 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.58 2dsa n ALA 85 Cb 0.49 -2.26 0.05 0.00 0.00 0.00 0.00 19.45 17.73 2dsa n ALA 85 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2dsa s ASN 86 N -0.11 4.97 0.00 0.00 0.01 -1.26 -2.02 114.94 116.52 2dsa s ASN 86 Ca 0.59 2.72 0.00 0.00 -0.71 0.00 0.00 52.86 55.47 2dsa s ASN 86 Cb -0.59 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.44 2dsa s ASN 86 CO 0.58 -1.77 0.00 0.61 -1.51 0.00 0.00 177.10 175.01 2dsa n GLY 87 N 0.80 2.94 3.81 0.66 0.00 -1.26 -5.01 105.19 107.12 2dsa n GLY 87 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.91 7.03 0.33 1.61 1.04 -0.86 -4.98 113.70 114.96 2dsa s SER 88 Ca 0.00 1.76 0.02 0.00 0.48 0.00 0.00 55.95 58.21 2dsa s SER 88 Cb 0.00 -2.55 0.59 0.00 0.10 0.00 0.00 66.02 64.16 2dsa s SER 88 CO 0.00 -0.29 1.96 0.15 0.98 0.00 0.00 173.24 176.03 2dsa h PHE 89 N 2.30 0.91 0.00 5.02 3.57 -1.95 -2.41 116.94 124.38 2dsa h PHE 89 Ca -0.48 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.03 2dsa h PHE 89 Cb 1.19 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 2dsa h PHE 89 CO 0.61 0.52 -0.04 0.93 -2.23 0.00 0.00 178.31 178.10 2dsa h GLU 90 N 0.93 0.00 -0.39 1.11 4.39 -1.93 -1.94 114.58 116.75 2dsa h GLU 90 Ca 0.32 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.89 2dsa h GLU 90 Cb 0.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2dsa h GLU 90 CO -0.10 0.04 -0.27 -0.09 -1.16 0.00 0.00 179.01 177.43 2dsa h ARG 91 N 0.00 0.83 -0.44 2.33 9.65 -1.65 0.57 114.38 125.67 2dsa h ARG 91 Ca -0.00 -0.37 -0.06 0.00 -1.10 0.00 0.00 59.98 58.45 2dsa h ARG 91 Cb 0.19 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 2dsa h ARG 91 CO 0.01 1.00 0.02 1.88 2.80 0.00 0.00 179.97 185.67 2dsa h TYR 92 N 0.71 0.74 -0.61 2.20 -1.99 -1.43 -1.18 116.97 115.42 2dsa h TYR 92 Ca 0.09 -0.09 -0.09 0.00 2.00 0.00 0.00 58.73 60.64 2dsa h TYR 92 Cb 0.82 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.31 2dsa h TYR 92 CO 0.05 0.69 0.04 1.25 -0.00 0.00 0.00 178.16 180.19 2dsa h HIS 93 N 0.67 1.11 -0.09 4.88 2.76 -1.28 0.11 115.15 123.30 2dsa h HIS 93 Ca 0.14 -0.17 0.02 0.00 -2.20 0.00 0.00 60.37 58.16 2dsa h HIS 93 Cb 0.39 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 29.03 2dsa h HIS 93 CO 0.02 0.96 -0.04 1.25 -1.30 0.00 0.00 177.93 178.82 2dsa h LEU 94 N 0.95 -0.14 -1.15 0.26 5.85 -0.60 -2.12 115.31 118.35 2dsa h LEU 94 Ca 0.18 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 2dsa h LEU 94 Cb 0.49 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2dsa h LEU 94 CO 0.02 -0.06 0.25 1.56 -0.34 0.00 0.00 178.44 179.87 2dsa h GLN 95 N -0.04 0.84 -0.07 1.25 4.20 -0.94 -0.68 115.11 119.68 2dsa h GLN 95 Ca 0.05 -0.12 0.03 0.00 0.06 0.00 0.00 58.65 58.67 2dsa h GLN 95 Cb 0.11 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 2dsa h GLN 95 CO -0.12 0.68 -0.15 0.37 -0.67 0.00 0.00 178.83 178.95 2dsa h GLN 96 N 0.84 -0.20 -0.59 1.46 4.15 -0.62 -1.68 115.11 118.47 2dsa h GLN 96 Ca 0.20 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.58 2dsa h GLN 96 Cb 0.14 0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 2dsa h GLN 96 CO -0.02 -0.13 0.12 -1.49 -1.93 0.00 0.00 178.83 175.38 2dsa h TRP 97 N -0.21 0.96 -0.39 3.99 4.06 -0.93 -0.73 115.95 122.69 2dsa h TRP 97 Ca 0.07 -0.10 -0.00 0.00 2.06 0.00 0.00 58.89 60.91 2dsa h TRP 97 Cb 0.31 -0.27 -0.02 0.00 -1.00 0.00 0.00 29.16 28.18 2dsa h TRP 97 CO -0.23 0.81 0.23 -0.07 -3.56 0.00 0.00 178.44 175.62 2dsa h LEU 98 N 0.88 0.48 -0.83 -4.49 3.38 -1.00 0.61 115.31 114.33 2dsa h LEU 98 Ca 0.19 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2dsa h LEU 98 Cb 0.34 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2dsa h LEU 98 CO 0.00 0.40 -0.18 -1.13 0.09 0.00 0.00 178.44 177.62 2dsa h ASN 99 N 0.52 0.68 -0.08 -0.43 -1.24 -1.14 -1.01 115.58 112.86 2dsa h ASN 99 Ca 0.14 -0.22 -0.01 0.00 0.71 0.00 0.00 56.30 56.93 2dsa h ASN 99 Cb 0.01 -0.18 -0.00 0.00 0.73 0.00 0.00 38.32 38.87 2dsa h ASN 99 CO -0.03 0.86 0.03 0.15 -1.29 0.00 0.00 177.43 177.16 2dsa h