#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1spb n VAL 4 N 0.00 0.57 -1.62 2.46 0.31 -1.26 -4.92 118.33 113.88 1spb n VAL 4 Ca 0.00 -0.24 -0.42 0.00 -0.01 0.00 0.00 64.34 63.67 1spb n VAL 4 Cb 0.00 -2.28 0.00 0.00 -0.91 0.00 0.00 33.84 30.66 1spb n VAL 4 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1spb n PRO 5 N 7.80 1.45 -0.30 5.55 -0.01 -1.26 -4.94 135.00 143.29 1spb n PRO 5 Ca 0.25 0.52 -0.04 0.00 -0.01 0.00 0.00 63.50 64.22 1spb n PRO 5 Cb 0.39 -2.03 0.08 0.00 -0.01 0.00 0.00 33.50 31.93 1spb n PRO 5 CO 0.00 0.00 0.00 -0.92 -0.01 0.00 0.00 175.50 174.57 1spb h TYR 6 N 1.78 1.03 -1.00 6.00 3.20 -1.91 -3.20 116.97 122.87 1spb h TYR 6 Ca -0.43 0.02 0.29 0.00 3.14 0.00 0.00 58.73 61.75 1spb h TYR 6 Cb 1.33 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 39.21 1spb h TYR 6 CO 0.45 0.65 0.72 0.78 -1.64 0.00 0.00 178.16 179.12 1spb h GLY 7 N 1.11 0.06 0.54 1.82 0.00 -1.97 -0.67 103.07 103.96 1spb h GLY 7 Ca 0.30 -0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.66 1spb h GLY 7 CO -0.07 -0.00 -0.12 -2.08 0.00 0.00 0.00 176.54 174.27 1spb h VAL 8 N 0.02 0.66 -0.13 4.60 2.07 -1.93 -2.53 116.25 119.01 1spb h VAL 8 Ca 0.48 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.98 1spb h VAL 8 Cb 1.88 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1spb h VAL 8 CO -0.02 0.00 0.02 0.77 0.02 0.00 0.00 177.57 178.36 1spb h SER 9 N -0.15 0.20 -0.93 0.57 4.64 -1.30 -2.16 113.55 114.43 1spb h SER 9 Ca 0.09 -0.26 0.20 0.00 -0.47 0.00 0.00 61.79 61.34 1spb h SER 9 Cb 0.27 -0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.23 1spb h SER 9 CO -0.21 0.42 0.61 -0.61 -0.87 0.00 0.00 176.83 176.16 1spb h GLN 10 N -0.02 0.47 -0.00 4.77 4.15 -1.28 -1.28 115.11 121.91 1spb h GLN 10 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1spb h GLN 10 Cb 0.30 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1spb h GLN 10 CO 0.00 0.31 -0.13 0.44 -1.93 0.00 0.00 178.83 177.52 1spb n ILE 11 N -4.56 0.00 -2.01 2.39 -5.35 -0.97 -4.93 119.36 103.93 1spb n ILE 11 Ca 0.20 -0.03 -0.10 0.00 -0.27 0.00 0.00 62.75 62.55 1spb n ILE 11 Cb 0.68 -0.18 -0.01 0.00 -1.74 0.00 0.00 39.64 38.39 1spb n ILE 11 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1spb n LYS 12 N -1.17 -0.77 -0.32 6.28 5.02 -0.48 -0.59 118.16 126.11 1spb n LYS 12 Ca 0.12 0.56 0.10 0.00 -2.02 0.00 0.00 58.31 57.07 1spb n LYS 12 Cb 0.29 -4.59 0.28 0.00 -0.02 0.00 0.00 35.03 30.99 1spb n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1spb h ALA 13 N 0.38 1.47 -0.74 7.82 0.00 -1.58 -3.30 119.26 123.30 1spb h ALA 13 Ca -0.23 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1spb h ALA 13 Cb 1.07 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1spb h ALA 13 CO 0.28 -0.09 0.43 -1.35 0.00 0.00 0.00 179.25 178.52 1spb h PRO 14 N 0.67 1.01 0.00 0.00 0.11 -1.87 -2.34 132.00 129.59 1spb h PRO 14 Ca 0.52 -0.10 -0.06 0.00 0.11 0.00 0.00 66.00 66.48 1spb h PRO 14 Cb 0.80 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 1spb h PRO 14 CO -0.39 0.72 -0.27 0.00 -0.21 0.00 0.00 178.00 177.86 1spb h ALA 15 N 1.45 1.14 -0.07 -0.75 0.00 -1.96 -2.60 119.26 116.46 1spb h ALA 15 Ca 0.27 -0.24 -0.22 0.00 0.00 0.00 0.00 54.91 54.71 1spb h ALA 15 Cb -0.01 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1spb h ALA 15 CO -0.05 0.34 -0.85 1.25 0.00 0.00 0.00 179.25 179.94 1spb h LEU 16 N 0.00 0.74 -0.59 0.00 6.46 -1.52 -3.15 115.31 117.24 1spb h LEU 16 Ca -0.00 -0.53 0.02 0.00 -0.12 0.00 0.00 57.88 57.25 1spb h LEU 16 Cb 0.67 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 1spb h LEU 16 CO 0.03 1.31 0.38 0.45 -0.62 0.00 0.00 178.44 179.99 1spb h HIS 17 N 0.38 0.71 -0.63 1.25 3.86 -1.24 -0.96 115.15 118.52 1spb h HIS 17 Ca -0.07 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 1spb h HIS 17 Cb 1.47 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 29.68 1spb h HIS 17 CO 0.07 0.43 0.09 0.77 0.86 0.00 0.00 177.93 180.15 1spb h SER 18 N 0.76 0.99 0.42 2.45 0.02 -1.56 -2.93 113.55 113.69 1spb h SER 18 Ca 0.23 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1spb h SER 18 Cb -0.03 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.24 1spb h SER 18 CO -0.07 0.99 0.00 1.56 -1.14 0.00 0.00 176.83 178.17 1spb h GLN 19 N 0.97 0.00 -0.25 3.45 4.20 -1.46 -3.46 115.11 118.57 1spb h GLN 19 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1spb h GLN 19 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1spb h GLN 19 CO 0.01 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.58 1spb n GLY 20 N -0.60 1.08 3.09 3.46 0.00 -1.12 -5.12 105.19 105.98 1spb n GLY 20 Ca -0.00 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1spb n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1spb s TYR 21 N -2.25 2.87 0.00 1.61 2.02 -0.39 -4.97 117.35 116.25 1spb s TYR 21 Ca 0.00 -1.83 0.00 0.00 -0.37 0.00 0.00 57.07 54.87 1spb s TYR 21 Cb 0.00 -1.88 0.00 0.00 -0.40 0.00 0.00 41.96 39.68 1spb s TYR 21 CO 0.00 -0.82 0.33 0.25 -1.57 0.00 0.00 175.55 173.74 1spb n THR 22 N 4.57 0.00 -0.11 -0.71 -2.24 -1.26 -2.82 114.28 111.71 1spb n THR 22 Ca -0.18 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1spb n THR 22 Cb 0.47 1.35 0.00 0.00 -2.10 0.00 0.00 70.33 70.05 1spb n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1spb n GLY 23 N -0.00 0.94 3.68 3.38 0.00 -1.26 -1.34 105.19 110.60 1spb n GLY 23 Ca 0.00 -0.04 -0.51 0.00 0.00 0.00 0.00 46.02 45.47 1spb n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1spb n SER 24 N 0.07 2.89 -0.19 1.61 7.64 -1.25 -2.37 113.62 122.03 1spb n SER 24 Ca 0.00 1.03 -0.02 0.00 1.01 0.00 0.00 58.87 60.89 1spb n SER 24 Cb 0.00 -1.28 -0.00 0.00 -1.01 0.00 0.00 64.21 61.91 1spb n SER 24 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1spb n ASN 25 N 5.46 -2.19 -4.17 6.43 4.13 -1.26 -4.52 115.26 119.14 1spb n ASN 25 Ca 0.23 0.02 -0.33 0.00 1.68 0.00 0.00 54.58 56.18 1spb n ASN 25 Cb 0.23 -0.90 -0.16 0.00 -1.54 0.00 0.00 39.78 37.41 1spb n ASN 25 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1spb s VAL 26 N -2.08 2.10 -0.30 2.41 1.01 -1.00 -5.01 120.40 117.53 1spb s VAL 26 Ca 0.00 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 1spb s VAL 26 Cb 0.00 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1spb s VAL 26 CO 0.00 0.55 0.20 -0.54 0.00 0.00 0.00 175.10 175.31 1spb s LYS 27 N 0.86 3.75 -0.17 2.72 1.02 -1.26 0.98 119.74 127.65 1spb s LYS 27 Ca -0.06 -0.46 0.01 0.00 0.02 0.00 0.00 55.97 55.49 1spb s LYS 27 Cb -0.15 -3.70 0.02 0.00 -0.52 0.00 0.00 37.83 33.48 1spb s LYS 27 CO -0.03 -0.28 -0.20 0.08 -0.92 0.00 0.00 175.35 174.00 1spb s VAL 28 N 1.74 2.01 -0.23 3.17 1.01 0.23 -0.66 120.40 127.65 1spb s VAL 28 Ca 0.07 -0.92 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 1spb s VAL 28 Cb -0.17 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1spb s VAL 28 CO 0.10 0.53 0.35 0.00 0.00 0.00 0.00 175.10 176.09 1spb s ALA 29 N 1.18 3.57 -0.44 5.51 0.00 0.21 -1.15 121.76 130.63 1spb s ALA 29 Ca 0.02 -0.69 -0.15 0.00 0.00 0.00 0.00 51.96 51.14 1spb s ALA 29 Cb -0.14 -2.62 0.05 0.00 0.00 0.00 0.00 23.12 20.42 1spb s ALA 29 CO -0.10 -0.42 0.34 0.08 0.00 0.00 0.00 175.76 175.67 1spb s VAL 30 N 1.56 5.14 -0.66 0.00 1.01 0.45 -1.13 120.40 126.77 1spb s VAL 30 Ca 0.16 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 61.02 1spb s VAL 30 Cb -0.15 -3.99 0.13 0.00 0.00 0.00 0.00 36.38 32.36 1spb s VAL 30 CO 0.08 -0.46 0.74 -0.63 0.00 0.00 0.00 175.10 174.83 1spb s ILE 31 N 1.64 4.97 0.00 2.22 1.01 -0.51 -0.38 121.20 130.15 1spb s ILE 31 Ca 0.04 -1.34 0.00 0.00 0.00 0.00 0.00 60.65 59.35 1spb s ILE 31 Cb -0.22 -4.50 0.00 0.00 0.01 0.00 0.00 42.46 37.75 1spb s ILE 31 CO 0.07 -1.13 0.00 -3.20 0.00 0.00 0.00 174.94 170.69 1spb n ASN 32 N 5.88 0.00 -0.59 3.58 2.85 -0.71 -4.12 115.26 122.16 1spb n ASN 32 Ca -0.03 0.00 0.06 0.00 -0.11 0.00 0.00 54.58 54.50 1spb n ASN 32 Cb 0.44 0.00 0.17 0.00 1.24 0.00 0.00 39.78 41.62 1spb n ASN 32 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1spb n SER 33 N 0.00 1.72 0.00 1.20 3.41 -1.26 0.33 113.62 119.03 1spb n SER 33 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 1spb n SER 33 Cb 0.00 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1spb n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1spb n GLY 34 N 1.03 0.34 3.02 5.00 0.00 -1.26 -4.32 105.19 109.00 1spb n GLY 34 Ca 0.11 -1.97 -0.24 0.00 0.00 0.00 0.00 46.02 43.92 1spb n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1spb s ILE 35 N -1.38 1.11 -0.23 -0.61 1.01 0.56 -2.61 121.20 119.04 1spb s ILE 35 Ca 0.00 -0.48 -0.29 0.00 0.00 0.00 0.00 60.65 59.88 1spb s ILE 35 Cb 0.00 -1.02 -0.02 0.00 0.01 0.00 0.00 42.46 41.43 1spb s ILE 35 CO 0.00 0.35 1.56 -0.62 0.00 0.00 0.00 174.94 176.23 1spb s ASP 36 N 0.61 6.44 0.50 3.58 2.15 -1.25 -3.60 116.67 125.09 1spb s ASP 36 Ca -0.13 1.55 0.26 0.00 0.43 0.00 0.00 52.55 54.65 1spb s ASP 36 Cb -0.15 -2.53 1.30 0.00 -0.30 0.00 0.00 42.92 41.24 1spb s ASP 36 CO 0.03 -1.22 2.01 0.77 -0.17 0.00 0.00 175.17 176.59 1spb h SER 37 N 10.45 0.00 0.66 -0.34 4.64 -1.71 -3.09 113.55 124.17 1spb h SER 37 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1spb h SER 37 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1spb h SER 37 CO 1.01 0.15 0.00 0.77 -0.87 0.00 0.00 176.83 177.89 1spb h SER 38 N 0.00 0.00 -3.09 4.97 4.64 -1.91 -3.45 113.55 114.72 1spb h SER 38 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1spb h SER 38 Cb 0.44 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.48 1spb h SER 38 CO 0.02 0.00 1.04 -2.28 -0.87 0.00 0.00 176.83 174.74 1spb s HIS 39 N -3.82 2.46 -1.41 4.77 2.46 -1.17 -4.62 115.29 113.96 1spb s HIS 39 Ca -0.01 0.74 0.12 0.00 0.47 0.00 0.00 55.06 56.39 1spb s HIS 39 Cb 0.10 -4.04 0.61 0.00 -0.13 0.00 0.00 32.58 29.12 1spb s HIS 39 CO 0.49 -2.07 1.30 -0.35 -2.47 0.00 0.00 174.74 171.64 1spb n PRO 40 N 7.62 0.17 0.00 2.88 -0.04 -1.26 -3.39 135.00 140.97 1spb n PRO 40 Ca 0.16 0.18 0.07 0.00 -0.04 0.00 0.00 63.50 63.86 1spb n PRO 40 Cb 0.47 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.47 1spb n PRO 40 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1spb n ASP 41 N -1.29 1.90 -4.00 3.54 8.00 -1.26 -4.92 116.55 118.52 1spb n ASP 41 Ca 0.06 -1.45 -0.31 0.00 0.71 0.00 0.00 54.79 53.80 1spb n ASP 41 Cb 0.10 0.14 -0.15 0.00 -0.02 0.00 0.00 41.12 41.19 1spb n ASP 41 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1spb s LEU 42 N -1.33 2.82 -0.41 0.64 1.43 -1.22 -5.06 118.68 115.55 1spb s LEU 42 Ca 0.14 -1.19 -0.15 0.00 -1.03 0.00 0.00 54.13 51.90 1spb s LEU 42 Cb 0.11 -1.32 0.02 0.00 0.03 0.00 0.00 46.19 45.03 1spb s LEU 42 CO 0.22 -0.20 0.30 0.20 0.23 0.00 0.00 176.35 177.10 1spb s ASN 43 N 1.29 6.11 -0.22 2.29 0.02 -1.26 -4.89 114.94 118.28 1spb s ASN 43 Ca -0.06 -0.90 -0.11 0.00 -1.02 0.00 0.00 52.86 50.77 1spb s ASN 43 Cb -0.19 -2.16 -0.05 0.00 0.02 0.00 0.00 41.25 38.87 1spb s ASN 43 CO -0.06 -0.45 0.20 -0.69 0.02 0.00 0.00 177.10 176.11 1spb s VAL 44 N 1.68 5.35 -0.50 1.60 1.01 -1.26 -4.25 120.40 124.03 1spb s VAL 44 Ca 0.05 0.29 0.24 0.00 0.00 0.00 0.00 61.98 62.55 1spb s VAL 44 Cb -0.19 -3.54 0.27 0.00 0.00 0.00 0.00 36.38 32.93 1spb s VAL 44 CO 0.10 0.36 1.57 0.00 0.00 0.00 0.00 175.10 177.13 1spb h ALA 45 N 7.23 0.92 0.00 5.51 0.00 0.66 -3.49 119.26 130.09 1spb h ALA 45 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1spb h ALA 45 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1spb h ALA 45 CO 0.70 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.36 1spb n GLY 46 N 1.17 -0.48 0.00 0.00 0.00 -1.21 -4.99 105.19 99.68 1spb n GLY 46 Ca 0.04 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1spb n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1spb n GLY 47 N 0.00 -2.20 3.31 -0.02 0.00 -1.26 0.06 105.19 105.08 1spb n GLY 47 Ca 0.00 -1.38 -0.14 0.00 0.00 0.00 0.00 46.02 44.50 1spb n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1spb s ALA 48 N -1.69 -1.02 -0.08 4.61 0.00 -0.18 -4.96 121.76 118.43 1spb s ALA 48 Ca 0.00 0.80 -0.00 0.00 0.00 0.00 0.00 51.96 52.76 1spb s ALA 48 Cb 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1spb s ALA 48 CO 0.00 -0.25 -0.06 0.45 0.00 0.00 0.00 175.76 175.90 1spb s SER 49 N -0.69 4.73 -0.03 0.00 0.15 -1.26 0.13 113.70 116.73 1spb s SER 49 Ca -0.08 -0.02 0.06 0.00 0.70 0.00 0.00 55.95 56.61 1spb s SER 49 Cb -0.04 -1.31 0.11 0.00 -1.71 0.00 0.00 66.02 63.08 1spb s SER 49 CO 0.04 0.33 1.08 0.49 1.20 0.00 0.00 173.24 176.37 1spb n PHE 50 N 2.43 0.09 -3.56 3.44 3.72 0.26 -4.94 117.46 118.90 1spb n PHE 50 Ca -0.18 -0.62 -0.40 0.00 -0.05 0.00 0.00 57.45 56.20 1spb n PHE 50 Cb 0.53 -0.08 -0.11 0.00 -0.94 0.00 0.00 39.48 38.88 1spb n PHE 50 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1spb s VAL 51 N -1.46 5.03 0.44 -4.37 1.01 -1.20 -4.74 120.40 115.12 1spb s VAL 51 Ca 0.11 -0.38 0.20 0.00 0.00 0.00 0.00 61.98 61.91 1spb s VAL 51 Cb 0.08 -3.62 0.40 0.00 0.00 0.00 0.00 36.38 33.24 1spb s VAL 51 CO 0.03 -0.04 1.86 -0.65 0.00 0.00 0.00 175.10 176.30 1spb h PRO 52 N 8.46 0.32 0.00 2.72 0.11 -1.95 -2.16 132.00 139.51 1spb h PRO 52 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1spb h PRO 52 Cb 1.15 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1spb h PRO 52 CO 0.64 0.21 -1.03 -1.13 -0.21 0.00 0.00 178.00 176.49 1spb n SER 53 N -4.47 0.63 -3.84 -2.05 3.41 -1.26 -4.68 113.62 101.36 1spb n SER 53 Ca 0.19 -0.02 -0.30 0.00 -0.26 0.00 0.00 58.87 58.48 1spb n SER 53 Cb 0.73 0.70 -0.14 0.00 -0.26 0.00 0.00 64.21 65.25 1spb n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1spb s GLU 54 N -3.25 1.40 0.34 4.33 2.02 -0.81 -4.99 118.70 117.74 1spb s GLU 54 Ca 0.02 -1.98 0.19 0.00 0.02 0.00 0.00 54.97 53.23 1spb s GLU 54 Cb 0.13 -2.70 0.18 0.00 0.10 0.00 0.00 34.13 31.84 1spb s GLU 54 CO 0.79 -1.07 1.48 1.79 0.02 0.00 0.00 175.26 178.27 1spb h THR 55 N 5.80 0.42 -3.63 3.63 1.35 -1.84 -3.37 112.91 115.28 1spb h THR 55 Ca -0.06 -1.60 -0.67 0.00 -0.55 0.00 0.00 66.41 63.53 1spb h THR 55 Cb 0.95 2.18 -0.18 0.00 -1.73 0.00 0.00 68.15 69.37 1spb h THR 55 CO 0.54 0.24 -0.27 0.21 -0.25 0.00 0.00 175.52 175.99 1spb s ASN 56 N -6.28 6.18 0.66 5.36 2.47 -1.26 -4.40 114.94 117.68 1spb s ASN 56 Ca 0.05 -0.36 0.41 0.00 0.42 0.00 0.00 52.86 53.37 1spb s ASN 56 Cb 0.06 -2.20 2.24 0.00 -1.45 0.00 0.00 41.25 39.90 1spb s ASN 56 CO 0.72 -0.41 2.28 1.55 -3.72 0.00 0.00 177.10 177.52 1spb h PRO 57 N 8.54 0.00 -0.01 0.43 0.13 -1.85 -3.00 132.00 136.24 1spb h PRO 57 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1spb h PRO 57 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1spb h PRO 57 CO 0.72 0.00 -0.16 1.19 -0.23 0.00 0.00 178.00 179.52 1spb n PHE 58 N -3.11 0.00 -3.99 1.56 3.72 -1.25 -0.32 117.46 114.07 1spb n PHE 58 Ca -0.03 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.02 1spb n PHE 58 Cb 0.14 -0.11 -0.14 0.00 -0.94 0.00 0.00 39.48 38.43 1spb n PHE 58 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1spb s GLN 59 N -2.37 3.44 -0.28 -1.08 0.74 -1.13 -1.70 119.66 117.27 1spb s GLN 59 Ca 0.29 -0.60 -0.00 0.00 0.05 0.00 0.00 55.36 55.09 1spb s GLN 59 Cb 0.20 -3.01 0.05 0.00 1.10 0.00 0.00 33.01 31.34 1spb s GLN 59 CO 0.47 -0.13 -0.04 0.34 -0.55 0.00 0.00 175.29 175.37 1spb s ASP 60 N 1.32 4.67 0.05 6.67 2.15 -1.26 -4.49 116.67 125.78 1spb s ASP 60 Ca 0.04 -1.24 0.25 0.00 0.43 0.00 0.00 52.55 52.03 1spb s ASP 60 Cb -0.14 -1.66 0.46 0.00 -0.30 0.00 0.00 42.92 41.28 1spb s ASP 60 CO -0.01 -0.22 1.39 0.59 -0.17 0.00 0.00 175.17 176.74 1spb n ASN 61 N 4.58 0.55 -0.04 -0.34 3.02 -1.26 -4.29 115.26 117.48 1spb n ASN 61 Ca -0.14 -0.07 -0.02 0.00 -0.03 0.00 0.00 54.58 54.32 1spb n ASN 61 Cb 0.44 0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.81 1spb n ASN 61 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1spb h ASN 62 N 0.00 0.00 0.00 6.41 -0.73 -1.81 -3.46 115.58 115.99 1spb h ASN 62 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1spb h ASN 62 Cb 0.60 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.19 1spb h ASN 62 CO 0.00 0.37 0.00 -1.54 -0.37 0.00 0.00 177.43 175.89 1spb n SER 63 N -3.60 0.00 -0.13 1.15 3.41 -1.26 -5.02 113.62 108.17 1spb n SER 63 Ca -0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.55 1spb n SER 63 Cb 0.09 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.08 1spb n SER 63 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1spb h HIS 64 N 0.00 0.05 -0.14 7.33 3.86 -1.95 -2.81 115.15 121.49 1spb h HIS 64 Ca 0.00 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.17 1spb h HIS 64 Cb 0.00 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1spb h HIS 64 CO 0.00 -0.05 -0.22 0.78 0.86 0.00 0.00 177.93 179.31 1spb h GLY 65 N 0.16 0.26 0.89 2.45 0.00 -1.90 -0.23 103.07 104.71 1spb h GLY 65 Ca 0.21 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 1spb h GLY 65 CO -0.32 0.17 -0.05 -0.84 0.00 0.00 0.00 176.54 175.50 1spb h THR 66 N 0.22 1.27 -0.07 4.70 2.02 -1.40 -2.30 112.91 117.35 1spb h THR 66 Ca 0.04 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1spb h THR 66 Cb 0.52 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1spb h THR 66 CO 0.04 0.34 0.01 -0.74 0.37 0.00 0.00 175.52 175.54 1spb h HIS 67 N 0.35 0.13 0.20 3.16 6.17 -0.91 -2.24 115.15 122.02 1spb h HIS 67 Ca 0.08 -0.02 0.01 0.00 0.71 0.00 0.00 60.37 61.15 1spb h HIS 67 Cb 0.52 -0.04 -0.02 0.00 2.52 0.00 0.00 27.41 30.39 1spb h HIS 67 CO 0.05 0.34 -0.23 0.28 0.71 0.00 0.00 177.93 179.08 1spb h VAL 68 N -0.12 0.51 -0.78 5.26 2.07 -1.10 -2.64 116.25 119.46 1spb h VAL 68 Ca 0.02 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.68 1spb h VAL 68 Cb 0.28 0.51 -0.09 0.00 -1.52 0.00 0.00 31.29 30.46 1spb h VAL 68 CO 0.00 0.00 0.35 0.00 0.02 0.00 0.00 177.57 177.95 1spb h ALA 69 N 0.24 1.11 -0.12 1.67 0.00 -1.44 -1.95 119.26 118.78 1spb h ALA 69 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1spb h ALA 69 Cb 0.45 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1spb h ALA 69 CO -0.07 -0.14 -0.35 0.78 0.00 0.00 0.00 179.25 179.47 1spb h GLY 70 N 0.53 0.27 0.90 0.00 0.00 -1.20 -2.23 103.07 101.34 1spb h GLY 70 Ca 0.42 