#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blb n GLY -7 N 0.00 6.23 1.00 0.00 0.00 -1.26 -5.08 105.19 106.08 1blb n GLY -7 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1blb n GLY -7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1blb n LYS -6 N 0.00 0.00 0.00 1.61 5.02 -1.26 -5.17 118.16 118.36 1blb n LYS -6 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1blb n LYS -6 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1blb n LYS -6 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1blb n PRO -5 N -1.75 0.00 -2.39 1.97 -0.04 -1.26 -4.71 135.00 126.83 1blb n PRO -5 Ca 0.00 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 1blb n PRO -5 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 1blb n PRO -5 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1blb s GLN -4 N 0.00 3.41 0.59 0.54 -0.44 -1.26 -5.05 119.66 117.45 1blb s GLN -4 Ca 0.00 -1.61 -0.12 0.00 -2.50 0.00 0.00 55.36 51.13 1blb s GLN -4 Cb 0.00 -5.41 -0.10 0.00 -1.64 0.00 0.00 33.01 25.86 1blb s GLN -4 CO 0.00 -2.88 -0.61 -2.30 0.50 0.00 0.00 175.29 169.99 1blb n PRO -3 N 8.40 0.00 -0.41 1.67 -0.02 -1.26 -4.91 135.00 138.47 1blb n PRO -3 Ca 0.46 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1blb n PRO -3 Cb 0.47 -0.59 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 1blb n PRO -3 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1blb n LEU -2 N 2.06 0.00 -3.55 2.45 4.32 -1.26 -5.09 117.00 115.93 1blb n LEU -2 Ca -0.01 -0.83 -0.11 0.00 -0.02 0.00 0.00 56.01 55.04 1blb n LEU -2 Cb 0.37 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.12 1blb n LEU -2 CO 0.29 0.32 0.71 0.54 -1.22 0.00 0.00 177.39 178.03 1blb s ASN -1 N -0.68 -0.41 0.29 -1.43 6.03 -1.26 -5.14 114.94 112.35 1blb s ASN -1 Ca 0.00 0.34 -0.25 0.00 -1.03 0.00 0.00 52.86 51.92 1blb s ASN -1 Cb 0.00 0.35 -0.16 0.00 -3.03 0.00 0.00 41.25 38.42 1blb s ASN -1 CO 0.00 -0.45 0.45 -2.65 -2.03 0.00 0.00 177.10 172.42 1blb n PRO 1 N 0.51 0.20 -3.32 3.55 -0.02 -1.26 -4.86 135.00 129.80 1blb n PRO 1 Ca -0.11 0.07 -0.11 0.00 -2.02 0.00 0.00 63.50 61.33 1blb n PRO 1 Cb 0.59 -1.14 -0.07 0.00 -0.02 0.00 0.00 33.50 32.86 1blb n PRO 1 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1blb s LYS 2 N -1.13 0.42 0.04 -0.52 2.20 -0.57 -4.43 119.74 115.76 1blb s LYS 2 Ca 0.62 -0.01 0.06 0.00 -0.36 0.00 0.00 55.97 56.28 1blb s LYS 2 Cb -0.79 -0.39 -0.02 0.00 -1.51 0.00 0.00 37.83 35.12 1blb s LYS 2 CO 0.59 -1.05 -0.18 -1.50 -0.36 0.00 0.00 175.35 172.84 1blb s ILE 3 N 2.40 1.43 -0.05 5.43 2.07 -1.25 0.15 121.20 131.39 1blb s ILE 3 Ca 0.10 -1.10 0.00 0.00 -1.41 0.00 0.00 60.65 58.24 1blb s ILE 3 Cb -0.13 -1.26 0.02 0.00 0.13 0.00 0.00 42.46 41.23 1blb s ILE 3 CO -0.28 0.13 -0.02 -0.63 -1.91 0.00 0.00 174.94 172.23 1blb s ILE 4 N -0.81 0.40 -0.12 2.00 1.01 0.44 -1.68 121.20 122.44 1blb s ILE 4 Ca 0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 1blb s ILE 4 Cb -0.08 -0.48 -0.02 0.00 0.01 0.00 0.00 42.46 41.88 1blb s ILE 4 CO 0.02 0.22 -0.10 0.27 0.00 0.00 0.00 174.94 175.34 1blb s ILE 5 N 1.24 3.38 0.08 2.92 -0.00 -1.17 -0.78 121.20 126.87 1blb s ILE 5 Ca -0.06 -0.56 0.07 0.00 -0.00 0.00 0.00 60.65 60.10 1blb s ILE 5 Cb -0.14 -2.42 -0.04 0.00 -0.00 0.00 0.00 42.46 39.86 1blb s ILE 5 CO -0.02 0.53 -0.13 -0.36 -0.00 0.00 0.00 174.94 174.97 1blb s PHE 6 N 0.06 2.68 0.12 1.37 0.40 -0.89 -0.50 117.98 121.22 1blb s PHE 6 Ca -0.03 -0.18 -0.26 0.00 -0.60 0.00 0.00 56.93 55.85 1blb s PHE 6 Cb -0.14 -1.45 -0.07 0.00 0.51 0.00 0.00 43.02 41.87 1blb s PHE 6 CO 0.04 0.37 1.65 1.49 0.70 0.00 0.00 175.22 179.47 1blb h GLU 7 N 3.96 -0.39 -6.47 0.44 4.81 -0.67 -1.57 114.58 114.70 1blb h GLU 7 Ca -0.49 0.03 -0.44 0.00 -0.13 0.00 0.00 59.36 58.33 1blb h GLU 7 Cb 1.16 0.09 0.02 0.00 0.63 0.00 0.00 28.75 30.65 1blb h GLU 7 CO 0.50 -0.26 -0.23 -0.65 -0.73 0.00 0.00 179.01 177.64 1blb s GLN 8 N -6.08 2.70 1.08 1.92 -1.52 -1.03 0.29 119.66 117.03 1blb s GLN 8 Ca -0.15 -1.35 -0.14 0.00 -1.95 0.00 0.00 55.36 51.77 1blb s GLN 8 Cb 0.08 -2.71 0.23 0.00 -0.22 0.00 0.00 33.01 30.39 1blb s GLN 8 CO 0.66 -0.39 1.08 -1.21 -0.25 0.00 0.00 175.29 175.17 