PHE 100 N 0.60 0.13 -0.28 0.67 3.57 -0.74 0.01 116.94 120.90 2dsa h PHE 100 Ca 0.09 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.62 2dsa h PHE 100 Cb 0.64 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 2dsa h PHE 100 CO 0.03 0.25 0.08 0.82 -2.23 0.00 0.00 178.31 177.26 2dsa h ILE 101 N -0.03 0.90 0.24 1.41 2.04 -0.76 0.91 117.51 122.22 2dsa h ILE 101 Ca 0.03 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 2dsa h ILE 101 Cb 0.17 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2dsa h ILE 101 CO -0.00 0.04 -0.11 -1.28 0.00 0.00 0.00 178.15 176.79 2dsa h SER 102 N 0.20 -0.27 0.72 1.72 0.87 -1.11 0.12 113.55 115.80 2dsa h SER 102 Ca 0.13 -0.14 -0.24 0.00 -1.23 0.00 0.00 61.79 60.30 2dsa h SER 102 Cb 0.11 0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 2dsa h SER 102 CO -0.14 -0.02 -1.40 0.77 -0.53 0.00 0.00 176.83 175.51 2dsa h SER 103 N -0.52 0.00 0.00 6.23 4.64 -0.97 -2.09 113.55 120.83 2dsa h SER 103 Ca -0.03 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.23 2dsa h SER 103 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 2dsa h SER 103 CO 0.05 0.93 -1.95 -0.62 -0.87 0.00 0.00 176.83 174.37 2dsa n GLU 104 N -3.13 0.67 0.00 4.77 -0.58 0.30 -4.46 120.64 118.21 2dsa n GLU 104 Ca -0.10 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.49 2dsa n GLU 104 Cb 0.98 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 30.38 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 -2.26 0.00 -0.19 -4.62 4.77 -0.93 -4.56 117.00 109.19 2dsa n LEU 105 Ca -0.08 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.85 2dsa n LEU 105 Cb 0.61 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2dsa n LEU 105 CO 0.41 -0.27 0.34 1.57 -1.33 0.00 0.00 177.39 178.11 2dsa n HIS 106 N -1.92 -0.20 0.29 -1.77 -0.00 0.36 -0.32 115.22 111.66 2dsa n HIS 106 Ca 0.00 0.58 0.18 0.00 0.46 0.00 0.00 57.72 58.94 2dsa n HIS 106 Cb 0.00 -0.49 0.93 0.00 -0.12 0.00 0.00 29.99 30.32 2dsa n HIS 106 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 2dsa h LYS 107 N 0.00 0.00 0.08 1.57 1.79 -1.59 -1.21 116.57 117.21 2dsa h LYS 107 Ca 0.07 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.27 2dsa h LYS 107 Cb 0.19 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2dsa h LYS 107 CO -0.43 0.00 -1.36 0.77 -1.08 0.00 0.00 179.45 177.34 2dsa h SER 108 N 0.00 0.28 0.11 0.86 0.02 -0.92 -3.28 113.55 110.62 2dsa h SER 108 Ca 0.00 -0.35 -0.02 0.00 -0.84 0.00 0.00 61.79 60.58 2dsa h SER 108 Cb 0.11 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 2dsa h SER 108 CO 0.00 1.29 -0.10 -0.26 -1.14 0.00 0.00 176.83 176.61 2dsa h PHE 109 N 0.05 0.00 -0.24 3.45 0.04 -0.44 -3.34 116.94 116.45 2dsa h PHE 109 Ca -0.17 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.66 2dsa h PHE 109 Cb 1.95 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 40.04 2dsa h PHE 109 CO 0.04 0.10 -0.16 0.77 -0.60 0.00 0.00 178.31 178.47 2dsa h SER 110 N 0.00 -0.52 0.91 2.17 0.02 -1.56 -1.78 113.55 112.78 2dsa h SER 110 Ca -0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2dsa h SER 110 Cb 0.19 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2dsa h SER 110 CO 0.01 -0.20 0.00 -2.65 -1.14 0.00 0.00 176.83 172.86 2dsa n PRO 111 N -5.32 0.17 0.15 3.45 -0.02 -1.25 -2.43 135.00 129.74 2dsa n PRO 111 Ca -0.01 0.31 0.02 0.00 -2.02 0.00 0.00 63.50 61.81 2dsa n PRO 111 Cb 0.24 -1.77 0.18 0.00 -0.02 0.00 0.00 33.50 32.12 2dsa n PRO 111 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2dsa h LEU 112 N 0.00 0.00 -0.22 2.45 3.38 -1.50 -3.02 115.31 116.40 2dsa h LEU 112 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2dsa h LEU 112 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2dsa h LEU 112 CO 0.00 0.52 -0.14 -0.26 0.09 0.00 0.00 178.44 178.66 2dsa h PHE 113 N 0.00 0.00 -3.38 1.13 -1.00 -1.29 -3.46 116.94 108.94 2dsa h PHE 113 Ca -0.01 0.00 -0.59 0.00 2.81 0.00 0.00 57.97 60.19 2dsa h PHE 113 Cb 1.16 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.64 2dsa h PHE 113 CO 0.00 0.14 0.67 1.21 -1.61 0.00 