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.45 1spb h GLY 70 CO -0.36 0.21 -0.03 -0.84 0.00 0.00 0.00 176.54 175.51 1spb h THR 71 N 0.22 1.27 0.08 4.70 2.02 -1.01 -1.47 112.91 118.71 1spb h THR 71 Ca 0.03 -1.03 0.02 0.00 0.77 0.00 0.00 66.41 66.20 1spb h THR 71 Cb 0.72 1.30 -0.04 0.00 -1.74 0.00 0.00 68.15 68.39 1spb h THR 71 CO 0.05 0.34 -0.32 0.58 0.37 0.00 0.00 175.52 176.54 1spb h VAL 72 N 0.37 0.31 0.00 3.16 2.07 -1.21 -2.91 116.25 118.04 1spb h VAL 72 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1spb h VAL 72 Cb 0.50 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1spb h VAL 72 CO 0.02 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.86 1spb h LEU 73 N -0.52 0.00 -0.15 2.57 5.85 -1.38 0.19 115.31 121.86 1spb h LEU 73 Ca 0.04 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.61 1spb h LEU 73 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1spb h LEU 73 CO -0.22 0.00 -0.50 0.00 -0.34 0.00 0.00 178.44 177.39 1spb h ALA 74 N 2.04 0.26 0.42 1.25 0.00 -1.19 -0.74 119.26 121.31 1spb h ALA 74 Ca 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 1spb h ALA 74 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1spb h ALA 74 CO 0.00 0.44 -0.20 0.28 0.00 0.00 0.00 179.25 179.77 1spb h VAL 84 N 0.26 0.00 -3.18 0.00 2.07 -1.42 -3.41 116.25 110.57 1spb h VAL 84 Ca -0.02 -0.12 -0.65 0.00 0.82 0.00 0.00 66.70 66.73 1spb h VAL 84 Cb 1.12 0.00 -0.40 0.00 -1.52 0.00 0.00 31.29 30.49 1spb h VAL 84 CO 0.11 0.00 -0.42 0.00 0.02 0.00 0.00 177.57 177.27 1spb s ALA 85 N -4.17 3.93 0.53 1.67 0.00 0.64 -4.91 121.76 119.45 1spb s ALA 85 Ca -0.08 -3.81 0.19 0.00 0.00 0.00 0.00 51.96 48.26 1spb s ALA 85 Cb 0.01 -2.38 1.36 0.00 0.00 0.00 0.00 23.12 22.10 1spb s ALA 85 CO 0.25 -2.11 2.14 -1.00 0.00 0.00 0.00 175.76 175.04 1spb h PRO 86 N 5.67 0.00 -0.01 0.00 0.14 -0.90 -2.32 132.00 134.57 1spb h PRO 86 Ca 0.14 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.28 1spb h PRO 86 Cb 0.78 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.92 1spb h PRO 86 CO 0.76 0.00 -0.11 0.43 0.14 0.00 0.00 178.00 179.22 1spb n SER 87 N -4.43 1.57 -4.77 1.44 7.64 -0.45 -4.97 113.62 109.65 1spb n SER 87 Ca -0.01 -1.37 -0.34 0.00 1.01 0.00 0.00 58.87 58.15 1spb n SER 87 Cb 0.15 0.07 0.03 0.00 -1.01 0.00 0.00 64.21 63.46 1spb n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1spb s ALA 88 N -2.19 2.57 -0.41 -0.43 0.00 -0.87 -3.75 121.76 116.69 1spb s ALA 88 Ca 0.31 0.69 -0.18 0.00 0.00 0.00 0.00 51.96 52.78 1spb s ALA 88 Cb 0.20 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.99 1spb s ALA 88 CO 0.40 -1.05 0.50 -1.12 0.00 0.00 0.00 175.76 174.50 1spb s SER 89 N -2.18 6.25 -0.02 0.00 0.01 0.28 -4.99 113.70 113.05 1spb s SER 89 Ca 0.70 -0.42 -0.17 0.00 1.31 0.00 0.00 55.95 57.38 1spb s SER 89 Cb -0.22 -2.26 -0.05 0.00 0.21 0.00 0.00 66.02 63.69 1spb s SER 89 CO 0.35 -0.60 0.46 -0.22 0.41 0.00 0.00 173.24 173.64 1spb s LEU 90 N 2.37 4.42 -0.08 2.44 2.96 -1.26 -0.60 118.68 128.93 1spb s LEU 90 Ca 0.16 0.97 0.01 0.00 -0.22 0.00 0.00 54.13 55.06 1spb s LEU 90 Cb -0.16 -2.67 0.02 0.00 0.50 0.00 0.00 46.19 43.87 1spb s LEU 90 CO 0.15 0.21 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.98 1spb s TYR 91 N -0.55 1.43 -0.50 5.38 1.51 -0.30 0.13 117.35 124.45 1spb s TYR 91 Ca 0.25 -0.58 -0.23 0.00 -1.01 0.00 0.00 57.07 55.51 1spb s TYR 91 Cb -0.17 -1.09 0.04 0.00 -0.11 0.00 0.00 41.96 40.63 1spb s TYR 91 CO 0.13 -0.34 0.82 0.00 -1.11 0.00 0.00 175.55 175.06 1spb s ALA 92 N 0.95 3.25 -0.45 3.71 0.00 0.11 -0.41 121.76 128.92 1spb s ALA 92 Ca -0.09 -1.24 -0.08 0.00 0.00 0.00 0.00 51.96 50.56 1spb s ALA 92 Cb -0.15 -3.56 0.12 0.00 0.00 0.00 0.00 23.12 19.53 1spb s ALA 92 CO 0.00 -2.14 0.31 0.08 0.00 0.00 0.00 175.76 174.02 1spb s VAL 93 N 3.45 3.97 -0.40 0.00 1.01 0.49 -1.01 120.40 127.91 1spb s VAL 93 Ca 0.27 -1.85 -0.24 0.00 0.00 0.00 0.00 61.98 60.16 1spb s VAL 93 Cb -0.14 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1spb s VAL 93 CO 0.19 -0.75 0.83 -0.75 0.00 0.00 0.00 175.10 174.63 1spb s LYS 94 N 1.31 3.68 -0.01 2.72 2.20 0.12 -1.73 119.74 128.02 1spb s LYS 94 Ca 0.06 0.27 0.03 0.00 -0.36 0.00 0.00 55.97 55.98 1spb s LYS 94 Cb -0.25 -3.85 -0.05 0.00 -1.51 0.00 0.00 37.83 32.17 1spb s LYS 94 CO -0.02 -0.98 0.06 1.33 -0.36 0.00 0.00 175.35 175.39 1spb n VAL 95 N 5.99 0.07 -4.58 4.02 0.24 0.15 0.90 118.33 125.12 1spb n VAL 95 Ca 0.04 -0.10 -0.34 0.00 -2.04 0.00 0.00 64.34 61.91 1spb n VAL 95 Cb 0.48 0.04 -0.11 0.00 -1.47 0.00 0.00 33.84 32.78 1spb n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1spb s LEU 96 N -3.54 3.20 0.00 1.34 1.43 -0.81 -4.26 118.68 116.05 1spb s LEU 96 Ca -0.01 -0.03 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 1spb s LEU 96 Cb 0.02 -1.72 0.08 0.00 0.03 0.00 0.00 46.19 44.59 1spb s LEU 96 CO 0.15 0.35 0.47 0.61 0.23 0.00 0.00 176.35 178.16 1spb n GLY 97 N 2.10 -0.56 0.49 -3.19 0.00 -0.55 -4.31 105.19 99.17 1spb n GLY 97 Ca -0.18 -1.79 0.32 0.00 0.00 0.00 0.00 46.02 44.38 1spb n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1spb h ALA 98 N -1.41 2.78 -0.00 4.61 0.00 -1.88 -1.72 119.26 121.63 1spb h ALA 98 Ca -0.15 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1spb h ALA 98 Cb 0.47 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1spb h ALA 98 CO 0.13 -1.22 -0.18 -0.40 0.00 0.00 0.00 179.25 177.58 1spb n ASP 99 N -4.43 0.66 0.00 0.00 5.75 -1.26 -3.78 116.55 113.48 1spb n ASP 99 Ca 0.29 -0.63 0.00 0.00 -0.01 0.00 0.00 54.79 54.44 1spb n ASP 99 Cb 1.21 0.01 0.00 0.00 -1.03 0.00 0.00 41.12 41.31 1spb n ASP 99 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1spb n GLY 100 N 1.32 0.41 3.33 6.12 0.00 -0.65 -5.06 105.19 110.66 1spb n GLY 100 Ca 0.13 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 1spb n GLY 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1spb s SER 101 N -2.93 3.11 0.17 1.61 1.04 -1.26 -4.88 113.70 110.56 1spb s SER 101 Ca 0.00 -0.55 -0.10 0.00 0.48 0.00 0.00 55.95 55.77 1spb s SER 101 Cb 0.00 -0.30 -0.00 0.00 0.10 0.00 0.00 66.02 65.82 1spb s SER 101 CO 0.00 0.27 0.32 -0.83 0.98 0.00 0.00 173.24 173.99 1spb s GLY 102 N -1.06 0.37 0.34 7.32 0.00 -1.26 -1.48 107.32 111.55 1spb s GLY 102 Ca 0.11 -0.77 -0.26 0.00 0.00 0.00 0.00 44.72 43.81 1spb s GLY 102 CO 0.01 -0.74 0.99 1.20 0.00 0.00 0.00 173.10 174.57 1spb s GLN 103 N -3.95 4.48 0.56 2.90 -0.21 -1.26 -4.95 119.66 117.24 1spb s GLN 103 Ca 0.15 1.44 0.27 0.00 0.02 0.00 0.00 55.36 57.25 1spb s GLN 103 Cb 0.03 -2.79 1.50 0.00 1.00 0.00 0.00 33.01 32.74 1spb s GLN 103 CO -0.01 0.16 1.99 1.88 -2.12 0.00 0.00 175.29 177.20 1spb h TYR 104 N 3.10 0.00 -0.17 0.91 -1.99 -1.99 -1.79 116.97 115.04 1spb h TYR 104 Ca -0.47 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.22 1spb h TYR 104 Cb 1.20 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.93 1spb h TYR 104 CO 0.60 0.00 -0.06 0.66 -0.00 0.00 0.00 178.16 179.36 1spb h SER 105 N 0.00 0.34 -0.94 3.88 4.64 -1.98 0.56 113.55 120.06 1spb h SER 105 Ca 0.19 -0.39 0.08 0.00 -0.47 0.00 0.00 61.79 61.21 1spb h SER 105 Cb 0.92 -0.09 -0.07 0.00 -0.31 0.00 0.00 62.40 62.84 1spb h SER 105 CO -0.00 0.65 0.59 -0.50 -0.87 0.00 0.00 176.83 176.69 1spb h TRP 106 N 0.03 1.07 -0.09 4.77 6.55 -1.76 0.24 115.95 126.77 1spb h TRP 106 Ca 0.04 0.03 -0.03 0.00 0.95 0.00 0.00 58.89 59.89 1spb h TRP 106 Cb 0.51 -0.34 -0.00 0.00 -0.86 0.00 0.00 29.16 28.46 1spb h TRP 106 CO 0.06 0.50 -0.04 0.82 -1.05 0.00 0.00 178.44 178.73 1spb h ILE 107 N 1.01 1.32 -0.07 1.49 2.04 -0.96 -1.53 117.51 120.81 1spb h ILE 107 Ca 0.43 -1.04 0.04 0.00 1.00 0.00 0.00 64.86 65.28 1spb h ILE 107 Cb 0.29 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 38.14 1spb h ILE 107 CO -0.21 0.29 -0.23 0.40 0.00 0.00 0.00 178.15 178.41 1spb h ILE 108 N -0.17 0.46 -0.56 -0.67 2.04 -0.50 -1.48 117.51 116.64 1spb h ILE 108 Ca 0.02 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.99 1spb h ILE 108 Cb 0.48 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1spb h ILE 108 CO 0.01 0.00 0.38 0.78 0.00 0.00 0.00 178.15 179.32 1spb h ASN 109 N -0.32 0.28 -0.19 1.72 2.35 -0.45 -0.91 115.58 118.06 1spb h ASN 109 Ca 0.08 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.74 1spb h ASN 109 Cb 0.44 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.75 1spb h ASN 109 CO -0.25 0.16 -0.26 1.23 -1.65 0.00 0.00 177.43 176.66 1spb h GLY 110 N 0.31 0.55 0.67 2.83 0.00 -0.34 -2.34 103.07 104.74 1spb h GLY 110 Ca 0.26 -0.60 0.04 0.00 0.00 0.00 0.00 47.33 47.03 1spb h GLY 110 CO -0.06 0.54 0.02 -2.22 0.00 0.00 0.00 176.54 174.82 1spb h ILE 111 N 0.16 0.85 -0.58 2.60 2.04 -0.58 -2.52 117.51 119.47 1spb h ILE 111 Ca 0.02 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 65.88 1spb h ILE 111 Cb 0.83 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1spb h ILE 111 CO 0.06 0.02 0.33 -0.33 0.00 0.00 0.00 178.15 178.23 1spb h GLU 112 N 0.10 0.63 -0.72 2.37 5.08 -1.24 -1.58 114.58 119.21 1spb h GLU 112 Ca 0.11 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1spb h GLU 112 Cb 0.13 