1blb s GLU 9 N -4.41 -0.27 -1.29 2.91 2.02 -0.99 -3.52 118.70 113.15 1blb s GLU 9 Ca 0.56 0.40 -0.14 0.00 0.02 0.00 0.00 54.97 55.81 1blb s GLU 9 Cb -0.09 -1.67 0.13 0.00 0.10 0.00 0.00 34.13 32.61 1blb s GLU 9 CO 0.34 -3.18 0.46 -1.71 0.02 0.00 0.00 175.26 171.20 1blb n ASN 10 N -4.47 -2.42 -0.04 -0.19 2.85 -1.21 -2.66 115.26 107.12 1blb n ASN 10 Ca 0.06 -0.59 -0.00 0.00 -0.11 0.00 0.00 54.58 53.94 1blb n ASN 10 Cb 0.58 -2.07 -0.00 0.00 1.24 0.00 0.00 39.78 39.53 1blb n ASN 10 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1blb n PHE 11 N -3.74 -0.01 -4.26 1.20 3.72 -1.26 -5.07 117.46 108.03 1blb n PHE 11 Ca 0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.29 1blb n PHE 11 Cb 0.49 -0.95 -0.10 0.00 -0.94 0.00 0.00 39.48 37.98 1blb n PHE 11 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1blb s GLN 12 N -3.64 1.09 0.40 -1.08 -1.52 -1.09 -5.08 119.66 108.74 1blb s GLN 12 Ca 0.00 -1.40 0.00 0.00 -1.95 0.00 0.00 55.36 52.01 1blb s GLN 12 Cb 0.00 -0.81 0.00 0.00 -0.22 0.00 0.00 33.01 31.98 1blb s GLN 12 CO 0.00 0.13 0.00 0.41 -0.25 0.00 0.00 175.29 175.58 1blb n GLY 13 N 0.03 0.63 3.59 3.09 0.00 -1.26 -2.47 105.19 108.80 1blb n GLY 13 Ca -0.12 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 1blb n GLY 13 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1blb s HIS 14 N 0.00 2.48 0.16 1.61 5.65 -1.26 -4.82 115.29 119.11 1blb s HIS 14 Ca 0.00 0.60 0.07 0.00 0.25 0.00 0.00 55.06 55.97 1blb s HIS 14 Cb 0.00 -4.39 -0.04 0.00 -1.18 0.00 0.00 32.58 26.97 1blb s HIS 14 CO 0.00 -1.78 0.01 -1.54 -0.65 0.00 0.00 174.74 170.78 1blb s SER 15 N 3.66 4.87 -0.19 9.88 1.04 -1.26 -0.08 113.70 131.63 1blb s SER 15 Ca 0.54 -0.35 -0.06 0.00 0.48 0.00 0.00 55.95 56.57 1blb s SER 15 Cb -0.11 -1.08 0.09 0.00 0.10 0.00 0.00 66.02 65.03 1blb s SER 15 CO 0.30 0.10 0.37 -2.28 0.98 0.00 0.00 173.24 172.70 1blb s HIS 16 N -1.69 -0.69 0.56 5.02 2.46 0.35 -4.93 115.29 116.37 1blb s HIS 16 Ca 0.28 1.25 -0.19 0.00 0.47 0.00 0.00 55.06 56.87 1blb s HIS 16 Cb -0.10 0.16 -0.05 0.00 -0.13 0.00 0.00 32.58 32.46 1blb s HIS 16 CO 0.19 -0.48 1.11 -2.00 -2.47 0.00 0.00 174.74 171.09 1blb s GLU 17 N 2.55 3.32 0.32 2.88 2.12 -1.26 -3.07 118.70 125.56 1blb s GLU 17 Ca 0.01 1.53 0.07 0.00 0.36 0.00 0.00 54.97 56.95 1blb s GLU 17 Cb -0.13 -2.01 -0.06 0.00 0.26 0.00 0.00 34.13 32.19 1blb s GLU 17 CO -0.12 -0.86 -0.05 -0.51 -0.54 0.00 0.00 175.26 173.18 1blb s LEU 18 N -3.95 2.60 0.00 2.70 1.02 -0.68 -4.98 118.68 115.38 1blb s LEU 18 Ca 0.71 -1.23 0.00 0.00 0.02 0.00 0.00 54.13 53.63 1blb s LEU 18 Cb -0.22 -0.78 0.00 0.00 0.02 0.00 0.00 46.19 45.21 1blb s LEU 18 CO 0.29 -0.33 0.08 0.59 0.02 0.00 0.00 176.35 177.00 1blb n ASN 19 N -0.72 0.00 -3.64 2.29 4.13 -1.26 -3.79 115.26 112.27 1blb n ASN 19 Ca -0.05 -1.00 -0.02 0.00 1.68 0.00 0.00 54.58 55.19 1blb n ASN 19 Cb 0.64 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.87 1blb n ASN 19 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1blb s GLY 20 N 0.00 -0.35 0.28 7.41 0.00 -1.26 -3.98 107.32 109.42 1blb s GLY 20 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 44.72 45.43 1blb s GLY 20 CO 0.00 0.18 0.00 -1.05 0.00 0.00 0.00 173.10 172.23 1blb n PRO 21 N -0.40 1.27 0.00 2.90 -0.02 -1.26 -4.85 135.00 132.64 1blb n PRO 21 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1blb n PRO 21 Cb 0.61 -0.56 0.00 0.00 -0.02 0.00 0.00 33.50 33.53 1blb n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1blb n PRO 23 N 0.00 -0.01 -3.74 0.00 -0.02 -1.26 -3.84 135.00 126.13 1blb n PRO 23 Ca 0.00 0.89 -0.29 0.00 -2.02 0.00 0.00 63.50 62.08 1blb n PRO 23 Cb 0.00 -1.91 -0.16 0.00 -0.02 0.00 0.00 33.50 31.41 1blb n PRO 23 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1blb s ASN 24 N -4.09 3.46 0.45 2.55 3.84 -1.26 -3.77 114.94 116.12 1blb s ASN 24 Ca -0.05 -1.19 0.25 0.00 0.21 0.00 0.00 52.86 52.08 1blb s ASN 24 Cb 0.22 -0.73 0.97 0.00 -0.55 0.00 0.00 41.25 41.16 1blb s ASN 24 CO 0.66 -0.35 1.84 -0.07 -2.79 0.00 0.00 177.10 176.39 1blb h LEU 25 N 8.17 0.00 -0.64 3.21 3.38 -1.49 -1.39 115.31 126.55 1blb h LEU 25 Ca -0.16 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.69 1blb h LEU 25 Cb 1.