0.00 178.31 178.72 2dsa s ASN 114 N -6.22 6.80 0.47 2.17 2.47 -1.14 -4.95 114.94 114.55 2dsa s ASN 114 Ca 0.05 0.84 0.22 0.00 0.42 0.00 0.00 52.86 54.39 2dsa s ASN 114 Cb 0.06 -2.49 1.19 0.00 -1.45 0.00 0.00 41.25 38.56 2dsa s ASN 114 CO 0.67 -0.81 1.99 1.55 -3.72 0.00 0.00 177.10 176.79 2dsa h PRO 115 N 8.19 0.00 -0.26 0.43 0.13 -1.88 -3.19 132.00 135.42 2dsa h PRO 115 Ca -0.22 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 2dsa h PRO 115 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2dsa h PRO 115 CO 0.98 0.19 -0.17 0.00 -0.23 0.00 0.00 178.00 178.77 2dsa h ALA 116 N 1.81 0.37 -2.41 -0.56 0.00 -1.94 -3.46 119.26 113.08 2dsa h ALA 116 Ca -0.00 -0.34 -0.58 0.00 0.00 0.00 0.00 54.91 53.99 2dsa h ALA 116 Cb 0.43 -0.09 0.09 0.00 0.00 0.00 0.00 17.79 18.23 2dsa h ALA 116 CO 0.02 0.28 0.56 -1.13 0.00 0.00 0.00 179.25 178.99 2dsa n SER 117 N -4.41 2.75 -4.70 0.00 3.41 -1.21 -4.96 113.62 104.50 2dsa n SER 117 Ca -0.04 1.17 -0.30 0.00 -0.26 0.00 0.00 58.87 59.44 2dsa n SER 117 Cb 0.39 -1.45 0.14 0.00 -0.26 0.00 0.00 64.21 63.03 2dsa n SER 117 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dsa s SER 118 N 0.03 3.38 0.46 4.04 1.04 -1.26 -4.86 113.70 116.53 2dsa s SER 118 Ca 0.63 1.71 0.25 0.00 0.48 0.00 0.00 55.95 59.02 2dsa s SER 118 Cb -0.61 -2.35 1.06 0.00 0.10 0.00 0.00 66.02 64.21 2dsa s SER 118 CO 0.55 -2.73 1.89 0.44 0.98 0.00 0.00 173.24 174.37 2dsa h ASP 119 N -1.61 0.00 -0.22 7.02 5.19 -1.98 -2.20 116.42 122.61 2dsa h ASP 119 Ca -0.48 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.78 2dsa h ASP 119 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2dsa h ASP 119 CO 0.51 0.20 -0.46 -0.08 -3.12 0.00 0.00 179.24 176.29 2dsa h GLU 120 N 0.00 0.71 0.56 3.56 4.81 -2.00 -2.59 114.58 119.64 2dsa h GLU 120 Ca -0.00 -0.46 -0.03 0.00 -0.13 0.00 0.00 59.36 58.74 2dsa h GLU 120 Cb 0.64 0.06 0.01 0.00 0.63 0.00 0.00 28.75 30.09 2dsa h GLU 120 CO 0.03 1.09 -0.27 2.35 -0.73 0.00 0.00 179.01 181.47 2dsa h TRP 121 N 0.42 -0.70 -0.97 0.92 2.91 -1.90 -3.02 115.95 113.61 2dsa h TRP 121 Ca 0.01 -0.02 0.18 0.00 1.13 0.00 0.00 58.89 60.18 2dsa h TRP 121 Cb 1.07 0.23 -0.09 0.00 -0.51 0.00 0.00 29.16 29.86 2dsa h TRP 121 CO 0.09 -0.38 0.61 0.87 -1.03 0.00 0.00 178.44 178.60 2dsa h LYS 122 N -0.91 0.71 -0.09 2.65 1.57 -1.46 -2.17 116.57 116.85 2dsa h LYS 122 Ca -0.08 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.51 2dsa h LYS 122 Cb 0.63 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 2dsa h LYS 122 CO 0.13 0.47 -0.61 -0.91 -0.57 0.00 0.00 179.45 177.96 2dsa h ASN 123 N 0.73 0.36 -0.48 0.86 4.21 -1.46 -0.28 115.58 119.52 2dsa h ASN 123 Ca 0.53 -0.20 -0.09 0.00 1.21 0.00 0.00 56.30 57.75 2dsa h ASN 123 Cb 0.87 -0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 37.95 2dsa h ASN 123 CO -0.30 0.88 -0.05 0.00 -1.29 0.00 0.00 177.43 176.67 2dsa h ALA 124 N 1.13 0.65 -0.34 -0.83 0.00 -1.27 -2.77 119.26 115.82 2dsa h ALA 124 Ca -0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 2dsa h ALA 124 Cb 1.12 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2dsa h ALA 124 CO 0.10 0.50 -0.39 0.28 0.00 0.00 0.00 179.25 179.74 2dsa h VAL 125 N 0.72 1.28 -0.54 0.00 2.07 -1.33 -2.73 116.25 115.71 2dsa h VAL 125 Ca 0.13 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 2dsa h VAL 125 Cb 0.58 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2dsa h VAL 125 CO 0.03 0.51 0.30 0.03 0.02 0.00 0.00 177.57 178.47 2dsa h ARG 126 N 0.68 0.74 -0.14 1.57 3.08 -1.02 -0.32 114.38 118.97 2dsa h ARG 126 Ca 0.06 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 2dsa h ARG 126 Cb 0.95 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.85 2dsa h ARG 126 CO 0.09 0.55 -0.25 0.37 -1.07 0.00 0.00 179.97 179.65 2dsa h GLN 127 N 0.75 0.42 -0.74 0.04 4.15 -1.39 -1.51 115.11 116.84 2dsa h GLN 127 Ca 0.19 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2dsa h GLN 127 Cb 0.02 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 2dsa h GLN 127 CO -0.03 0.86 0.47 0.77 -1.93 0.00 0.00 178.83 178.96 