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1spb h GLU 112 CO -0.17 0.42 0.26 2.35 -1.00 0.00 0.00 179.01 180.86 1spb h TRP 113 N 0.65 1.12 -0.00 4.33 7.01 -1.40 -1.58 115.95 126.06 1spb h TRP 113 Ca 0.25 -0.09 -0.08 0.00 2.11 0.00 0.00 58.89 61.08 1spb h TRP 113 Cb 0.09 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.81 1spb h TRP 113 CO -0.07 0.87 -0.36 0.00 -2.79 0.00 0.00 178.44 176.08 1spb h ALA 114 N 1.22 1.39 0.49 2.65 0.00 -1.21 0.56 119.26 124.37 1spb h ALA 114 Ca 0.24 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1spb h ALA 114 Cb 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1spb h ALA 114 CO -0.01 0.46 -0.24 0.82 0.00 0.00 0.00 179.25 180.28 1spb h ILE 115 N 0.01 0.14 -0.86 0.00 2.04 -1.14 -1.19 117.51 116.52 1spb h ILE 115 Ca -0.00 -0.53 0.16 0.00 1.00 0.00 0.00 64.86 65.49 1spb h ILE 115 Cb 0.65 0.22 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 1spb h ILE 115 CO 0.05 0.03 0.56 0.00 0.00 0.00 0.00 178.15 178.79 1spb h ALA 116 N -1.02 1.97 -0.14 1.87 0.00 -1.21 -3.03 119.26 117.70 1spb h ALA 116 Ca -0.07 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1spb h ALA 116 Cb 0.55 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1spb h ALA 116 CO 0.11 -0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.24 1spb n ASN 117 N -4.53 1.85 -3.23 0.00 3.02 0.20 -4.95 115.26 107.61 1spb n ASN 117 Ca 0.17 -1.69 -0.16 0.00 -0.03 0.00 0.00 54.58 52.87 1spb n ASN 117 Cb 0.52 -0.09 0.08 0.00 -0.61 0.00 0.00 39.78 39.69 1spb n ASN 117 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1spb n ASN 118 N 0.44 -2.53 -4.72 6.41 4.13 -1.11 -4.98 115.26 112.90 1spb n ASN 118 Ca 0.17 -0.58 -0.42 0.00 1.68 0.00 0.00 54.58 55.43 1spb n ASN 118 Cb 0.37 -4.79 -0.03 0.00 -1.54 0.00 0.00 39.78 33.79 1spb n ASN 118 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 1spb s MET 119 N -5.15 4.44 0.00 3.52 -1.94 -0.46 -4.82 119.30 114.90 1spb s MET 119 Ca 0.05 1.77 -0.08 0.00 -1.71 0.00 0.00 55.69 55.72 1spb s MET 119 Cb -0.01 -3.34 -0.30 0.00 2.01 0.00 0.00 34.83 33.19 1spb s MET 119 CO 0.68 -0.23 0.87 -0.44 -0.01 0.00 0.00 175.02 175.89 1spb h ASP 120 N 6.66 0.54 -3.57 3.03 3.32 -1.21 -3.43 116.42 121.76 1spb h ASP 120 Ca -0.42 -0.70 -0.29 0.00 0.02 0.00 0.00 57.03 55.64 1spb h ASP 120 Cb 1.21 -0.17 -0.33 0.00 0.22 0.00 0.00 39.33 40.26 1spb h ASP 120 CO 0.80 1.57 -0.73 -0.69 -1.72 0.00 0.00 179.24 178.47 1spb s VAL 121 N -2.61 -0.01 -0.09 -1.35 1.01 -0.34 -1.14 120.40 115.87 1spb s VAL 121 Ca -0.10 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1spb s VAL 121 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.33 1spb s VAL 121 CO 0.87 0.08 -0.17 -0.63 0.00 0.00 0.00 175.10 175.26 1spb s ILE 122 N 0.83 2.78 -0.13 2.22 1.01 0.03 0.64 121.20 128.59 1spb s ILE 122 Ca -0.07 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1spb s ILE 122 Cb -0.10 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.24 1spb s ILE 122 CO -0.02 0.55 -0.13 0.21 0.00 0.00 0.00 174.94 175.55 1spb s ASN 123 N -0.00 4.02 -0.40 3.58 2.47 -0.28 -0.54 114.94 123.77 1spb s ASN 123 Ca -0.05 -0.32 0.02 0.00 0.42 0.00 0.00 52.86 52.93 1spb s ASN 123 Cb -0.14 -1.58 0.12 0.00 -1.45 0.00 0.00 41.25 38.20 1spb s ASN 123 CO 0.04 0.17 0.19 -0.04 -3.72 0.00 0.00 177.10 173.74 1spb s MET 124 N 0.30 1.19 -0.51 0.43 -1.94 0.83 -1.43 119.30 118.17 1spb s MET 124 Ca -0.10 -1.78 -0.03 0.00 -1.71 0.00 0.00 55.69 52.06 1spb s MET 124 Cb -0.16 -2.37 0.11 0.00 2.01 0.00 0.00 34.83 34.42 1spb s MET 124 CO 0.06 -1.09 2.63 0.43 -0.01 0.00 0.00 175.02 177.04 1spb n SER 125 N 3.92 6.64 -3.44 3.03 7.64 -1.26 -0.90 113.62 129.26 1spb n SER 125 Ca 0.05 -3.30 -0.10 0.00 1.01 0.00 0.00 58.87 56.53 1spb n SER 125 Cb 0.37 -1.20 -0.02 0.00 -1.01 0.00 0.00 64.21 62.35 1spb n SER 125 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1spb s LEU 126 N -2.47 0.30 0.00 -3.43 0.05 -1.26 -4.71 118.68 107.15 1spb s LEU 126 Ca 0.57 -1.09 0.00 0.00 0.05 0.00 0.00 54.13 53.66 1spb s LEU 126 Cb 0.39 2.20 0.00 0.00 -2.05 0.00 0.00 46.19 46.73 1spb s LEU 126 CO -0.25 -1.39 0.00 0.61 -0.55 0.00 0.00 176.35 174.77 1spb n GLY 127 N -0.49 0.07 3.08 -3.48 0.00 -1.26 -4.28 105.19 98.84 1spb n GLY 127 Ca -0.04 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.75 1spb n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1spb s GLY 128 N 0.00 0.40 0.39 -0.02 0.00 -0.50 -4.90 107.32 102.69 1spb s GLY 128 Ca 0.00 -1.05 0.10 0.00 0.00 0.00 0.00 44.72 43.78 1spb s GLY 128 CO 0.00 -1.16 1.90 -0.56 0.00 0.00 0.00 173.10 173.28 1spb h PRO 129 N 3.40 0.17 -5.61 2.90 0.13 -1.91 -0.16 132.00 130.91 1spb h PRO 129 Ca -0.34 -0.04 -0.64 0.00 -0.87 0.00 0.00 66.00 64.11 1spb h PRO 129 Cb 1.16 -0.02 -0.08 0.00 0.13 0.00 0.00 31.00 32.18 1spb h PRO 129 CO 0.61 0.36 -0.42 -1.12 -0.23 0.00 0.00 178.00 177.20 1spb s SER 130 N -6.91 6.43 0.78 1.44 0.01 -1.26 -4.76 113.70 109.44 1spb s SER 130 Ca -0.05 0.51 -0.11 0.00 1.31 0.00 0.00 55.95 57.61 1spb s SER 130 Cb 0.15 -2.12 0.06 0.00 0.21 0.00 0.00 66.02 64.33 1spb s SER 130 CO 0.73 0.31 1.11 -0.83 0.41 0.00 0.00 173.24 174.97 1spb s GLY 131 N -0.58 1.78 -0.10 3.44 0.00 -1.26 -4.78 107.32 105.82 1spb s GLY 131 Ca 0.15 0.40 -0.04 0.00 0.00 0.00 0.00 44.72 45.23 1spb s GLY 131 CO 0.04 0.76 0.20 -0.45 0.00 0.00 0.00 173.10 173.66 1spb s SER 132 N -3.08 0.27 0.39 1.64 0.15 -1.26 -5.05 113.70 106.77 1spb s SER 132 Ca 0.64 0.43 0.09 0.00 0.70 0.00 0.00 55.95 57.81 1spb s SER 132 Cb -0.19 0.40 0.80 0.00 -1.71 0.00 0.00 66.02 65.32 1spb s SER 132 CO 0.54 -0.21 1.94 0.00 1.20 0.00 0.00 173.24 176.71 1spb h ALA 133 N 7.90 1.55 -0.04 5.45 0.00 -1.99 -2.01 119.26 130.11 1spb h ALA 133 Ca -0.25 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.39 1spb h ALA 133 Cb 1.13 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.83 1spb h ALA 133 CO 0.24 0.33 -0.38 0.00 0.00 0.00 0.00 179.25 179.44 1spb h ALA 134 N 1.66 0.10 -0.89 0.00 0.00 -1.98 -1.37 119.26 116.79 1spb h ALA 134 Ca 0.06 -0.48 0.08 0.00 0.00 0.00 0.00 54.91 54.57 1spb h ALA 134 Cb 0.28 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1spb h ALA 134 CO 0.01 0.22 0.58 1.25 0.00 0.00 0.00 179.25 181.30 1spb h LEU 135 N -0.20 0.85 -0.14 0.00 5.85 -1.89 -0.58 115.31 119.19 1spb h LEU 135 Ca -0.04 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1spb h LEU 135 Cb 1.07 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1spb h LEU 135 CO 0.08 0.52 0.02 0.50 -0.34 0.00 0.00 178.44 179.22 1spb h LYS 136 N 0.95 0.24 -0.88 1.25 3.64 -1.35 -1.98 116.57 118.44 1spb h LYS 136 Ca 0.40 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.74 1spb h LYS 136 Cb 0.30 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 1spb h LYS 136 CO -0.16 0.44 0.58 0.00 -2.27 0.00 0.00 179.45 178.04 1spb h ALA 137 N 0.80 1.43 -0.09 5.00 0.00 -0.23 -0.89 119.26 125.28 1spb h ALA 137 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1spb h ALA 137 Cb 0.31 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1spb h ALA 137 CO 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 179.25 179.64 1spb h ALA 138 N 1.48 0.13 -0.61 0.00 0.00 -0.86 -2.03 119.26 117.36 1spb h ALA 138 Ca 0.35 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1spb h ALA 138 Cb -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1spb h ALA 138 CO -0.10 -0.03 0.06 -0.39 0.00 0.00 0.00 179.25 178.79 1spb h VAL 139 N -0.20 1.26 -0.74 0.00 -1.51 -1.31 -2.33 116.25 111.41 1spb h VAL 139 Ca 0.01 -1.05 -0.05 0.00 -1.23 0.00 0.00 66.70 64.38 1spb h VAL 139 Cb 0.62 0.72 -0.03 0.00 -2.13 0.00 0.00 31.29 30.47 1spb h VAL 139 CO 0.02 0.39 0.26 0.44 -1.23 0.00 0.00 177.57 177.45 1spb h ASP 140 N 0.96 1.06 -0.31 4.19 3.32 -1.15 -1.61 116.42 122.88 1spb h ASP 140 Ca 0.18 -0.19 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 1spb h ASP 140 Cb 0.47 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1spb h ASP 140 CO 0.02 0.97 -0.44 0.50 -1.72 0.00 0.00 179.24 178.56 1spb h LYS 141 N 1.09 0.84 -0.48 3.56 1.63 -1.38 0.94 116.57 122.77 1spb h LYS 141 Ca 0.24 -0.50 -0.04 0.00 -0.85 0.00 0.00 60.65 59.51 1spb h LYS 141 Cb 0.26 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 1spb h LYS 141 CO -0.01 1.13 0.12 0.00 -3.45 0.00 0.00 179.45 177.24 1spb h ALA 142 N 0.70 1.31 0.49 5.00 0.00 -0.74 0.25 119.26 126.28 1spb h ALA 142 Ca 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1spb h ALA 142 Cb 1.