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1blb h LEU 25 CO 0.40 0.20 -0.58 0.11 0.09 0.00 0.00 178.44 178.67 1blb h LYS 26 N 0.00 0.00 -0.12 1.13 6.56 -1.79 -0.89 116.57 121.45 1blb h LYS 26 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1blb h LYS 26 Cb 0.72 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 1blb h LYS 26 CO 0.03 0.58 0.00 -1.91 -2.06 0.00 0.00 179.45 176.08 1blb n GLU 27 N -3.59 1.52 -0.04 3.15 2.13 -0.61 -2.45 120.64 120.75 1blb n GLU 27 Ca -0.00 -0.78 -0.03 0.00 0.66 0.00 0.00 57.16 57.01 1blb n GLU 27 Cb 0.64 -1.36 -0.14 0.00 0.27 0.00 0.00 31.44 30.85 1blb n GLU 27 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1blb n THR 28 N 0.01 1.08 -0.46 6.31 -1.04 -0.40 -4.99 114.28 114.79 1blb n THR 28 Ca 0.15 -0.73 0.00 0.00 -2.04 0.00 0.00 64.05 61.43 1blb n THR 28 Cb 0.25 -0.51 0.00 0.00 -1.82 0.00 0.00 70.33 68.25 1blb n THR 28 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1blb n GLY 328 N 1.53 -1.94 0.00 3.41 0.00 -0.86 -5.05 105.19 102.28 1blb n GLY 328 Ca -0.19 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1blb n GLY 328 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1blb n VAL 29 N 0.95 0.00 -0.05 1.61 0.24 -1.26 -4.86 118.33 114.96 1blb n VAL 29 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.26 1blb n VAL 29 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 1blb n VAL 29 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1blb n GLU 30 N -1.79 0.34 -3.55 7.34 0.00 -1.26 -4.10 120.64 117.61 1blb n GLU 30 Ca 0.00 0.42 -0.21 0.00 0.00 0.00 0.00 57.16 57.36 1blb n GLU 30 Cb 0.00 -1.41 -0.01 0.00 0.00 0.00 0.00 31.44 30.02 1blb n GLU 30 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1blb s LYS 31 N -1.97 3.32 -0.31 5.31 -0.14 -1.26 -4.51 119.74 120.17 1blb s LYS 31 Ca -0.12 -0.67 -0.07 0.00 -1.36 0.00 0.00 55.97 53.75 1blb s LYS 31 Cb 0.02 -2.77 0.02 0.00 -1.68 0.00 0.00 37.83 33.42 1blb s LYS 31 CO 0.18 0.16 0.09 0.00 -0.76 0.00 0.00 175.35 175.02 1blb s ALA 32 N -2.20 3.06 -2.11 5.17 0.00 -1.26 -4.39 121.76 120.02 1blb s ALA 32 Ca 0.40 -1.57 0.20 0.00 0.00 0.00 0.00 51.96 50.99 1blb s ALA 32 Cb -0.09 -2.20 0.54 0.00 0.00 0.00 0.00 23.12 21.36 1blb s ALA 32 CO 0.33 -1.09 1.45 0.41 0.00 0.00 0.00 175.76 176.86 1blb n GLY 33 N 4.85 1.75 3.65 0.00 0.00 0.15 -4.76 105.19 110.82 1blb n GLY 33 Ca -0.14 -0.67 -0.00 0.00 0.00 0.00 0.00 46.02 45.21 1blb n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1blb s SER 34 N -1.14 -0.15 0.41 1.61 0.01 -1.01 -2.36 113.70 111.08 1blb s SER 34 Ca 0.40 0.25 0.07 0.00 1.31 0.00 0.00 55.95 57.99 1blb s SER 34 Cb 0.21 0.81 -0.05 0.00 0.21 0.00 0.00 66.02 67.21 1blb s SER 34 CO 0.29 -0.04 0.22 -0.69 0.41 0.00 0.00 173.24 173.42 1blb s VAL 35 N 0.78 2.37 -0.28 3.43 1.01 -1.06 -2.10 120.40 124.56 1blb s VAL 35 Ca -0.04 -1.63 -0.07 0.00 0.00 0.00 0.00 61.98 60.25 1blb s VAL 35 Cb -0.03 -3.00 0.14 0.00 0.00 0.00 0.00 36.38 33.49 1blb s VAL 35 CO -0.12 -0.00 0.58 -0.22 0.00 0.00 0.00 175.10 175.34 1blb s LEU 36 N -3.95 -1.08 -0.32 3.92 0.20 0.04 -3.19 118.68 114.30 1blb s LEU 36 Ca 0.42 1.20 -0.22 0.00 0.69 0.00 0.00 54.13 56.22 1blb s LEU 36 Cb 0.03 2.02 -0.00 0.00 -0.43 0.00 0.00 46.19 47.80 1blb s LEU 36 CO 0.24 -0.24 0.73 -0.69 -0.29 0.00 0.00 176.35 176.10 1blb s VAL 37 N 2.81 4.83 -0.00 1.68 1.01 -0.39 -0.42 120.40 129.92 1blb s VAL 37 Ca 0.03 0.98 0.02 0.00 0.00 0.00 0.00 61.98 63.01 1blb s VAL 37 Cb -0.13 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 1blb s VAL 37 CO -0.18 -0.26 0.04 0.00 0.00 0.00 0.00 175.10 174.70 1blb n GLN 38 N 6.14 0.32 -3.15 2.72 6.02 -0.30 -2.48 117.38 126.65 1blb n GLN 38 Ca 0.02 -0.02 0.04 0.00 -0.01 0.00 0.00 57.00 57.03 1blb n GLN 38 Cb 0.48 -1.05 -0.00 0.00 1.02 0.00 0.00 30.24 30.69 1blb n GLN 38 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1blb s ALA 39 N -2.13 -2.53 0.00 -1.58 0.00 0.40 -4.80 121.76 111.12 1blb s ALA 39 Ca -0.01 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1blb s ALA 39 Cb 0.01 -2.48 0.00 0.00 0.00 0.00 0.00 23.12 20.65 1blb s ALA 39 CO 0.08 -1.73 0.00 0.41 