2dsa h SER 128 N 0.04 0.87 -0.60 -0.69 0.02 -1.34 -2.43 113.55 109.42 2dsa h SER 128 Ca 0.01 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2dsa h SER 128 Cb 0.83 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.13 2dsa h SER 128 CO 0.06 0.66 0.35 -0.07 -1.14 0.00 0.00 176.83 176.68 2dsa h LEU 129 N 1.01 0.73 -0.80 5.07 3.38 -1.01 -1.05 115.31 122.64 2dsa h LEU 129 Ca 0.27 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.21 2dsa h LEU 129 Cb -0.07 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 2dsa h LEU 129 CO -0.05 0.59 0.50 0.78 0.09 0.00 0.00 178.44 180.35 2dsa h ASN 130 N 0.81 0.82 -0.16 -0.43 2.35 -0.97 0.23 115.58 118.23 2dsa h ASN 130 Ca 0.21 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2dsa h ASN 130 Cb 0.01 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2dsa h ASN 130 CO -0.04 0.55 0.08 0.74 -1.65 0.00 0.00 177.43 177.12 2dsa h THR 131 N 0.96 1.11 -0.09 2.81 2.02 -1.12 -1.18 112.91 117.42 2dsa h THR 131 Ca 0.33 -0.31 -0.13 0.00 0.77 0.00 0.00 66.41 67.07 2dsa h THR 131 Cb 0.06 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2dsa h THR 131 CO -0.13 0.10 -0.50 0.03 0.37 0.00 0.00 175.52 175.39 2dsa h ARG 132 N 0.15 0.25 -0.52 6.66 2.47 -0.73 -2.48 114.38 120.18 2dsa h ARG 132 Ca 0.06 -0.14 -0.07 0.00 -1.26 0.00 0.00 59.98 58.56 2dsa h ARG 132 Cb 0.09 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 2dsa h ARG 132 CO -0.01 0.70 0.05 -0.07 0.56 0.00 0.00 179.97 181.20 2dsa h LEU 133 N 0.20 0.86 -0.63 3.04 3.38 -0.49 -1.98 115.31 119.69 2dsa h LEU 133 Ca 0.01 -0.28 0.10 0.00 0.09 0.00 0.00 57.88 57.80 2dsa h LEU 133 Cb 0.96 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.41 2dsa h LEU 133 CO 0.08 0.92 0.23 1.23 0.09 0.00 0.00 178.44 180.99 2dsa h GLY 134 N 0.76 0.88 0.95 0.83 0.00 -0.91 0.18 103.07 105.77 2dsa h GLY 134 Ca 0.15 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 2dsa h GLY 134 CO 0.02 -0.03 0.09 -1.61 0.00 0.00 0.00 176.54 175.00 2dsa h GLN 135 N 0.41 0.21 -0.62 4.80 4.15 -1.22 -0.80 115.11 122.04 2dsa h GLN 135 Ca 0.32 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.67 2dsa h GLN 135 Cb 0.41 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 2dsa h GLN 135 CO -0.32 0.21 0.22 0.28 -1.93 0.00 0.00 178.83 177.29 2dsa h VAL 136 N 0.16 1.24 -0.70 2.39 2.07 -1.17 -2.22 116.25 118.01 2dsa h VAL 136 Ca 0.05 -0.79 0.10 0.00 0.82 0.00 0.00 66.70 66.89 2dsa h VAL 136 Cb 0.06 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.33 2dsa h VAL 136 CO -0.01 0.31 0.32 0.00 0.02 0.00 0.00 177.57 178.21 2dsa h ALA 137 N 1.08 0.96 -0.47 1.67 0.00 -0.84 -1.38 119.26 120.29 2dsa h ALA 137 Ca 0.20 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 2dsa h ALA 137 Cb 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2dsa h ALA 137 CO -0.01 -0.11 0.14 0.00 0.00 0.00 0.00 179.25 179.27 2dsa h ARG 138 N 0.53 0.73 -0.60 0.00 3.08 -0.79 -2.52 114.38 114.82 2dsa h ARG 138 Ca 0.36 -0.16 0.10 0.00 0.07 0.00 0.00 59.98 60.35 2dsa h ARG 138 Cb 0.43 -0.10 -0.08 0.00 0.08 0.00 0.00 29.97 30.29 2dsa h ARG 138 CO -0.30 0.70 0.18 0.37 -1.07 0.00 0.00 179.97 179.84 2dsa h GLN 139 N 0.62 0.33 0.00 0.04 5.75 -1.02 -1.79 115.11 119.05 2dsa h GLN 139 Ca 0.15 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2dsa h GLN 139 Cb 0.27 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.75 2dsa h GLN 139 CO -0.00 0.22 0.00 1.28 -2.65 0.00 0.00 178.83 177.67 2dsa n LEU 140 N -5.06 0.00 0.08 -2.39 4.77 -0.55 -1.89 117.00 111.96 2dsa n LEU 140 Ca 0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.05 2dsa n LEU 140 Cb 0.29 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 2dsa n LEU 140 CO 0.20 0.00 0.11 -0.33 -1.33 0.00 0.00 177.39 176.04 2dsa h GLU 141 N 0.00 0.00 0.00 3.23 5.08 -0.91 -3.38 114.58 118.59 2dsa h GLU 141 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 2dsa h GLU 141 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2dsa h GLU 141 CO 0.00 0.58 -0.64 0.45 -1.00 0.00 0.00 179.01 178.40 2dsa h HIS 142 N 0.00 0.00 -2.51 4.33 