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1spb h ALA 142 CO 0.10 0.49 -0.23 0.28 0.00 0.00 0.00 179.25 179.89 1spb h VAL 143 N 0.71 0.16 -0.31 0.00 2.07 -1.40 -1.25 116.25 116.22 1spb h VAL 143 Ca 0.16 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.24 1spb h VAL 143 Cb 0.25 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1spb h VAL 143 CO -0.00 0.03 0.30 0.00 0.02 0.00 0.00 177.57 177.92 1spb h ALA 144 N -1.00 2.04 0.00 1.67 0.00 -0.55 0.30 119.26 121.73 1spb h ALA 144 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1spb h ALA 144 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1spb h ALA 144 CO 0.11 -0.46 0.00 0.45 0.00 0.00 0.00 179.25 179.35 1spb n SER 145 N -3.92 0.00 0.00 0.00 2.88 0.87 -4.93 113.62 108.52 1spb n SER 145 Ca 0.05 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1spb n SER 145 Cb 0.46 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1spb n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1spb n GLY 146 N 1.34 0.71 3.78 0.46 0.00 0.11 -5.05 105.19 106.53 1spb n GLY 146 Ca 0.07 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 1spb n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1spb s VAL 147 N -2.00 4.65 -0.28 1.61 1.01 -0.51 -4.19 120.40 120.69 1spb s VAL 147 Ca 0.00 1.47 -0.25 0.00 0.00 0.00 0.00 61.98 63.19 1spb s VAL 147 Cb 0.00 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1spb s VAL 147 CO 0.00 0.48 0.87 -0.69 0.00 0.00 0.00 175.10 175.76 1spb s VAL 148 N -0.74 4.75 -0.24 2.92 1.01 -0.29 -4.01 120.40 123.80 1spb s VAL 148 Ca 0.33 1.50 -0.06 0.00 0.00 0.00 0.00 61.98 63.75 1spb s VAL 148 Cb -0.21 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 1spb s VAL 148 CO 0.22 -0.21 0.04 -0.69 0.00 0.00 0.00 175.10 174.46 1spb s VAL 149 N 3.05 4.05 -0.07 2.92 1.01 -1.26 -0.79 120.40 129.32 1spb s VAL 149 Ca 0.36 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.13 1spb s VAL 149 Cb -0.14 -2.89 -0.00 0.00 0.00 0.00 0.00 36.38 33.35 1spb s VAL 149 CO 0.10 0.36 -0.21 -0.69 0.00 0.00 0.00 175.10 174.66 1spb s VAL 150 N 1.58 1.79 -0.01 2.92 1.01 0.29 -0.66 120.40 127.32 1spb s VAL 150 Ca 0.06 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 1spb s VAL 150 Cb -0.15 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.69 1spb s VAL 150 CO 0.02 0.50 0.08 0.00 0.00 0.00 0.00 175.10 175.70 1spb s ALA 151 N 0.13 -0.18 0.26 5.51 0.00 0.13 -0.12 121.76 127.48 1spb s ALA 151 Ca -0.09 -0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.45 1spb s ALA 151 Cb -0.15 0.03 -0.10 0.00 0.00 0.00 0.00 23.12 22.91 1spb s ALA 151 CO 0.05 -0.14 1.39 0.00 0.00 0.00 0.00 175.76 177.06 1spb s ALA 152 N -0.94 3.58 -0.39 0.00 0.00 -0.08 -1.07 121.76 122.87 1spb s ALA 152 Ca -0.10 1.28 0.27 0.00 0.00 0.00 0.00 51.96 53.40 1spb s ALA 152 Cb -0.06 -3.53 0.86 0.00 0.00 0.00 0.00 23.12 20.39 1spb s ALA 152 CO 0.00 -0.69 1.77 0.00 0.00 0.00 0.00 175.76 176.85 1spb h ALA 153 N 4.79 1.00 0.00 0.00 0.00 -1.56 -3.39 119.26 120.10 1spb h ALA 153 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1spb h ALA 153 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1spb h ALA 153 CO 0.75 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.41 1spb n GLY 154 N 0.65 2.88 2.21 0.00 0.00 -1.26 -1.07 105.19 108.60 1spb n GLY 154 Ca 0.03 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.85 1spb n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1spb n ASN 155 N 0.00 6.46 -1.04 1.61 3.02 -1.25 -1.13 115.26 122.93 1spb n ASN 155 Ca 0.00 -3.77 0.11 0.00 -0.03 0.00 0.00 54.58 50.89 1spb n ASN 155 Cb 0.00 -0.70 0.16 0.00 -0.61 0.00 0.00 39.78 38.64 1spb n ASN 155 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1spb n GLU 156 N -0.82 2.35 0.00 3.52 4.71 -0.61 -4.69 120.64 125.10 1spb n GLU 156 Ca 0.54 -2.10 0.00 0.00 -0.01 0.00 0.00 57.16 55.60 1spb n GLU 156 Cb 0.79 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.74 1spb n GLU 156 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1spb n GLY 157 N 1.38 1.76 3.56 0.62 0.00 -0.80 -4.67 105.19 107.04 1spb n GLY 157 Ca 0.17 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 1spb n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1spb s THR 158 N 0.00 4.27 -0.49 2.61 -4.23 -1.26 -3.41 115.64 113.12 1spb s THR 158 Ca 0.00 -0.22 0.08 0.00 -1.18 0.00 0.00 61.69 60.37 1spb s THR 158 Cb 0.00 -2.89 0.32 0.00 1.34 0.00 0.00 72.50 71.27 1spb s THR 158 CO 0.00 0.49 0.80 -0.24 -0.54 0.00 0.00 174.62 175.12 1spb n SER 159 N 3.47 2.62 0.00 3.99 2.88 -1.26 -5.08 113.62 120.24 1spb n SER 159 Ca -0.17 -3.30 0.00 0.00 -1.33 0.00 0.00 58.87 54.07 1spb n SER 159 Cb 0.52 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 1spb n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1spb n GLY 160 N 0.28 2.33 0.03 0.46 0.00 -1.26 -2.62 105.19 104.40 1spb n GLY 160 Ca 0.28 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1spb n GLY 160 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1spb n SER 161 N 9.87 0.83 -4.82 1.61 3.41 -1.26 -4.99 113.62 118.27 1spb n SER 161 Ca 0.00 -0.70 -0.33 0.00 -0.26 0.00 0.00 58.87 57.58 1spb n SER 161 Cb 0.00 0.64 -0.07 0.00 -0.26 0.00 0.00 64.21 64.52 1spb n SER 161 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1spb s SER 162 N -2.97 6.93 0.03 4.04 1.04 -1.08 -5.04 113.70 116.66 1spb s SER 162 Ca 0.10 1.67 -0.30 0.00 0.48 0.00 0.00 55.95 57.90 1spb s SER 162 Cb 0.17 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.72 1spb s SER 162 CO 0.78 -0.35 1.00 -0.55 0.98 0.00 0.00 173.24 175.09 1spb s SER 163 N -2.18 7.37 0.00 7.02 0.15 -1.26 -4.44 113.70 120.35 1spb s SER 163 Ca 0.62 1.72 0.17 0.00 0.70 0.00 0.00 55.95 59.16 1spb s SER 163 Cb -0.09 -2.57 0.23 0.00 -1.71 0.00 0.00 66.02 61.88 1spb s SER 163 CO 0.13 -0.24 1.15 0.35 1.20 0.00 0.00 173.24 175.83 1spb n THR 164 N 3.69 0.28 -1.74 6.45 -2.24 -0.82 -4.99 114.28 114.91 1spb n THR 164 Ca 0.06 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.77 1spb n THR 164 Cb 0.50 1.12 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 1spb n THR 164 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1spb s VAL 165 N -1.33 2.92 0.80 2.28 1.01 -1.25 -4.50 120.40 120.34 1spb s VAL 165 Ca 0.25 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 1spb s VAL 165 Cb 0.16 -3.09 0.11 0.00 0.00 0.00 0.00 36.38 33.56 1spb s VAL 165 CO 0.23 -0.01 1.14 -0.83 0.00 0.00 0.00 175.10 175.63 1spb s GLY 166 N 3.63 1.69 -0.13 4.51 0.00 -0.23 -4.72 107.32 112.07 1spb s GLY 166 Ca 0.83 -1.01 -0.07 0.00 0.00 0.00 0.00 44.72 44.48 1spb s GLY 166 CO 0.38 -0.46 0.11 -0.19 0.00 0.00 0.00 173.10 172.93 1spb s TYR 167 N -3.50 3.47 -0.98 1.90 2.02 -0.07 -0.05 117.35 120.13 1spb s TYR 167 Ca 0.65 0.41 0.19 0.00 -0.37 0.00 0.00 57.07 57.95 1spb s TYR 167 Cb -0.08 -1.95 0.81 0.00 -0.40 0.00 0.00 41.96 40.33 1spb s TYR 167 CO 0.48 0.59 1.61 -0.35 -1.57 0.00 0.00 175.55 176.30 1spb n PRO 168 N 2.34 0.01 0.28 -1.71 -0.04 -1.26 -1.42 135.00 133.20 1spb n PRO 168 Ca -0.19 0.18 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 1spb n PRO 168 Cb 0.54 -1.51 0.81 0.00 -0.04 0.00 0.00 33.50 33.30 1spb n PRO 168 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1spb h GLY 169 N 3.23 0.00 2.00 0.55 0.00 -1.58 -2.36 103.07 104.91 1spb h GLY 169 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1spb h GLY 169 CO 0.00 0.00 -0.03 1.70 0.00 0.00 0.00 176.54 178.21 1spb h LYS 170 N 0.00 0.00 -6.72 4.80 3.64 -0.75 -3.36 116.57 114.17 1spb h LYS 170 Ca -0.00 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.86 1spb h LYS 170 Cb 0.23 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1spb h LYS 170 CO 0.01 0.03 0.52 0.71 -2.27 0.00 0.00 179.45 178.45 1spb s TYR 171 N -3.88 3.48 0.56 1.91 2.02 -0.89 -4.91 117.35 115.65 1spb s TYR 171 Ca -0.01 1.54 0.27 0.00 -0.37 0.00 0.00 57.07 58.50 1spb s TYR 171 Cb 0.11 -3.37 1.49 0.00 -0.40 0.00 0.00 41.96 39.79 1spb s TYR 171 CO 0.52 -0.93 2.01 -1.35 -1.57 0.00 0.00 175.55 174.23 1spb h PRO 172 N 4.63 0.00 0.00 -1.71 0.11 -1.89 -2.72 132.00 130.42 1spb h PRO 172 Ca -0.45 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 1spb h PRO 172 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1spb h PRO 172 CO 0.71 0.00 -0.34 0.66 -0.21 0.00 0.00 178.00 178.82 1spb h SER 173 N 0.00 0.00 -3.08 -2.05 4.64 -1.93 -3.46 113.55 107.67 1spb h SER 173 Ca 0.18 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.91 1spb h SER 173 Cb 0.84 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.90 1spb h SER 173 CO -0.00 0.34 -0.37 -0.69 -0.87 0.00 0.00 176.83 175.24 1spb s VAL 174 N -3.24 5.24 -0.49 0.95 1.01 -1.03 -4.72 120.40 118.13 1spb s VAL 174 Ca 0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.72 1spb s VAL 174 Cb 0.08 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.89 1spb s VAL 174 CO 0.70 0.08 0.57 -0.63 0.00 0.00 0.00 175.10 175.81 1spb s ILE 175 N -1.61 4.95 -0.25 2.22 1.01 0.17 -4.83 121.20 122.86 1spb s ILE 175 Ca 0.39 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 60.33 1spb s ILE 175 Cb -0.12 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 1spb s ILE 175 CO 0.26 -0.71 0.53 0.00 0.00 0.00 0.00 174.94 175.01 1spb s ALA 176 N 2.43 3.59 -0.27 9.38 0.00 -1.25 0.18 121.76 135.81 1spb s ALA 176 Ca 0.13 -0.55 -0.02 0.00 0.00 0.00 0.00 51.96 51.53 1spb s ALA 176 Cb -0.19 -2.89 0.03 0.00 0.00 0.00 0.00 23.12 20.07 1spb s ALA 176 CO 0.12 -0.69 -0.03 0.08 0.00 0.00 0.00 175.76 175.23 1spb s VAL 177 N 2.21 3.00 0.61 0.00 1.01 -0.23 -0.67 120.40 126.33 1spb s VAL 177 Ca 0.22 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1spb s VAL 177 Cb -0.16 -2.58 0.04 0.00 0.00 0.00 0.00 36.38 33.68 1spb s VAL 177 CO 0.09 0.11 0.89 -0.83 0.00 0.00 0.00 175.10 175.36 