0.00 0.00 0.00 175.76 174.52 1blb n GLY 40 N 5.40 5.72 3.81 0.00 0.00 -1.26 -1.51 105.19 117.35 1blb n GLY 40 Ca 0.04 -1.52 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 1blb n GLY 40 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1blb s PRO 41 N 1.52 0.60 0.01 1.61 0.02 -1.26 -4.94 135.00 132.55 1blb s PRO 41 Ca 0.00 -0.04 -0.06 0.00 0.02 0.00 0.00 61.00 60.92 1blb s PRO 41 Cb 0.00 -1.81 -0.00 0.00 0.02 0.00 0.00 34.50 32.71 1blb s PRO 41 CO 0.00 -2.50 0.11 -1.58 -0.33 0.00 0.00 177.00 172.70 1blb s TRP 42 N -3.47 0.09 -0.30 6.54 0.52 -0.98 -1.34 118.94 120.00 1blb s TRP 42 Ca 0.68 -0.23 -0.02 0.00 0.02 0.00 0.00 56.10 56.55 1blb s TRP 42 Cb -0.10 -0.08 0.05 0.00 -1.15 0.00 0.00 33.47 32.19 1blb s TRP 42 CO 0.53 -0.28 -0.00 0.14 0.02 0.00 0.00 176.95 177.36 1blb s VAL 43 N -1.49 2.98 1.04 4.03 -7.23 0.43 -2.21 120.40 117.94 1blb s VAL 43 Ca -0.14 -1.39 -0.14 0.00 -1.81 0.00 0.00 61.98 58.50 1blb s VAL 43 Cb -0.08 -2.72 0.21 0.00 0.56 0.00 0.00 36.38 34.36 1blb s VAL 43 CO 0.01 -0.11 1.12 -0.83 -0.31 0.00 0.00 175.10 174.98 1blb s GLY 44 N 1.26 1.58 0.08 2.32 0.00 0.41 -2.58 107.32 110.38 1blb s GLY 44 Ca -0.05 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.08 1blb s GLY 44 CO -0.01 0.08 -0.07 -0.19 0.00 0.00 0.00 173.10 172.91 1blb s TYR 45 N -3.09 0.83 -0.10 1.90 1.51 0.19 -1.60 117.35 116.99 1blb s TYR 45 Ca 0.67 -0.77 -0.09 0.00 -1.01 0.00 0.00 57.07 55.87 1blb s TYR 45 Cb -0.15 -0.48 -0.03 0.00 -0.11 0.00 0.00 41.96 41.19 1blb s TYR 45 CO 0.56 -0.12 -0.17 -1.91 -1.11 0.00 0.00 175.55 172.80 1blb n GLU 46 N 0.46 0.31 -2.20 -0.62 0.00 -0.14 -1.72 120.64 116.74 1blb n GLU 46 Ca -0.16 0.28 -0.40 0.00 0.00 0.00 0.00 57.16 56.89 1blb n GLU 46 Cb 0.59 -1.23 -0.02 0.00 0.00 0.00 0.00 31.44 30.78 1blb n GLU 46 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.13 175.99 1blb s GLN 47 N -2.00 4.32 1.20 5.31 2.00 -0.26 -3.95 119.66 126.28 1blb s GLN 47 Ca -0.14 2.08 -0.16 0.00 -2.00 0.00 0.00 55.36 55.14 1blb s GLN 47 Cb 0.02 -3.00 0.29 0.00 0.80 0.00 0.00 33.01 31.12 1blb s GLN 47 CO 0.21 -0.17 1.03 0.00 -0.50 0.00 0.00 175.29 175.86 1blb s ALA 48 N -1.20 -0.12 -1.21 1.58 0.00 -1.26 -2.66 121.76 116.90 1blb s ALA 48 Ca 0.50 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 1blb s ALA 48 Cb -0.37 -3.09 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 1blb s ALA 48 CO 0.48 -3.80 0.93 0.09 0.00 0.00 0.00 175.76 173.47 1blb n ASN 49 N -4.92 -2.20 -4.13 0.00 3.02 -1.25 -2.91 115.26 102.87 1blb n ASN 49 Ca 0.07 -0.67 -0.31 0.00 -0.03 0.00 0.00 54.58 53.64 1blb n ASN 49 Cb 0.57 -4.91 -0.04 0.00 -0.61 0.00 0.00 39.78 34.79 1blb n ASN 49 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1blb s LYS 51 N -6.85 1.23 0.13 0.00 2.20 -1.09 -5.08 119.74 110.28 1blb s LYS 51 Ca 0.32 -1.55 0.00 0.00 -0.36 0.00 0.00 55.97 54.38 1blb s LYS 51 Cb -0.17 0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.45 1blb s LYS 51 CO 0.93 -0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.91 1blb n GLY 52 N -0.27 1.02 3.66 5.54 0.00 -1.26 -1.10 105.19 112.78 1blb n GLY 52 Ca 0.01 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.19 1blb n GLY 52 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1blb s GLU 53 N 0.00 4.12 0.15 1.61 2.12 -1.26 -4.84 118.70 120.60 1blb s GLU 53 Ca 0.00 0.01 -0.25 0.00 0.36 0.00 0.00 54.97 55.10 1blb s GLU 53 Cb 0.00 -3.55 -0.08 0.00 0.26 0.00 0.00 34.13 30.77 1blb s GLU 53 CO 0.00 -0.02 0.75 -0.65 -0.54 0.00 0.00 175.26 174.80 1blb s GLN 54 N 1.28 4.52 -0.11 4.30 -0.21 -1.26 -0.96 119.66 127.21 1blb s GLN 54 Ca 0.14 1.10 -0.01 0.00 0.02 0.00 0.00 55.36 56.61 1blb s GLN 54 Cb -0.14 -3.27 0.03 0.00 1.00 0.00 0.00 33.01 30.63 1blb s GLN 54 CO 0.07 0.56 -0.02 -0.06 -2.12 0.00 0.00 175.29 173.72 1blb s PHE 55 N -1.06 1.01 -0.21 0.91 0.08 -0.63 -4.97 117.98 113.11 1blb s PHE 55 Ca 0.35 -0.50 -0.14 0.00 0.12 0.00 0.00 56.93 56.76 1blb s PHE 55 Cb -0.23 -0.99 -0.04 0.00 -0.57 0.00 0.00 43.02 41.20 1blb s PHE 55 CO 0.25 -0.44 0.34 0.08 -0.10 0.00 0.00 175.22 175.34 1blb s VAL 56 N 1.86 5.24 -0.11 -0.44 1.01 -1.26 0.15 120.40 126.86 1blb s VAL 56 Ca 