3.86 -1.44 -3.47 115.15 115.92 2dsa h HIS 142 Ca -0.07 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.21 2dsa h HIS 142 Cb 1.60 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.93 2dsa h HIS 142 CO 0.00 0.64 0.41 0.00 0.86 0.00 0.00 177.93 179.84 2dsa s ALA 143 N -3.47 -1.75 -0.20 2.45 0.00 -1.25 -5.05 121.76 112.49 2dsa s ALA 143 Ca -0.01 0.82 0.29 0.00 0.00 0.00 0.00 51.96 53.06 2dsa s ALA 143 Cb 0.12 0.57 1.13 0.00 0.00 0.00 0.00 23.12 24.94 2dsa s ALA 143 CO 0.76 -0.73 1.85 -1.00 0.00 0.00 0.00 175.76 176.64 2dsa h PRO 144 N 2.00 0.00 -5.24 0.00 0.13 -1.84 -3.41 132.00 123.64 2dsa h PRO 144 Ca -0.26 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.47 2dsa h PRO 144 Cb 1.26 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.25 2dsa h PRO 144 CO 0.33 0.00 -0.69 0.71 -0.23 0.00 0.00 178.00 178.12 2dsa s TYR 145 N -3.47 1.58 0.32 1.56 1.51 -0.48 -4.88 117.35 113.49 2dsa s TYR 145 Ca 0.03 -0.78 0.09 0.00 -1.01 0.00 0.00 57.07 55.40 2dsa s TYR 145 Cb 0.09 -0.86 0.85 0.00 -0.11 0.00 0.00 41.96 41.93 2dsa s TYR 145 CO 0.50 0.12 1.75 -0.07 -1.11 0.00 0.00 175.55 176.74 2dsa h LEU 146 N 2.53 0.70 -2.98 -1.29 4.07 -1.88 -2.09 115.31 114.36 2dsa h LEU 146 Ca -0.38 0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.70 2dsa h LEU 146 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 2dsa h LEU 146 CO 0.64 0.17 0.00 0.18 -1.08 0.00 0.00 178.44 178.35 2dsa n LEU 147 N -4.82 3.45 0.00 1.67 4.77 -1.26 -5.00 117.00 115.81 2dsa n LEU 147 Ca 0.25 -2.25 0.00 0.00 -0.03 0.00 0.00 56.01 53.98 2dsa n LEU 147 Cb 0.69 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2dsa n LEU 147 CO 0.19 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2dsa n GLY 148 N 0.51 0.22 0.03 -0.72 0.00 -0.79 -4.83 105.19 99.61 2dsa n GLY 148 Ca 0.17 -1.49 0.12 0.00 0.00 0.00 0.00 46.02 44.82 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 0.66 -4.47 1.61 8.00 -1.26 -1.39 116.55 119.70 2dsa n ASP 149 Ca 0.00 -0.45 -0.33 0.00 0.71 0.00 0.00 54.79 54.72 2dsa n ASP 149 Cb 0.00 0.36 -0.13 0.00 -0.02 0.00 0.00 41.12 41.33 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 -2.94 3.09 0.19 -1.24 2.00 -1.26 -4.89 119.66 114.62 2dsa s GLN 150 Ca 0.12 -0.62 -0.31 0.00 -2.00 0.00 0.00 55.36 52.55 2dsa s GLN 150 Cb 0.17 -2.62 -0.10 0.00 0.80 0.00 0.00 33.01 31.27 2dsa s GLN 150 CO 0.71 0.42 1.48 -1.17 -0.50 0.00 0.00 175.29 176.23 2dsa s LEU 151 N -0.18 4.38 0.38 3.68 2.96 -1.26 -4.71 118.68 123.93 2dsa s LEU 151 Ca 0.01 2.59 0.07 0.00 -0.22 0.00 0.00 54.13 56.58 2dsa s LEU 151 Cb -0.13 -3.61 -0.07 0.00 0.50 0.00 0.00 46.19 42.88 2dsa s LEU 151 CO 0.03 -0.74 0.00 -0.94 -1.32 0.00 0.00 176.35 173.38 2dsa s SER 152 N 0.80 3.56 0.48 3.68 1.04 -1.26 -4.47 113.70 117.52 2dsa s SER 152 Ca 0.65 -1.35 0.31 0.00 0.48 0.00 0.00 55.95 56.04 2dsa s SER 152 Cb -0.42 -0.33 1.70 0.00 0.10 0.00 0.00 66.02 67.07 2dsa s SER 152 CO 0.36 -0.45 1.95 -0.37 0.98 0.00 0.00 173.24 175.72 2dsa h VAL 153 N 1.88 0.00 -0.20 5.02 -1.51 -1.23 -1.04 116.25 119.17 2dsa h VAL 153 Ca -0.43 0.00 -0.20 0.00 -1.23 0.00 0.00 66.70 64.84 2dsa h VAL 153 Cb 1.24 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 2dsa h VAL 153 CO 0.77 0.00 -0.67 0.00 -1.23 0.00 0.00 177.57 176.44 2dsa h ALA 154 N 1.94 0.43 -0.50 5.19 0.00 -1.91 -1.77 119.26 122.64 2dsa h ALA 154 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 2dsa h ALA 154 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2dsa h ALA 154 CO 0.00 0.69 0.26 -0.44 0.00 0.00 0.00 179.25 179.76 2dsa h ASP 155 N 0.55 0.64 -0.03 0.00 5.19 -1.60 -0.76 116.42 120.40 2dsa h ASP 155 Ca -0.02 -0.10 0.03 0.00 -0.62 0.00 0.00 57.03 56.32 2dsa h ASP 155 Cb 1.28 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 40.59 2dsa h ASP 155 CO 0.14 0.56 -0.20 0.40 -3.12 0.00 0.00 179.24 177.01 2dsa h ILE 156 N 0.66 0.51 -0.21 0.35 2.04 -1.48 0.14 117.51 119.53 2dsa h ILE 156 Ca 0.17 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.07 2dsa h ILE 156 Cb 0.07 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 