1spb s GLY 178 N 1.32 1.72 -0.19 4.51 0.00 -0.45 -1.58 107.32 112.65 1spb s GLY 178 Ca -0.01 -1.04 -0.06 0.00 0.00 0.00 0.00 44.72 43.61 1spb s GLY 178 CO -0.03 -0.72 0.03 0.00 0.00 0.00 0.00 173.10 172.38 1spb s ALA 179 N -2.98 3.19 0.03 3.20 0.00 -1.26 -2.67 121.76 121.26 1spb s ALA 179 Ca 0.57 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.65 1spb s ALA 179 Cb -0.10 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 1spb s ALA 179 CO 0.42 0.00 0.16 0.14 0.00 0.00 0.00 175.76 176.49 1spb s VAL 180 N 0.71 5.19 0.09 0.00 -7.23 -0.97 -0.34 120.40 117.85 1spb s VAL 180 Ca 0.01 -0.36 -0.01 0.00 -1.81 0.00 0.00 61.98 59.82 1spb s VAL 180 Cb -0.14 -3.46 0.02 0.00 0.56 0.00 0.00 36.38 33.36 1spb s VAL 180 CO 0.02 0.24 0.12 -0.90 -0.31 0.00 0.00 175.10 174.27 1spb n ASP 181 N 0.70 0.10 0.28 4.85 5.68 0.10 -1.68 116.55 126.58 1spb n ASP 181 Ca -0.09 -1.10 0.12 0.00 -0.50 0.00 0.00 54.79 53.22 1spb n ASP 181 Cb 0.52 -0.08 0.78 0.00 -1.14 0.00 0.00 41.12 41.20 1spb n ASP 181 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1spb h SER 182 N -0.11 0.00 -0.48 -1.12 4.64 -1.88 -2.35 113.55 112.25 1spb h SER 182 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1spb h SER 182 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1spb h SER 182 CO 0.04 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 174.48 1spb n SER 183 N -4.11 3.78 0.00 4.97 3.41 -1.26 -4.93 113.62 115.48 1spb n SER 183 Ca -0.03 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.21 1spb n SER 183 Cb 0.11 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.54 1spb n SER 183 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1spb n ASN 184 N 0.75 -3.99 -4.73 4.04 3.02 -0.89 -4.99 115.26 108.47 1spb n ASN 184 Ca 0.19 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.33 1spb n ASN 184 Cb 0.73 -2.43 -0.04 0.00 -0.61 0.00 0.00 39.78 37.42 1spb n ASN 184 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1spb s GLN 185 N -1.26 4.61 0.13 3.52 2.00 -1.26 -4.76 119.66 122.65 1spb s GLN 185 Ca 0.00 1.33 -0.31 0.00 -2.00 0.00 0.00 55.36 54.38 1spb s GLN 185 Cb 0.00 -3.39 -0.10 0.00 0.80 0.00 0.00 33.01 30.31 1spb s GLN 185 CO 0.00 0.17 1.76 0.50 -0.50 0.00 0.00 175.29 177.22 1spb s ARG 186 N 0.24 4.15 0.19 1.67 3.52 -1.26 0.03 118.95 127.49 1spb s ARG 186 Ca 0.46 2.54 -0.32 0.00 -0.13 0.00 0.00 55.73 58.28 1spb s ARG 186 Cb -0.22 -3.48 -0.11 0.00 -1.56 0.00 0.00 34.95 29.58 1spb s ARG 186 CO 0.27 -0.79 1.65 0.00 -0.81 0.00 0.00 175.30 175.62 1spb s ALA 187 N 2.35 3.86 0.54 6.12 0.00 0.53 -4.84 121.76 130.33 1spb s ALA 187 Ca 0.78 1.49 0.32 0.00 0.00 0.00 0.00 51.96 54.56 1spb s ALA 187 Cb -0.45 -3.66 1.49 0.00 0.00 0.00 0.00 23.12 20.50 1spb s ALA 187 CO 0.35 -0.86 1.86 0.77 0.00 0.00 0.00 175.76 177.88 1spb h SER 188 N 6.68 0.00 1.48 0.00 0.02 -1.92 -1.79 113.55 118.02 1spb h SER 188 Ca -0.43 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.43 1spb h SER 188 Cb 1.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 1spb h SER 188 CO 0.93 0.00 -0.41 2.19 -1.14 0.00 0.00 176.83 178.39 1spb h PHE 189 N 0.00 0.00 -1.89 3.45 -5.15 -1.91 -3.39 116.94 108.06 1spb h PHE 189 Ca 0.44 0.00 -0.60 0.00 -0.20 0.00 0.00 57.97 57.61 1spb h PHE 189 Cb 1.80 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.98 1spb h PHE 189 CO 0.00 0.41 1.38 0.45 -2.00 0.00 0.00 178.31 178.55 1spb n SER 190 N -3.24 3.24 -4.76 -0.68 2.88 -0.68 -1.57 113.62 108.81 1spb n SER 190 Ca 0.02 0.48 -0.41 0.00 -1.33 0.00 0.00 58.87 57.62 1spb n SER 190 Cb 0.68 -1.47 -0.01 0.00 -0.75 0.00 0.00 64.21 62.66 1spb n SER 190 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1spb s SER 191 N 6.84 6.33 0.28 -3.46 0.01 -0.28 -4.09 113.70 119.33 1spb s SER 191 Ca 0.99 3.02 0.09 0.00 1.31 0.00 0.00 55.95 61.36 1spb s SER 191 Cb -0.50 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.04 1spb s SER 191 CO 0.42 -0.92 0.06 0.68 0.41 0.00 0.00 173.24 173.89 1spb s VAL 192 N -0.41 3.47 0.00 3.43 -7.23 -1.22 -4.86 120.40 113.58 1spb s VAL 192 Ca 0.60 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.99 1spb s VAL 192 Cb -0.48 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.50 1spb s VAL 192 CO 0.54 -0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.62 1spb n GLY 193 N -1.01 1.70 0.30 2.32 0.00 0.11 -1.94 105.19 106.67 1spb n GLY 193 Ca -0.06 -1.90 0.20 0.00 0.00 0.00 0.00 46.02 44.26 1spb n GLY 193 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1spb h PRO 194 N 0.00 0.00 0.00 1.61 0.13 -1.85 -1.80 132.00 130.09 1spb h PRO 194 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1spb h PRO 194 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1spb h PRO 194 CO 0.00 0.00 -0.41 0.39 -0.23 0.00 0.00 178.00 177.75 1spb n GLU 195 N -2.95 0.09 -2.03 0.86 4.71 -1.26 -4.81 120.64 115.25 1spb n GLU 195 Ca -0.02 0.03 -0.42 0.00 -0.01 0.00 0.00 57.16 56.74 1spb n GLU 195 Cb 0.11 -1.56 -0.03 0.00 -1.01 0.00 0.00 31.44 28.95 1spb n GLU 195 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1spb s LEU 196 N -3.39 4.32 -0.24 -4.62 2.96 -0.68 -4.42 118.68 112.62 1spb s LEU 196 Ca 0.10 2.23 -0.12 0.00 -0.22 0.00 0.00 54.13 56.13 1spb s LEU 196 Cb 0.16 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.22 1spb s LEU 196 CO 0.67 -0.90 -0.31 0.47 -1.32 0.00 0.00 176.35 174.96 1spb n ASP 197 N 6.84 1.67 -3.79 3.68 8.00 0.16 -4.34 116.55 128.76 1spb n ASP 197 Ca 0.17 0.29 -0.09 0.00 0.71 0.00 0.00 54.79 55.86 1spb n ASP 197 Cb 0.43 -0.70 -0.06 0.00 -0.02 0.00 0.00 41.12 40.77 1spb n ASP 197 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1spb s VAL 198 N -2.44 0.12 0.01 2.53 -7.23 -1.00 -1.58 120.40 110.80 1spb s VAL 198 Ca -0.33 -1.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.90 1spb s VAL 198 Cb 0.12 -1.30 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 1spb s VAL 198 CO 0.42 -0.54 -0.16 -0.04 -0.31 0.00 0.00 175.10 174.46 1spb s MET 199 N -3.85 2.24 0.06 4.82 -1.94 -0.53 -1.34 119.30 118.77 1spb s MET 199 Ca 0.05 -0.88 -0.07 0.00 -1.71 0.00 0.00 55.69 53.08 1spb s MET 199 Cb 0.04 -2.27 -0.01 0.00 2.01 0.00 0.00 34.83 34.60 1spb s MET 199 CO -0.11 0.57 0.13 0.00 -0.01 0.00 0.00 175.02 175.59 1spb s ALA 200 N -0.87 -0.06 0.02 3.03 0.00 -1.09 -2.01 121.76 120.78 1spb s ALA 200 Ca 0.14 -0.68 -0.30 0.00 0.00 0.00 0.00 51.96 51.12 1spb s ALA 200 Cb -0.11 0.37 -0.09 0.00 0.00 0.00 0.00 23.12 23.29 1spb s ALA 200 CO 0.04 -0.42 2.00 -2.30 0.00 0.00 0.00 175.76 175.08 1spb n PRO 201 N 0.24 2.80 -0.13 0.00 -0.02 -1.26 -2.28 135.00 134.35 1spb n PRO 201 Ca -0.16 1.01 0.02 0.00 -2.02 0.00 0.00 63.50 62.35 1spb n PRO 201 Cb 0.61 -3.03 0.03 0.00 -0.02 0.00 0.00 33.50 31.09 1spb n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1spb n GLY 202 N 4.66 1.15 3.14 -1.23 0.00 -0.67 -1.87 105.19 110.37 1spb n GLY 202 Ca 0.21 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1spb n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1spb s VAL 203 N -0.90 1.89 -1.39 1.61 1.01 -1.23 -1.39 120.40 119.99 1spb s VAL 203 Ca 0.07 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1spb s VAL 203 Cb 0.06 -1.68 -0.00 0.00 0.00 0.00 0.00 36.38 34.76 1spb s VAL 203 CO 0.01 0.52 0.44 -0.24 0.00 0.00 0.00 175.10 175.83 1spb n SER 204 N 4.05 -0.46 -4.64 3.32 2.88 -1.20 -4.80 113.62 112.77 1spb n SER 204 Ca -0.20 -0.99 -0.43 0.00 -1.33 0.00 0.00 58.87 55.92 1spb n SER 204 Cb 0.52 -3.13 -0.03 0.00 -0.75 0.00 0.00 64.21 60.81 1spb n SER 204 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1spb s ILE 205 N -3.93 4.65 -0.26 2.46 -1.09 0.12 -4.73 121.20 118.42 1spb s ILE 205 Ca 0.01 1.61 -0.22 0.00 -2.23 0.00 0.00 60.65 59.82 1spb s ILE 205 Cb -0.00 -4.29 -0.01 0.00 -1.58 0.00 0.00 42.46 36.57 1spb s ILE 205 CO 0.88 -0.33 0.72 -0.69 -1.23 0.00 0.00 174.94 174.30 1spb s VAL 206 N 3.30 4.91 0.29 2.92 1.01 -1.26 -0.32 120.40 131.25 1spb s VAL 206 Ca 0.40 1.29 -0.01 0.00 0.00 0.00 0.00 61.98 63.67 1spb s VAL 206 Cb -0.13 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1spb s VAL 206 CO 0.12 -0.04 0.32 -0.55 0.00 0.00 0.00 175.10 174.95 1spb s SER 207 N 1.44 0.79 0.15 3.32 0.15 -1.01 -4.77 113.70 113.78 1spb s SER 207 Ca 0.30 -1.47 -0.30 0.00 0.70 0.00 0.00 55.95 55.18 1spb s SER 207 Cb -0.15 0.54 -0.08 0.00 -1.71 0.00 0.00 66.02 64.62 1spb s SER 207 CO 0.08 -1.08 1.30 0.42 1.20 0.00 0.00 173.24 175.16 1spb s THR 208 N -3.61 3.41 0.11 6.45 -4.23 -1.26 -0.89 115.64 115.63 1spb s THR 208 Ca 0.35 1.10 0.07 0.00 -1.18 0.00 0.00 61.69 62.03 1spb s THR 208 Cb 0.02 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.12 1spb s THR 208 CO 0.19 0.13 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.47 1spb s LEU 209 N 0.36 2.35 0.28 4.79 1.43 -0.44 -1.22 118.68 126.22 1spb s LEU 209 Ca 0.58 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.65 1spb s LEU 209 Cb -0.35 -0.68 -0.14 0.00 0.03 0.00 0.00 46.19 45.05 1spb s LEU 209 CO 0.34 -0.06 1.12 -2.65 0.23 0.00 0.00 176.35 175.33 1spb n PRO 210 N 0.80 1.53 -2.31 1.29 -0.02 -1.26 -1.49 135.00 133.53 1spb n PRO 210 Ca -0.17 