0.04 0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.57 1blb s VAL 56 Cb -0.13 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1blb s VAL 56 CO -0.07 0.28 -0.02 -0.36 0.00 0.00 0.00 175.10 174.94 1blb s PHE 57 N 1.19 3.10 0.22 5.22 0.08 -0.94 -4.94 117.98 121.91 1blb s PHE 57 Ca 0.16 0.04 0.01 0.00 0.12 0.00 0.00 56.93 57.26 1blb s PHE 57 Cb -0.14 -1.84 -0.05 0.00 -0.57 0.00 0.00 43.02 40.42 1blb s PHE 57 CO 0.07 0.30 0.06 -1.83 -0.10 0.00 0.00 175.22 173.73 1blb s GLU 58 N -0.48 1.28 -0.36 0.44 -1.05 -1.26 -2.32 118.70 114.93 1blb s GLU 58 Ca 0.08 -1.66 -0.38 0.00 -0.15 0.00 0.00 54.97 52.86 1blb s GLU 58 Cb -0.12 -0.21 -0.14 0.00 -0.44 0.00 0.00 34.13 33.23 1blb s GLU 58 CO 0.02 -0.24 2.10 1.17 0.95 0.00 0.00 175.26 179.26 1blb n LYS 59 N -0.36 0.89 0.00 -4.83 4.81 -1.26 -4.59 118.16 112.81 1blb n LYS 59 Ca -0.02 0.26 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1blb n LYS 59 Cb 0.65 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.48 1blb n LYS 59 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1blb n GLY 60 N 6.33 2.53 3.70 3.14 0.00 -1.03 -4.95 105.19 114.91 1blb n GLY 60 Ca 0.41 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 1blb n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1blb s GLU 61 N -2.04 4.48 -0.45 1.61 2.02 -1.26 -1.26 118.70 121.81 1blb s GLU 61 Ca 0.00 1.37 0.09 0.00 0.02 0.00 0.00 54.97 56.45 1blb s GLU 61 Cb 0.00 -3.50 0.34 0.00 0.10 0.00 0.00 34.13 31.06 1blb s GLU 61 CO 0.00 -0.19 0.79 0.66 0.02 0.00 0.00 175.26 176.54 1blb n TYR 62 N 4.50 1.53 -1.36 1.61 4.01 -1.19 -5.00 117.16 121.24 1blb n TYR 62 Ca 0.07 -3.87 -0.39 0.00 -0.16 0.00 0.00 57.90 53.55 1blb n TYR 62 Cb 0.50 -0.44 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 1blb n TYR 62 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1blb n PRO 63 N 0.20 3.44 0.00 -0.72 -0.04 -1.26 -2.55 135.00 134.07 1blb n PRO 63 Ca 0.27 -2.24 0.00 0.00 -0.04 0.00 0.00 63.50 61.49 1blb n PRO 63 Cb 0.56 -2.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 1blb n PRO 63 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1blb n ARG 64 N 4.14 0.00 -0.30 0.54 0.63 -1.25 -3.32 116.66 117.10 1blb n ARG 64 Ca 0.72 0.00 0.27 0.00 -0.92 0.00 0.00 57.85 57.92 1blb n ARG 64 Cb 0.26 0.00 0.61 0.00 0.45 0.00 0.00 32.46 33.78 1blb n ARG 64 CO 0.00 0.00 0.00 0.11 -2.51 0.00 0.00 177.63 175.23 1blb h TRP 65 N 0.00 0.36 -0.80 -0.14 5.08 -1.87 0.14 115.95 118.73 1blb h TRP 65 Ca 0.00 0.01 0.12 0.00 1.08 0.00 0.00 58.89 60.10 1blb h TRP 65 Cb 0.00 -0.10 -0.08 0.00 -3.00 0.00 0.00 29.16 25.97 1blb h TRP 65 CO 0.00 0.04 0.41 0.38 -1.28 0.00 0.00 178.44 177.99 1blb h ASP 66 N 0.22 0.52 -0.75 0.11 3.04 -1.95 -2.19 116.42 115.42 1blb h ASP 66 Ca 0.56 0.08 0.22 0.00 -3.24 0.00 0.00 57.03 54.64 1blb h ASP 66 Cb 1.75 -0.01 -0.03 0.00 -1.04 0.00 0.00 39.33 40.00 1blb h ASP 66 CO -0.16 0.26 0.88 0.28 -2.04 0.00 0.00 179.24 178.46 1blb h SER 67 N 0.64 0.00 0.00 4.15 0.02 -1.30 -1.99 113.55 115.07 1blb h SER 67 Ca 0.41 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.35 1blb h SER 67 Cb 0.51 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.01 1blb h SER 67 CO -0.32 0.00 -0.35 -2.67 -1.14 0.00 0.00 176.83 172.36 1blb n TRP 68 N -3.42 0.00 -3.34 3.45 2.14 -0.83 -4.97 117.44 110.47 1blb n TRP 68 Ca 0.16 -0.99 -0.12 0.00 2.07 0.00 0.00 57.50 58.63 1blb n TRP 68 Cb 1.13 -0.17 -0.07 0.00 -0.81 0.00 0.00 31.31 31.39 1blb n TRP 68 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 1blb s THR 69 N -2.32 -0.56 -1.72 -1.67 2.01 -0.75 -4.85 115.64 105.78 1blb s THR 69 Ca 0.30 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1blb s THR 69 Cb 0.29 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.82 1blb s THR 69 CO -0.03 -0.33 0.67 -1.20 -0.69 0.00 0.00 174.62 173.04 1blb n SER 70 N 5.34 0.21 0.00 3.53 7.64 -1.26 -3.33 113.62 125.76 1blb n SER 70 Ca -0.01 -1.55 0.00 0.00 1.01 0.00 0.00 58.87 58.33 1blb n SER 70 Cb 0.48 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1blb n SER 70 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1blb n SER 370 N -0.33 0.00 0.00 6.43 3.41 -1.26 -5.11 113.62 116.75 1blb n SER 370 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1blb n SER 370 Cb 0.05 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1blb n SER 370 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1blb n ARG 71 N -2.28 0.00 -3.09 4.33 1.74 -1.21 -5.02 116.66 111.13 1blb n ARG 71 Ca 0.00 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 1blb n ARG 71 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 1blb n ARG 71 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1blb s ARG 371 N -0.30 3.14 -0.08 5.56 6.06 -1.26 -4.97 118.95 127.09 1blb s ARG 371 Ca 0.00 -0.88 0.04 0.00 -2.50 0.00 0.00 55.73 52.40 1blb s ARG 371 Cb 0.00 -4.13 -0.01 0.00 0.06 0.00 0.00 34.95 30.87 1blb s ARG 371 CO 0.00 -1.35 -0.22 -0.08 -2.50 0.00 0.00 175.30 171.15 1blb s THR 72 N 2.90 2.26 -0.57 4.11 -1.32 -1.26 -5.03 115.64 116.73 1blb s THR 72 Ca 0.17 -0.97 -0.02 0.00 -1.21 0.00 0.00 61.69 59.66 1blb s THR 72 Cb -0.19 -1.86 0.39 0.00 -1.51 0.00 0.00 72.50 69.33 1blb s THR 72 CO 0.12 0.56 2.03 -0.67 -2.21 0.00 0.00 174.62 174.45 1blb n ASP 73 N 3.14 7.36 -0.78 8.08 2.03 -1.26 -5.05 116.55 130.08 1blb n ASP 73 Ca -0.18 -3.59 0.08 0.00 0.52 0.00 0.00 54.79 51.62 1blb n ASP 73 Cb 0.52 -1.00 -0.02 0.00 -0.72 0.00 0.00 41.12 39.90 1blb n ASP 73 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1blb n SER 74 N -0.57 -4.62 -4.88 1.67 3.41 -1.26 -4.82 113.62 102.56 1blb n SER 74 Ca 0.54 0.66 -0.30 0.00 -0.26 0.00 0.00 58.87 59.51 1blb n SER 74 Cb 0.64 -2.00 -0.03 0.00 -0.26 0.00 0.00 64.21 62.57 1blb n SER 74 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1blb s LEU 75 N 0.00 3.81 0.22 1.04 2.96 -1.26 -4.55 118.68 120.90 1blb s LEU 75 Ca 0.00 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 1blb s LEU 75 Cb 0.00 -4.00 0.00 0.00 0.50 0.00 0.00 46.19 42.69 1blb s LEU 75 CO 0.00 -0.41 0.00 -0.24 -1.32 0.00 0.00 176.35 174.38 1blb n SER 76 N -1.37 -0.30 -4.61 3.68 2.88 -0.70 -4.72 113.62 108.48 1blb n SER 76 Ca 0.02 0.38 -0.25 0.00 -1.33 0.00 0.00 58.87 57.69 1blb n SER 76 Cb 0.54 0.46 -0.08 0.00 -0.75 0.00 0.00 64.21 64.38 1blb n SER 76 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1blb s SER 77 N -4.84 4.45 -0.23 -3.46 0.01 -1.19 -1.94 113.70 106.50 1blb s SER 77 Ca 0.00 -0.56 -0.04 0.00 1.31 0.00 0.00 55.95 56.65 1blb s SER 77 Cb 0.00 -0.82 0.12 0.00 0.21 0.00 0.00 66.02 65.53 1blb s SER 77 CO 0.00 0.07 0.42 -0.76 0.41 0.00 0.00 173.24 173.37 1blb s LEU 78 N -3.12 -0.71 0.03 2.44 1.43 -1.26 0.54 118.68 118.03 1blb s LEU 78 Ca 0.28 0.62 0.09 0.00 -1.03 0.00 0.00 54.13 54.08 1blb s LEU 78 Cb -0.08 1.31 -0.03 0.00 0.03 0.00 0.00 46.19 47.43 1blb s LEU 78 CO 0.17 -0.27 -0.26 0.00 0.23 0.00 0.00 176.35 176.23 1blb s ARG 79 N 2.60 1.91 0.41 1.70 1.70 -1.07 -3.34 118.95 122.86 1blb s ARG 79 Ca 0.07 -1.05 -0.24 0.00 -0.47 0.00 0.00 55.73 54.04 1blb s ARG 79 Cb -0.14 -2.01 -0.08 0.00 -0.57 0.00 0.00 34.95 32.15 1blb s ARG 79 CO -0.15 0.53 1.10 -2.14 -1.08 0.00 0.00 175.30 173.56 1blb s PRO 80 N -1.08 4.06 -0.22 3.89 0.02 -1.26 -0.43 135.00 139.98 1blb s PRO 80 Ca 0.11 1.66 -0.25 0.00 0.02 0.00 0.00 61.00 62.53 1blb s PRO 80 Cb -0.10 -2.56 -0.01 0.00 0.02 0.00 0.00 34.50 31.85 1blb s PRO 80 CO 0.01 -0.27 0.86 0.42 -0.33 0.00 0.00 177.00 177.70 1blb s ILE 81 N -1.56 4.83 -1.16 2.83 1.01 -0.45 -4.83 121.20 121.86 1blb s ILE 81 Ca 0.59 1.66 -0.17 0.00 0.00 0.00 0.00 60.65 62.73 1blb s ILE 81 Cb -0.26 -4.15 0.12 0.00 0.01 0.00 0.00 42.46 38.18 1blb s ILE 81 CO 0.32 -0.06 1.46 -0.75 0.00 0.00 0.00 174.94 175.92 1blb s LYS 82 N 2.66 3.92 -0.26 2.79 2.36 -1.26 -4.63 119.74 125.32 1blb s LYS 82 Ca 0.37 -2.12 -0.29 0.00 -2.55 0.00 0.00 55.97 51.38 1blb s LYS 82 Cb -0.16 -5.19 -0.00 0.00 -1.05 0.00 0.00 37.83 31.43 1blb s LYS 82 CO 0.09 -1.94 1.29 0.08 1.55 0.00 0.00 175.35 176.42 1blb s VAL 83 N 2.84 4.18 -1.04 4.02 1.01 -1.26 -4.97 120.40 125.18 1blb s VAL 83 Ca 0.44 1.36 -0.07 0.00 0.00 0.00 0.00 61.98 63.72 1blb s VAL 83 Cb -0.01 -4.10 0.26 0.00 0.00 0.00 0.00 36.38 32.53 1blb s VAL 83 CO -0.01 -0.36 1.01 -0.62 0.00 0.00 0.00 175.10 175.12 1blb s ASP 84 N 2.56 6.93 -0.05 3.32 