2dsa h ILE 156 CO -0.03 0.00 -0.04 0.22 0.00 0.00 0.00 178.15 178.31 2dsa h TYR 157 N -0.31 -0.08 -0.69 1.37 3.20 -1.15 -2.09 116.97 117.22 2dsa h TYR 157 Ca 0.07 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.02 2dsa h TYR 157 Cb 0.41 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.68 2dsa h TYR 157 CO -0.27 -0.07 0.39 1.25 -1.64 0.00 0.00 178.16 177.82 2dsa h LEU 158 N 0.02 0.57 -0.29 2.82 5.85 -0.94 -2.01 115.31 121.34 2dsa h LEU 158 Ca 0.10 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2dsa h LEU 158 Cb 0.14 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2dsa h LEU 158 CO -0.20 0.36 0.02 0.15 -0.34 0.00 0.00 178.44 178.44 2dsa h PHE 159 N 0.71 0.02 -0.20 1.25 3.57 -0.37 0.76 116.94 122.68 2dsa h PHE 159 Ca 0.31 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.86 2dsa h PHE 159 Cb 0.21 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 2dsa h PHE 159 CO -0.08 -0.03 0.02 0.28 -2.23 0.00 0.00 178.31 176.28 2dsa h VAL 160 N 0.11 0.89 -0.52 1.41 2.07 -1.01 -1.16 116.25 118.03 2dsa h VAL 160 Ca 0.14 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.57 2dsa h VAL 160 Cb 0.17 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2dsa h VAL 160 CO -0.21 0.02 0.11 0.58 0.02 0.00 0.00 177.57 178.09 2dsa h VAL 161 N 0.09 1.25 -0.21 2.57 2.07 -1.15 -2.58 116.25 118.28 2dsa h VAL 161 Ca 0.09 -0.89 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 2dsa h VAL 161 Cb 0.10 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2dsa h VAL 161 CO -0.14 0.32 -0.14 -0.07 0.02 0.00 0.00 177.57 177.57 2dsa h LEU 162 N 0.74 0.34 -2.26 2.57 3.38 -0.71 -2.44 115.31 116.92 2dsa h LEU 162 Ca 0.16 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2dsa h LEU 162 Cb 0.36 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2dsa h LEU 162 CO 0.00 0.50 0.00 1.23 0.09 0.00 0.00 178.44 180.27 2dsa h GLY 163 N 0.85 0.00 2.00 0.83 0.00 -0.79 -1.03 103.07 104.93 2dsa h GLY 163 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2dsa h GLY 163 CO 0.03 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.36 2dsa n TRP 164 N -2.86 0.20 -0.25 5.60 8.01 -0.92 -4.13 117.44 123.09 2dsa n TRP 164 Ca -0.02 0.06 0.04 0.00 -1.31 0.00 0.00 57.50 56.27 2dsa n TRP 164 Cb 0.11 -0.60 0.27 0.00 -2.01 0.00 0.00 31.31 29.08 2dsa n TRP 164 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 2dsa h SER 165 N 0.00 0.84 -0.21 -0.99 0.02 -1.34 -2.02 113.55 109.85 2dsa h SER 165 Ca 0.00 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2dsa h SER 165 Cb 0.48 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2dsa h SER 165 CO 0.00 0.56 0.08 0.00 -1.14 0.00 0.00 176.83 176.33 2dsa h ALA 166 N 1.54 1.62 0.00 3.77 0.00 -1.73 0.59 119.26 125.05 2dsa h ALA 166 Ca 0.35 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2dsa h ALA 166 Cb 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2dsa h ALA 166 CO -0.12 0.29 -0.12 0.66 0.00 0.00 0.00 179.25 179.97 2dsa n TYR 167 N -4.39 0.33 -0.65 0.00 4.02 -0.77 -3.49 117.16 112.21 2dsa n TYR 167 Ca 0.01 0.10 0.04 0.00 -0.01 0.00 0.00 57.90 58.04 2dsa n TYR 167 Cb 0.15 -0.62 0.06 0.00 -0.02 0.00 0.00 39.34 38.91 2dsa n TYR 167 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2dsa n VAL 168 N -1.79 1.21 -3.08 -0.72 0.24 -1.03 -4.99 118.33 108.18 2dsa n VAL 168 Ca 0.06 -1.37 -0.19 0.00 -2.04 0.00 0.00 64.34 60.81 2dsa n VAL 168 Cb 0.38 0.24 0.04 0.00 -1.47 0.00 0.00 33.84 33.03 2dsa n VAL 168 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2dsa n ASN 169 N -0.81 -5.42 -4.55 -1.34 2.85 -0.87 -5.00 115.26 100.13 2dsa n ASN 169 Ca 0.06 -0.31 -0.39 0.00 -0.11 0.00 0.00 54.58 53.83 2dsa n ASN 169 Cb 0.46 -4.17 -0.11 0.00 1.24 0.00 0.00 39.78 37.20 2dsa n ASN 169 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2dsa s ILE 170 N -3.14 5.25 -0.06 -1.44 1.01 0.14 -5.04 121.20 117.93 2dsa s ILE 170 Ca 0.34 -0.06 -0.23 0.00 0.00 0.00 0.00 60.65 60.70 2dsa s ILE 170 Cb -0.15 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 2dsa s ILE 170 CO 0.42 0.11 0.68 -0.62 