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1spb n PRO 210 Cb 0.55 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1spb n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1spb n GLY 211 N 1.35 0.88 3.53 -1.23 0.00 -1.26 -3.96 105.19 104.48 1spb n GLY 211 Ca 0.10 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.24 1spb n GLY 211 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1spb n ASN 212 N 1.51 -2.50 -4.44 1.61 5.15 -1.24 -5.00 115.26 110.36 1spb n ASN 212 Ca 0.00 -0.73 -0.22 0.00 -0.60 0.00 0.00 54.58 53.03 1spb n ASN 212 Cb 0.48 -4.62 -0.10 0.00 -0.53 0.00 0.00 39.78 35.00 1spb n ASN 212 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1spb s LYS 213 N -5.50 1.58 0.08 1.20 1.02 -0.56 -5.02 119.74 112.54 1spb s LYS 213 Ca 0.09 -1.78 0.06 0.00 0.02 0.00 0.00 55.97 54.36 1spb s LYS 213 Cb -0.02 -1.32 -0.03 0.00 -0.52 0.00 0.00 37.83 35.94 1spb s LYS 213 CO 0.77 0.11 -0.16 0.71 -0.92 0.00 0.00 175.35 175.87 1spb s TYR 214 N -2.88 1.33 0.00 3.18 2.02 -1.26 -1.33 117.35 118.42 1spb s TYR 214 Ca 0.29 -0.45 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 1spb s TYR 214 Cb 0.02 -0.74 0.00 0.00 -0.40 0.00 0.00 41.96 40.83 1spb s TYR 214 CO 0.12 0.09 0.00 0.41 -1.57 0.00 0.00 175.55 174.60 1spb n GLY 215 N 1.24 1.58 3.71 0.71 0.00 -0.07 -4.80 105.19 107.56 1spb n GLY 215 Ca -0.21 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 1spb n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1spb s ALA 216 N -2.00 3.31 0.09 4.61 0.00 -1.24 -2.39 121.76 124.13 1spb s ALA 216 Ca 0.00 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.75 1spb s ALA 216 Cb 0.00 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1spb s ALA 216 CO 0.00 -0.38 -0.21 0.15 0.00 0.00 0.00 175.76 175.32 1spb s LYS 217 N 1.13 1.17 -0.03 0.00 1.02 0.56 -4.83 119.74 118.76 1spb s LYS 217 Ca 0.56 -1.11 0.07 0.00 0.02 0.00 0.00 55.97 55.50 1spb s LYS 217 Cb -0.26 -1.40 -0.02 0.00 -0.52 0.00 0.00 37.83 35.64 1spb s LYS 217 CO 0.28 0.33 -0.23 -1.12 -0.92 0.00 0.00 175.35 173.69 1spb s SER 218 N -1.75 2.72 0.00 2.83 0.01 -1.26 0.14 113.70 116.38 1spb s SER 218 Ca 0.06 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 56.90 1spb s SER 218 Cb -0.10 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 65.72 1spb s SER 218 CO 0.04 0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.56 1spb n GLY 219 N 2.64 3.25 0.22 3.44 0.00 -0.48 -4.92 105.19 109.33 1spb n GLY 219 Ca -0.16 -1.07 0.15 0.00 0.00 0.00 0.00 46.02 44.94 1spb n GLY 219 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1spb h THR 220 N 1.00 0.00 0.00 2.61 1.35 -1.83 -2.02 112.91 114.02 1spb h THR 220 Ca 0.00 -0.17 -0.04 0.00 -0.55 0.00 0.00 66.41 65.65 1spb h THR 220 Cb 0.00 0.93 -0.01 0.00 -1.73 0.00 0.00 68.15 67.35 1spb h THR 220 CO 0.00 0.00 -0.20 0.00 -0.25 0.00 0.00 175.52 175.07 1spb h ALA 221 N 2.07 1.09 0.15 6.62 0.00 -1.89 -0.20 119.26 127.10 1spb h ALA 221 Ca 0.00 -0.18 -0.32 0.00 0.00 0.00 0.00 54.91 54.41 1spb h ALA 221 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1spb h ALA 221 CO 0.00 0.25 -1.57 0.52 0.00 0.00 0.00 179.25 178.46 1spb h MET 222 N 0.00 0.31 -0.22 0.00 2.86 -1.66 -3.36 114.93 112.86 1spb h MET 222 Ca -0.00 -0.53 -0.08 0.00 -2.06 0.00 0.00 59.70 57.03 1spb h MET 222 Cb 0.63 0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.48 1spb h MET 222 CO 0.03 1.19 -0.18 0.00 1.06 0.00 0.00 176.91 179.01 1spb h ALA 223 N 0.38 0.32 -0.62 6.32 0.00 -0.99 -3.37 119.26 121.30 1spb h ALA 223 Ca -0.26 -0.34 0.06 0.00 0.00 0.00 0.00 54.91 54.37 1spb h ALA 223 Cb 2.05 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 19.67 1spb h ALA 223 CO 0.18 0.23 -0.55 1.03 0.00 0.00 0.00 179.25 180.13 1spb h SER 224 N 0.19 -1.93 -0.60 0.00 0.87 -1.21 -2.89 113.55 107.99 1spb h SER 224 Ca 0.04 0.27 0.17 0.00 -1.23 0.00 0.00 61.79 61.04 1spb h SER 224 Cb 0.71 0.82 -0.02 0.00 -0.44 0.00 0.00 62.40 63.46 1spb h SER 224 CO 0.05 -0.33 0.51 1.55 -0.53 0.00 0.00 176.83 178.08 1spb h PRO 225 N -0.24 0.00 -0.10 2.24 0.13 -1.71 -1.37 132.00 130.95 1spb h PRO 225 Ca 0.10 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.17 1spb h PRO 225 Cb 0.51 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1spb h PRO 225 CO -0.71 0.00 -0.21 0.45 -0.23 0.00 0.00 178.00 177.30 1spb h HIS 226 N 0.00 0.17 0.08 1.56 3.86 -1.66 0.05 115.15 119.21 1spb h HIS 226 Ca 0.29 -0.02 -0.24 0.00 -1.16 0.00 0.00 60.37 59.23 1spb h HIS 226 Cb 1.30 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.72 1spb h HIS 226 CO 0.00 0.36 -1.27 0.28 0.86 0.00 0.00 177.93 178.17 1spb h VAL 227 N 0.15 1.07 -0.07 2.45 2.07 -1.38 -2.16 116.25 118.38 1spb h VAL 227 Ca 0.03 -2.35 -0.02 0.00 0.82 0.00 0.00 66.70 65.17 1spb h VAL 227 Cb 0.46 2.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1spb h VAL 227 CO 0.03 0.63 -0.07 0.00 0.02 0.00 0.00 177.57 178.18 1spb h ALA 228 N -0.12 1.76 -0.19 1.67 0.00 -1.20 -1.55 119.26 119.62 1spb h ALA 228 Ca -0.29 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 1spb h ALA 228 Cb 1.61 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1spb h ALA 228 CO 0.01 0.18 -0.58 0.78 0.00 0.00 0.00 179.25 179.63 1spb h GLY 229 N 0.41 0.69 1.23 0.00 0.00 -1.07 -2.96 103.07 101.36 1spb h GLY 229 Ca 0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 47.33 46.48 1spb h GLY 229 CO 0.01 0.74 0.22 0.00 0.00 0.00 0.00 176.54 177.51 1spb h ALA 230 N 0.88 1.17 -0.44 3.60 0.00 -1.06 -2.26 119.26 121.14 1spb h ALA 230 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 1spb h ALA 230 Cb 1.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1spb h ALA 230 CO 0.11 0.58 -0.24 0.00 0.00 0.00 0.00 179.25 179.71 1spb h ALA 231 N 1.29 0.74 -0.85 0.00 0.00 -1.14 -1.43 119.26 117.88 1spb h ALA 231 Ca 0.21 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1spb h ALA 231 Cb 0.24 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1spb h ALA 231 CO -0.01 0.66 0.44 0.00 0.00 0.00 0.00 179.25 180.35 1spb h ALA 232 N 0.93 1.09 -0.36 0.00 0.00 -1.57 -1.61 119.26 117.74 1spb h ALA 232 Ca 0.10 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1spb h ALA 232 Cb 0.80 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1spb h ALA 232 CO 0.07 0.62 -0.37 -0.07 0.00 0.00 0.00 179.25 179.49 1spb h LEU 233 N 1.19 0.91 -0.10 0.00 3.38 -0.70 -2.14 115.31 117.84 1spb h LEU 233 Ca 0.29 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1spb h LEU 233 Cb 0.06 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1spb h LEU 233 CO -0.04 1.18 0.01 0.40 0.09 0.00 0.00 178.44 180.07 1spb h ILE 234 N 0.71 1.23 -0.11 1.22 2.04 -1.25 -2.72 117.51 118.63 1spb h ILE 234 Ca 0.06 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.24 1spb h ILE 234 Cb 0.94 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1spb h ILE 234 CO 0.09 0.21 0.17 -0.07 0.00 0.00 0.00 178.15 178.54 1spb h LEU 235 N -0.08 0.00 0.03 1.44 3.38 -1.18 0.58 115.31 119.49 1spb h LEU 235 Ca 0.03 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.73 1spb h LEU 235 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1spb h LEU 235 CO 0.00 0.00 -1.16 0.77 0.09 0.00 0.00 178.44 178.14 1spb h SER 236 N 0.00 0.54 0.66 -0.43 4.64 -1.08 -2.27 113.55 115.60 1spb h SER 236 Ca 0.05 -0.52 -0.27 0.00 -0.47 0.00 0.00 61.79 60.59 1spb h SER 236 Cb 0.38 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1spb h SER 236 CO -0.00 1.36 -1.29 0.50 -0.87 0.00 0.00 176.83 176.53 1spb h LYS 237 N 0.15 0.19 -2.08 4.77 3.64 -1.16 -3.42 116.57 118.66 1spb h LYS 237 Ca -0.13 -0.32 -0.58 0.00 -1.27 0.00 0.00 60.65 58.35 1spb h LYS 237 Cb 1.85 0.12 -0.40 0.00 -0.41 0.00 0.00 32.23 33.39 1spb h LYS 237 CO 0.20 1.10 -0.91 0.72 -2.27 0.00 0.00 179.45 178.29 1spb n HIS 238 N -3.44 1.14 0.22 1.91 8.25 0.20 -4.94 115.22 118.55 1spb n HIS 238 Ca -0.09 -3.78 0.13 0.00 -0.26 0.00 0.00 57.72 53.71 1spb n HIS 238 Cb 1.01 -0.42 0.68 0.00 1.12 0.00 0.00 29.99 32.38 1spb n HIS 238 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1spb h PRO 239 N 4.08 0.00 -0.00 -0.41 0.13 -1.64 -1.08 132.00 133.08 1spb h PRO 239 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1spb h PRO 239 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1spb h PRO 239 CO 0.60 0.00 -0.64 0.09 -0.23 0.00 0.00 178.00 177.82 1spb n ASN 240 N -2.44 1.09 -4.73 1.44 3.02 -1.26 -4.91 115.26 107.46 1spb n ASN 240 Ca -0.02 -0.89 -0.41 0.00 -0.03 0.00 0.00 54.58 53.23 1spb n ASN 240 Cb 0.16 0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 39.86 1spb n ASN 240 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1spb s TRP 241 N -2.81 3.40 0.74 3.10 0.52 -0.41 -5.04 118.94 118.44 1spb s TRP 241 Ca 0.14 1.36 -0.12 0.00 0.02 0.00 0.00 56.10 57.50 1spb s TRP 241 Cb 0.17 -3.46 0.04 0.00 -1.15 0.00 0.00 33.47 29.07 1spb s TRP 241 CO 0.71 -1.35 1.12 0.95 0.02 0.00 0.00 176.95 178.40 1spb s THR 242 N 0.22 3.05 0.38 2.01 -4.23 -1.26 -4.91 115.64 110.90 1spb s THR 242 Ca 0.55 0.34 0.17 0.00 -1.18 0.00 0.00 61.69 61.57 1spb s THR 242 Cb -0.33 -3.32 0.37 0.00 1.34 0.00 0.00 72.50 70.56 1spb s THR 242 