2.15 -1.26 -5.02 116.67 125.30 1blb s ASP 84 Ca 0.56 -3.62 0.01 0.00 0.43 0.00 0.00 52.55 49.93 1blb s ASP 84 Cb -0.18 -2.12 0.02 0.00 -0.30 0.00 0.00 42.92 40.34 1blb s ASP 84 CO 0.20 -0.26 -0.05 -0.55 -0.17 0.00 0.00 175.17 174.34 1blb s SER 85 N 0.90 1.15 -0.08 -0.34 0.15 -1.26 -5.15 113.70 109.07 1blb s SER 85 Ca 0.30 -0.16 0.04 0.00 0.70 0.00 0.00 55.95 56.83 1blb s SER 85 Cb -0.09 -0.52 0.00 0.00 -1.71 0.00 0.00 66.02 63.70 1blb s SER 85 CO -0.09 -0.05 -0.21 0.00 1.20 0.00 0.00 173.24 174.09 1blb s GLN 86 N 0.96 2.57 0.00 5.44 1.03 -1.26 -5.12 119.66 123.28 1blb s GLN 86 Ca -0.10 -0.75 0.00 0.00 0.04 0.00 0.00 55.36 54.55 1blb s GLN 86 Cb -0.14 -2.01 0.00 0.00 0.03 0.00 0.00 33.01 30.89 1blb s GLN 86 CO 0.00 0.17 0.00 0.39 -2.54 0.00 0.00 175.29 173.31 1blb n GLU 87 N 3.51 0.56 -3.21 9.60 -0.58 -1.26 -5.05 120.64 124.21 1blb n GLU 87 Ca -0.20 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.31 1blb n GLU 87 Cb 0.53 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.33 1blb n GLU 87 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1blb n HIS 88 N -1.41 0.55 -2.35 -0.32 8.25 -1.26 -4.84 115.22 113.84 1blb n HIS 88 Ca 0.00 -3.72 -0.34 0.00 -0.26 0.00 0.00 57.72 53.40 1blb n HIS 88 Cb 0.00 -0.40 -0.01 0.00 1.12 0.00 0.00 29.99 30.70 1blb n HIS 88 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1blb s LYS 89 N -1.74 3.54 -0.16 -0.41 2.20 -1.26 -2.51 119.74 119.41 1blb s LYS 89 Ca 0.37 1.44 -0.12 0.00 -0.36 0.00 0.00 55.97 57.30 1blb s LYS 89 Cb 0.21 -2.05 0.05 0.00 -1.51 0.00 0.00 37.83 34.53 1blb s LYS 89 CO -0.09 -0.66 0.41 -1.50 -0.36 0.00 0.00 175.35 173.15 1blb s ILE 90 N -1.97 -0.01 -0.16 5.43 2.07 -1.12 -1.47 121.20 123.97 1blb s ILE 90 Ca 0.69 0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.97 1blb s ILE 90 Cb -0.19 -0.59 0.03 0.00 0.13 0.00 0.00 42.46 41.84 1blb s ILE 90 CO 0.25 0.01 -0.13 -0.89 -1.91 0.00 0.00 174.94 172.28 1blb s THR 91 N 0.64 1.57 -0.46 4.00 2.01 1.42 -0.48 115.64 124.34 1blb s THR 91 Ca -0.03 -0.73 -0.23 0.00 0.31 0.00 0.00 61.69 61.01 1blb s THR 91 Cb -0.05 -1.53 0.03 0.00 0.01 0.00 0.00 72.50 70.96 1blb s THR 91 CO -0.04 0.36 0.77 -0.76 -0.69 0.00 0.00 174.62 174.26 1blb s LEU 92 N 1.47 4.33 0.00 4.42 1.02 0.50 -1.13 118.68 129.29 1blb s LEU 92 Ca 0.03 -0.22 0.00 0.00 0.02 0.00 0.00 54.13 53.96 1blb s LEU 92 Cb -0.14 -2.88 0.00 0.00 0.02 0.00 0.00 46.19 43.19 1blb s LEU 92 CO -0.10 -0.92 0.00 -1.22 0.02 0.00 0.00 176.35 174.13 1blb n TYR 93 N 6.68 -1.29 -0.42 0.29 4.01 -0.86 0.12 117.16 125.68 1blb n TYR 93 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1blb n TYR 93 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1blb n TYR 93 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1blb n GLU 94 N -0.38 1.35 -3.89 -0.72 0.28 0.14 -3.69 120.64 113.73 1blb n GLU 94 Ca 0.00 -0.95 -0.09 0.00 -0.16 0.00 0.00 57.16 55.96 1blb n GLU 94 Cb 0.00 -0.79 -0.06 0.00 1.43 0.00 0.00 31.44 32.02 1blb n GLU 94 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1blb s ASN 95 N -0.48 -0.04 0.58 -1.84 0.02 0.07 -3.93 114.94 109.32 1blb s ASN 95 Ca 0.00 -0.74 -0.20 0.00 -1.02 0.00 0.00 52.86 50.90 1blb s ASN 95 Cb 0.00 0.46 -0.04 0.00 0.02 0.00 0.00 41.25 41.70 1blb s ASN 95 CO 0.00 -0.92 1.26 -2.84 0.02 0.00 0.00 177.10 174.62 1blb s PRO 96 N -3.93 3.02 -0.97 -0.60 0.02 -1.26 -3.00 135.00 128.28 1blb s PRO 96 Ca 0.14 1.98 -0.04 0.00 0.02 0.00 0.00 61.00 63.10 1blb s PRO 96 Cb 0.02 -2.05 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 1blb s PRO 96 CO -0.02 -1.21 0.84 0.09 -0.33 0.00 0.00 177.00 176.37 1blb n ASN 97 N -1.38 -5.15 -3.33 2.53 3.02 -0.73 -4.02 115.26 106.20 1blb n ASN 97 Ca 0.13 -0.61 -0.15 0.00 -0.03 0.00 0.00 54.58 53.91 1blb n ASN 97 Cb 0.48 -4.68 0.00 0.00 -0.61 0.00 0.00 39.78 34.97 1blb n ASN 97 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1blb n PHE 98 N -3.22 -0.89 -3.98 3.10 3.72 -1.23 -4.95 117.46 110.01 1blb n PHE 98 Ca -0.11 0.30 -0.08 0.00 -0.05 0.00 0.00 57.45 57.52 1blb n PHE 98 Cb 0.62 -1.32 -0.09 0.00 -0.94 0.00 0.00 39.48 37.75 1blb n PHE 98 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1blb