0.00 0.00 0.00 174.94 175.52 2dsa s ASP 171 N 1.73 6.98 0.00 3.58 2.15 -1.26 -4.22 116.67 125.63 2dsa s ASP 171 Ca 0.06 1.17 0.22 0.00 0.43 0.00 0.00 52.55 54.43 2dsa s ASP 171 Cb -0.17 -2.40 0.57 0.00 -0.30 0.00 0.00 42.92 40.62 2dsa s ASP 171 CO 0.10 -0.08 1.47 0.18 -0.17 0.00 0.00 175.17 176.67 2dsa n LEU 172 N 3.63 2.54 -0.16 -1.34 4.32 -1.26 -4.47 117.00 120.26 2dsa n LEU 172 Ca -0.02 -1.07 0.02 0.00 -0.02 0.00 0.00 56.01 54.91 2dsa n LEU 172 Cb 0.51 -0.17 0.29 0.00 -1.62 0.00 0.00 43.42 42.44 2dsa n LEU 172 CO 0.46 0.54 1.22 0.28 -1.22 0.00 0.00 177.39 178.67 2dsa h SER 173 N 3.35 0.76 0.00 -1.43 0.02 -1.99 -2.28 113.55 111.98 2dsa h SER 173 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2dsa h SER 173 Cb 0.74 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2dsa h SER 173 CO 0.00 0.55 0.07 -0.65 -1.14 0.00 0.00 176.83 175.66 2dsa h PRO 174 N 0.90 0.00 -3.10 3.45 0.11 -2.03 -3.32 132.00 128.00 2dsa h PRO 174 Ca 0.25 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.74 2dsa h PRO 174 Cb -0.09 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 30.61 2dsa h PRO 174 CO -0.06 0.00 -0.67 -1.58 -0.21 0.00 0.00 178.00 175.48 2dsa s TRP 175 N -3.77 2.80 0.34 0.65 0.51 -0.86 -4.99 118.94 113.62 2dsa s TRP 175 Ca -0.03 -2.95 0.13 0.00 -2.12 0.00 0.00 56.10 51.13 2dsa s TRP 175 Cb 0.08 -2.37 0.98 0.00 -0.81 0.00 0.00 33.47 31.35 2dsa s TRP 175 CO 0.26 -0.70 1.73 -1.35 -0.51 0.00 0.00 176.95 176.38 2dsa h PRO 176 N 6.17 0.47 -0.08 4.98 0.11 -1.77 -1.37 132.00 140.51 2dsa h PRO 176 Ca 0.03 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 2dsa h PRO 176 Cb 0.86 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 2dsa h PRO 176 CO 0.61 0.31 -0.29 0.66 -0.21 0.00 0.00 178.00 179.09 2dsa h SER 177 N 0.49 0.15 0.05 -2.05 4.64 -1.89 -0.19 113.55 114.75 2dsa h SER 177 Ca 0.65 -0.04 -0.17 0.00 -0.47 0.00 0.00 61.79 61.76 2dsa h SER 177 Cb 1.40 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2dsa h SER 177 CO -0.45 0.44 -0.59 -0.07 -0.87 0.00 0.00 176.83 175.29 2dsa h LEU 178 N 0.13 0.62 -0.34 5.97 3.38 -1.56 -1.57 115.31 121.94 2dsa h LEU 178 Ca 0.02 -0.35 -0.15 0.00 0.09 0.00 0.00 57.88 57.49 2dsa h LEU 178 Cb 0.59 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2dsa h LEU 178 CO 0.04 1.07 -0.38 1.56 0.09 0.00 0.00 178.44 180.82 2dsa h GLN 179 N 0.41 0.86 -0.55 1.13 4.20 -1.27 -0.76 115.11 119.14 2dsa h GLN 179 Ca -0.00 -0.47 -0.02 0.00 0.06 0.00 0.00 58.65 58.21 2dsa h GLN 179 Cb 1.15 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.92 2dsa h GLN 179 CO 0.11 1.11 0.24 0.00 -0.67 0.00 0.00 178.83 179.63 2dsa h ALA 180 N 0.74 1.39 0.33 3.87 0.00 -1.07 -2.18 119.26 122.33 2dsa h ALA 180 Ca 0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2dsa h ALA 180 Cb 0.97 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2dsa h ALA 180 CO 0.09 0.47 -0.16 0.35 0.00 0.00 0.00 179.25 180.01 2dsa h PHE 181 N 0.79 -0.41 -0.69 0.00 3.57 -1.16 -2.03 116.94 117.00 2dsa h PHE 181 Ca 0.19 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.82 2dsa h PHE 181 Cb 0.12 0.14 -0.13 0.00 2.79 0.00 0.00 35.95 38.87 2dsa h PHE 181 CO 0.01 -0.10 -0.17 1.96 -2.23 0.00 0.00 178.31 177.77 2dsa h GLN 182 N -0.73 -0.00 -0.52 1.11 1.08 -1.06 -0.79 115.11 114.21 2dsa h GLN 182 Ca -0.05 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.10 2dsa h GLN 182 Cb 0.50 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 2dsa h GLN 182 CO 0.07 -0.00 0.11 0.78 -0.95 0.00 0.00 178.83 178.84 2dsa h GLY 183 N -0.00 0.90 1.32 3.46 0.00 -1.41 0.32 103.07 107.66 2dsa h GLY 183 Ca 0.33 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 2dsa h GLY 183 CO -0.71 0.54 -0.00 -0.09 0.00 0.00 0.00 176.54 176.27 2dsa h ARG 184 N 0.72 0.83 0.08 4.80 2.43 -0.64 -2.91 114.38 119.69 2dsa h ARG 184 Ca 0.16 -0.23 -0.31 0.00 -0.81 0.00 0.00 59.98 58.79 2dsa h ARG 184 Cb 0.36 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2dsa h ARG 184 CO 0.01 0.83 -1.68 0.28 -1.51 0.00 0.00 179.97 177.90 2dsa h VAL 185 N 0.77 0.95 0.00 0.20 2.07 -1.12 -3.38 116.25 115.74 2dsa h VAL 185 Ca 0.15 -2.68 -0.03 0.00 0.82 0.00 0.00 66.70 64.95 2dsa h VAL 185 Cb 0.47 2.