CO 0.35 -0.44 1.76 -0.55 -0.54 0.00 0.00 174.62 175.19 1spb h ASN 243 N -0.79 0.49 -0.26 3.99 -1.07 -1.91 -1.37 115.58 114.66 1spb h ASN 243 Ca -0.45 0.10 -0.00 0.00 0.07 0.00 0.00 56.30 56.01 1spb h ASN 243 Cb 1.28 0.02 -0.01 0.00 -2.07 0.00 0.00 38.32 37.53 1spb h ASN 243 CO 0.64 0.08 0.16 0.74 0.07 0.00 0.00 177.43 179.12 1spb h THR 244 N 0.43 1.10 -0.21 6.14 2.02 -1.93 0.37 112.91 120.82 1spb h THR 244 Ca 0.61 -0.23 -0.14 0.00 0.77 0.00 0.00 66.41 67.42 1spb h THR 244 Cb 1.47 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1spb h THR 244 CO -0.34 0.09 -0.47 1.56 0.37 0.00 0.00 175.52 176.73 1spb h GLN 245 N 0.33 0.55 0.04 6.66 4.20 -1.78 -2.34 115.11 122.77 1spb h GLN 245 Ca 0.09 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 1spb h GLN 245 Cb 0.01 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1spb h GLN 245 CO -0.02 0.90 -0.02 0.28 -0.67 0.00 0.00 178.83 179.30 1spb h VAL 246 N 0.44 1.21 0.02 -0.54 2.07 -0.87 -1.48 116.25 117.10 1spb h VAL 246 Ca 0.03 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 1spb h VAL 246 Cb 0.99 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1spb h VAL 246 CO 0.09 0.21 -0.01 -0.09 0.02 0.00 0.00 177.57 177.79 1spb h ARG 247 N -0.43 -0.02 -0.87 1.57 2.43 -1.04 -2.22 114.38 113.79 1spb h ARG 247 Ca -0.01 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1spb h ARG 247 Cb 0.39 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 1spb h ARG 247 CO 0.01 0.01 0.52 0.77 -1.51 0.00 0.00 179.97 179.77 1spb h SER 248 N -0.04 1.05 -0.65 -3.80 0.02 -1.30 -2.07 113.55 106.76 1spb h SER 248 Ca -0.00 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1spb h SER 248 Cb 0.04 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.28 1spb h SER 248 CO 0.00 0.81 0.16 -1.28 -1.14 0.00 0.00 176.83 175.38 1spb h SER 249 N 1.20 1.00 -0.57 3.07 0.87 -1.23 0.15 113.55 118.05 1spb h SER 249 Ca 0.31 -0.21 -0.06 0.00 -1.23 0.00 0.00 61.79 60.61 1spb h SER 249 Cb -0.04 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.63 1spb h SER 249 CO -0.06 0.96 0.11 -0.07 -0.53 0.00 0.00 176.83 177.25 1spb h LEU 250 N 1.00 0.88 -0.16 2.23 3.38 -1.28 -1.82 115.31 119.54 1spb h LEU 250 Ca 0.21 -0.25 -0.23 0.00 0.09 0.00 0.00 57.88 57.70 1spb h LEU 250 Cb 0.36 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.88 1spb h LEU 250 CO 0.00 0.90 -0.93 -0.33 0.09 0.00 0.00 178.44 178.17 1spb h GLU 251 N 0.82 0.51 0.00 1.13 5.08 -0.68 -3.30 114.58 118.14 1spb h GLU 251 Ca 0.17 -0.53 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 1spb h GLU 251 Cb 0.38 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1spb h GLU 251 CO 0.01 1.16 -0.16 -0.91 -1.00 0.00 0.00 179.01 178.11 1spb h ASN 252 N 0.30 0.00 -0.31 1.42 2.35 -0.69 -3.37 115.58 115.28 1spb h ASN 252 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1spb h ASN 252 Cb 1.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.93 1spb h ASN 252 CO 0.17 0.16 0.00 0.35 -1.65 0.00 0.00 177.43 176.46 1spb n THR 253 N -3.19 1.28 -1.22 2.81 -2.24 -0.69 -5.04 114.28 105.99 1spb n THR 253 Ca 0.02 -1.19 -0.35 0.00 -2.27 0.00 0.00 64.05 60.26 1spb n THR 253 Cb 0.51 0.34 0.10 0.00 -2.10 0.00 0.00 70.33 69.18 1spb n THR 253 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1spb n THR 254 N 0.23 2.26 -2.83 4.28 -2.24 -1.25 -4.09 114.28 110.65 1spb n THR 254 Ca 0.13 -0.30 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 1spb n THR 254 Cb 0.52 -1.08 -0.04 0.00 -2.10 0.00 0.00 70.33 67.62 1spb n THR 254 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1spb s THR 255 N -1.98 4.33 -0.10 4.28 2.01 0.37 -4.86 115.64 119.70 1spb s THR 255 Ca 0.72 0.12 -0.29 0.00 0.31 0.00 0.00 61.69 62.54 1spb s THR 255 Cb -0.31 -4.60 -0.04 0.00 0.01 0.00 0.00 72.50 67.55 1spb s THR 255 CO 0.52 -1.25 1.57 -0.54 -0.69 0.00 0.00 174.62 174.23 1spb s LYS 256 N 4.08 4.14 0.00 4.92 1.02 -1.26 0.11 119.74 132.75 1spb s LYS 256 Ca 0.28 2.01 0.00 0.00 0.02 0.00 0.00 55.97 58.28 1spb s LYS 256 Cb -0.13 -3.95 0.00 0.00 -0.52 0.00 0.00 37.83 33.23 1spb s LYS 256 CO 0.17 -0.88 0.00 1.28 -0.92 0.00 0.00 175.35 174.99 1spb n LEU 257 N 7.21 0.00 0.00 3.17 4.77 -1.26 -4.91 117.00 125.98 1spb n LEU 257 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1spb n LEU 257 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1spb n LEU 257 CO 0.61 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1spb n GLY 258 N 5.00 -0.05 3.68 -0.72 0.00 -1.26 -4.96 105.19 106.89 1spb n GLY 258 Ca 0.00 -1.02 -0.45 0.00 0.00 0.00 0.00 46.02 44.55 1spb n GLY 258 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1spb n ASP 259 N 0.00 3.60 0.18 1.61 5.68 -1.26 -4.73 116.55 121.64 1spb n ASP 259 Ca 0.00 1.01 0.16 0.00 -0.50 0.00 0.00 54.79 55.46 1spb n ASP 259 Cb 0.00 -1.46 0.62 0.00 -1.14 0.00 0.00 41.12 39.14 1spb n ASP 259 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1spb h SER 260 N 8.00 0.00 1.10 -1.12 0.02 -1.92 0.24 113.55 119.87 1spb h SER 260 Ca -0.47 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.43 1spb h SER 260 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 1spb h SER 260 CO 0.93 0.00 -0.28 -0.26 -1.14 0.00 0.00 176.83 176.08 1spb h PHE 261 N 0.00 0.00 0.00 3.45 0.04 -1.86 -0.93 116.94 117.64 1spb h PHE 261 Ca 0.13 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.70 1spb h PHE 261 Cb 1.30 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.41 1spb h PHE 261 CO 0.00 0.28 -1.73 0.66 -0.60 0.00 0.00 178.31 176.92 1spb n TYR 262 N -3.35 0.00 -0.06 -0.55 4.02 -0.61 0.07 117.16 116.68 1spb n TYR 262 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 1spb n TYR 262 Cb 0.51 -0.53 0.00 0.00 -0.02 0.00 0.00 39.34 39.30 1spb n TYR 262 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1spb n TYR 263 N -2.40 0.00 -1.43 -0.72 4.01 -0.03 -4.92 117.16 111.67 1spb n TYR 263 Ca -0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1spb n TYR 263 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.88 1spb n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1spb n GLY 264 N 0.57 2.85 0.23 2.72 0.00 -0.35 -2.38 105.19 108.83 1spb n GLY 264 Ca 0.00 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.87 1spb n GLY 264 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1spb h LYS 265 N 0.00 0.00 0.00 1.61 1.79 -1.54 -3.32 116.57 115.11 1spb h LYS 265 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1spb h LYS 265 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1spb h LYS 265 CO 0.00 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.78 1spb n GLY 266 N 0.80 0.59 3.72 3.86 0.00 -1.00 -4.22 105.19 108.95 1spb n GLY 266 Ca 0.03 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 1spb n GLY 266 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1spb s LEU 267 N 0.00 4.42 0.17 0.99 2.96 0.29 -1.45 118.68 126.07 1spb s LEU 267 Ca 0.00 1.99 -0.32 0.00 -0.22 0.00 0.00 54.13 55.58 1spb s LEU 267 Cb 0.00 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 42.99 1spb s LEU 267 CO 0.00 -0.32 1.66 0.27 -1.32 0.00 0.00 176.35 176.64 1spb s ILE 268 N 0.46 2.41 -0.33 6.68 -4.36 -0.85 0.14 121.20 125.35 1spb s ILE 268 Ca 0.53 0.24 0.03 0.00 -0.26 0.00 0.00 60.65 61.20 1spb s ILE 268 Cb -0.28 -3.16 0.09 0.00 1.25 0.00 0.00 42.46 40.37 1spb s ILE 268 CO 0.31 0.02 0.04 0.21 0.24 0.00 0.00 174.94 175.76 1spb s ASN 269 N 1.40 4.77 0.26 4.36 3.84 -1.26 -4.51 114.94 123.80 1spb s ASN 269 Ca 0.73 -2.02 -0.01 0.00 0.21 0.00 0.00 52.86 51.77 1spb s ASN 269 Cb -0.46 -1.64 0.33 0.00 -0.55 0.00 0.00 41.25 38.93 1spb s ASN 269 CO 0.32 -0.36 1.73 1.62 -2.79 0.00 0.00 177.10 177.61 1spb h VAL 270 N 6.61 1.25 -0.08 -5.21 3.04 -1.11 -0.15 116.25 120.61 1spb h VAL 270 Ca -0.07 -1.12 -0.01 0.00 -1.01 0.00 0.00 66.70 64.49 1spb h VAL 270 Cb 1.03 1.05 -0.00 0.00 -2.01 0.00 0.00 31.29 31.35 1spb h VAL 270 CO 0.53 0.38 0.02 -0.61 -1.01 0.00 0.00 177.57 176.88 1spb h GLN 271 N 0.65 0.12 -0.36 4.17 4.15 -1.75 0.02 115.11 122.11 1spb h GLN 271 Ca 0.11 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.45 1spb h GLN 271 Cb 0.55 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1spb h GLN 271 CO 0.03 0.30 0.01 0.00 -1.93 0.00 0.00 178.83 177.24 1spb h ALA 272 N 0.82 0.48 -0.42 3.38 0.00 -1.84 -3.27 119.26 118.41 1spb h ALA 272 Ca 0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1spb h ALA 272 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1spb h ALA 272 CO -0.00 0.24 0.08 0.00 0.00 0.00 0.00 179.25 179.58 1spb h ALA 273 N 0.87 1.36 0.00 0.00 0.00 -0.98 -3.10 119.26 117.41 1spb h ALA 273 Ca 0.10 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1spb h ALA 273 Cb 0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1spb h ALA 273 CO 0.02 0.45 -0.18 0.00 0.00 0.00 0.00 179.25 179.54 1spb h ALA 274 N 1.48 1.25 0.00 0.00 0.00 -1.04 -3.43 119.26 117.53 1spb h ALA 274 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1spb h ALA 274 Cb 0.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1spb h ALA 274 CO -0.00 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.48