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.83 2dsa h VAL 185 CO 0.02 0.74 -0.14 1.23 0.02 0.00 0.00 177.57 179.44 2dsa h GLY 186 N 2.18 0.00 -2.01 2.17 0.00 -0.32 -3.00 103.07 102.10 2dsa h GLY 186 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2dsa h GLY 186 CO 0.12 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.27 2dsa n GLY 187 N -0.58 1.51 3.77 4.60 0.00 -1.10 -4.48 105.19 108.91 2dsa n GLY 187 Ca -0.02 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 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 -1.42 4.27 0.09 1.61 0.52 -1.13 -4.94 118.95 117.93 2dsa s ARG 188 Ca 0.38 1.62 -0.21 0.00 -0.52 0.00 0.00 55.73 57.00 2dsa s ARG 188 Cb 0.21 -2.72 -0.11 0.00 0.52 0.00 0.00 34.95 32.85 2dsa s ARG 188 CO 0.29 -0.07 1.67 1.05 0.02 0.00 0.00 175.30 178.25 2dsa h GLU 189 N 2.84 0.17 -0.81 3.54 4.11 -1.91 -1.56 114.58 120.96 2dsa h GLU 189 Ca -0.48 -0.02 0.11 0.00 0.07 0.00 0.00 59.36 59.04 2dsa h GLU 189 Cb 1.22 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 2dsa h GLU 189 CO 0.63 0.22 0.53 0.00 0.07 0.00 0.00 179.01 180.46 2dsa h ALA 190 N 0.95 1.81 -0.12 1.06 0.00 -1.93 0.13 119.26 121.16 2dsa h ALA 190 Ca 0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2dsa h ALA 190 Cb 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2dsa h ALA 190 CO -0.01 0.01 -0.05 0.28 0.00 0.00 0.00 179.25 179.48 2dsa h VAL 191 N 0.69 1.31 -0.31 0.00 2.07 -1.78 -2.32 116.25 115.91 2dsa h VAL 191 Ca 0.38 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.88 2dsa h VAL 191 Cb 0.54 1.77 -0.04 0.00 -1.52 0.00 0.00 31.29 32.04 2dsa h VAL 191 CO -0.15 0.31 0.09 1.56 0.02 0.00 0.00 177.57 179.39 2dsa h GLN 192 N -0.10 0.21 -0.46 1.57 1.08 -0.52 -1.13 115.11 115.76 2dsa h GLN 192 Ca 0.03 -0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.27 2dsa h GLN 192 Cb 0.51 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.86 2dsa h GLN 192 CO 0.02 0.14 0.31 0.77 -0.95 0.00 0.00 178.83 179.11 2dsa h SER 193 N 0.21 0.36 -0.11 1.46 0.02 -0.74 0.15 113.55 114.91 2dsa h SER 193 Ca 0.14 -0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.91 2dsa h SER 193 Cb 0.13 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 62.60 2dsa h SER 193 CO -0.17 0.24 -0.65 0.00 -1.14 0.00 0.00 176.83 175.11 2dsa h ALA 194 N 1.75 0.22 -0.39 3.77 0.00 -0.95 -1.87 119.26 121.79 2dsa h ALA 194 Ca 0.19 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2dsa h ALA 194 Cb 0.26 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2dsa h ALA 194 CO -0.05 0.51 0.20 -0.07 0.00 0.00 0.00 179.25 179.84 2dsa h LEU 195 N 0.28 0.49 0.57 0.00 -0.00 -0.49 -2.26 115.31 113.89 2dsa h LEU 195 Ca -0.05 -0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.70 2dsa h LEU 195 Cb 1.30 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.82 2dsa h LEU 195 CO 0.13 0.46 -0.37 0.03 -0.00 0.00 0.00 178.44 178.70 2dsa h ARG 196 N 0.49 -0.86 0.00 1.13 3.08 -1.04 0.05 114.38 117.23 2dsa h ARG 196 Ca 0.13 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2dsa h ARG 196 Cb 0.09 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2dsa h ARG 196 CO -0.02 -0.57 0.10 0.00 -1.07 0.00 0.00 179.97 178.41 2dsa h ALA 197 N -0.55 1.08 -0.01 0.04 0.00 -1.31 0.24 119.26 118.75 2dsa h ALA 197 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2dsa h ALA 197 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2dsa h ALA 197 CO 0.05 -0.08 -0.63 0.39 0.00 0.00 0.00 179.25 178.99 2dsa n GLU 198 N -2.49 1.07 -2.60 0.00 1.02 -0.86 -5.02 120.64 111.76 2dsa n GLU 198 Ca -0.02 -0.56 -0.08 0.00 -0.02 0.00 0.00 57.16 56.48 2dsa n GLU 198 Cb 0.14 -1.41 0.04 0.00 -0.02 0.00 0.00 31.44 30.19 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 1.38 -0.04 0.00 0.62 0.00 0.85 -4.79 105.19 103.21 2dsa n GLY 199 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2dsa n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36