s THR 99 N -2.93 0.18 0.00 4.37 2.01 -1.16 -4.98 115.64 113.12 1blb s THR 99 Ca 0.06 -1.47 0.00 0.00 0.31 0.00 0.00 61.69 60.59 1blb s THR 99 Cb -0.03 -1.37 0.00 0.00 0.01 0.00 0.00 72.50 71.10 1blb s THR 99 CO 0.44 -0.81 0.00 0.61 -0.69 0.00 0.00 174.62 174.17 1blb n GLY 100 N 0.12 -0.75 3.77 4.40 0.00 -1.26 -0.75 105.19 110.72 1blb n GLY 100 Ca -0.15 -1.82 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 1blb n GLY 100 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1blb s LYS 101 N 0.00 3.45 0.08 1.61 2.47 -1.26 -4.67 119.74 121.41 1blb s LYS 101 Ca 0.00 1.70 0.03 0.00 -1.56 0.00 0.00 55.97 56.15 1blb s LYS 101 Cb 0.00 -2.14 -0.03 0.00 -1.46 0.00 0.00 37.83 34.20 1blb s LYS 101 CO 0.00 -0.79 -0.10 -1.59 0.16 0.00 0.00 175.35 173.03 1blb s LYS 102 N -3.09 0.75 -0.27 4.03 -2.85 -1.26 -0.68 119.74 116.37 1blb s LYS 102 Ca 0.70 -1.03 0.03 0.00 -1.00 0.00 0.00 55.97 54.67 1blb s LYS 102 Cb -0.26 -0.46 0.07 0.00 -2.06 0.00 0.00 37.83 35.11 1blb s LYS 102 CO 0.31 0.07 -0.08 1.41 0.10 0.00 0.00 175.35 177.16 1blb s MET 103 N -2.42 2.07 -0.37 1.78 -2.45 0.32 -4.94 119.30 113.30 1blb s MET 103 Ca 0.01 -1.40 -0.16 0.00 -1.25 0.00 0.00 55.69 52.89 1blb s MET 103 Cb -0.05 -2.91 -0.00 0.00 1.25 0.00 0.00 34.83 33.12 1blb s MET 103 CO -0.00 -0.63 0.38 -1.83 1.05 0.00 0.00 175.02 173.99 1blb s GLU 104 N 1.10 3.41 -0.25 4.11 -1.05 -1.26 -0.37 118.70 124.39 1blb s GLU 104 Ca -0.06 -0.54 -0.13 0.00 -0.15 0.00 0.00 54.97 54.10 1blb s GLU 104 Cb -0.20 -3.86 -0.04 0.00 -0.44 0.00 0.00 34.13 29.59 1blb s GLU 104 CO -0.06 -0.62 0.27 0.08 0.95 0.00 0.00 175.26 175.88 1blb s VAL 105 N 2.03 5.27 -0.16 1.83 1.01 0.37 -4.96 120.40 125.78 1blb s VAL 105 Ca 0.11 0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.45 1blb s VAL 105 Cb -0.17 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1blb s VAL 105 CO 0.12 0.26 -0.04 -0.63 0.00 0.00 0.00 175.10 174.81 1blb s ILE 106 N 1.48 3.82 0.00 2.22 1.01 -1.26 -2.79 121.20 125.69 1blb s ILE 106 Ca 0.12 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.39 1blb s ILE 106 Cb -0.15 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.64 1blb s ILE 106 CO 0.08 0.48 0.00 0.47 0.00 0.00 0.00 174.94 175.97 1blb n ASP 306 N 3.68 0.00 -4.87 3.58 8.00 -1.04 -4.78 116.55 121.11 1blb n ASP 306 Ca -0.17 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.03 1blb n ASP 306 Cb 0.52 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.69 1blb n ASP 306 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1blb s ASP 107 N 0.00 5.10 0.41 -2.24 1.01 -1.26 -4.90 116.67 114.80 1blb s ASP 107 Ca 0.00 1.09 0.03 0.00 0.71 0.00 0.00 52.55 54.38 1blb s ASP 107 Cb 0.00 -1.82 -0.00 0.00 1.01 0.00 0.00 42.92 42.11 1blb s ASP 107 CO 0.00 -1.56 0.60 1.51 0.21 0.00 0.00 175.17 175.93 1blb s ASP 108 N -4.33 5.81 -0.07 0.27 1.47 -1.26 -4.80 116.67 113.77 1blb s ASP 108 Ca 0.59 0.03 0.01 0.00 1.18 0.00 0.00 52.55 54.36 1blb s ASP 108 Cb -0.12 -1.29 0.02 0.00 -0.34 0.00 0.00 42.92 41.19 1blb s ASP 108 CO 0.52 -0.65 -0.09 -0.69 0.68 0.00 0.00 175.17 174.94 1blb s VAL 109 N -2.42 0.91 -1.45 2.11 1.01 -0.20 -4.97 120.40 115.40 1blb s VAL 109 Ca 0.48 -0.32 0.13 0.00 0.00 0.00 0.00 61.98 62.27 1blb s VAL 109 Cb -0.10 -0.88 0.06 0.00 0.00 0.00 0.00 36.38 35.46 1blb s VAL 109 CO 0.35 0.31 0.84 -2.65 0.00 0.00 0.00 175.10 173.95 1blb n PRO 110 N 4.09 1.33 -3.15 2.72 -0.02 -1.26 -1.07 135.00 137.64 1blb n PRO 110 Ca -0.22 -1.03 0.04 0.00 -2.02 0.00 0.00 63.50 60.28 1blb n PRO 110 Cb 0.51 -1.22 -0.00 0.00 -0.02 0.00 0.00 33.50 32.77 1blb n PRO 110 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1blb s SER 111 N -1.33 -1.45 0.46 2.55 1.04 -1.26 0.20 113.70 113.91 1blb s SER 111 Ca 0.13 0.14 0.19 0.00 0.48 0.00 0.00 55.95 56.89 1blb s SER 111 Cb 0.11 1.91 1.10 0.00 0.10 0.00 0.00 66.02 69.24 1blb s SER 111 CO 0.24 -0.26 1.97 -0.26 0.98 0.00 0.00 173.24 175.91 1blb h PHE 112 N 7.84 0.00 0.16 5.02 -1.00 -1.43 -2.61 116.94 124.93 1blb h PHE 112 Ca -0.02 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 1blb h PHE 112 Cb 1.19 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.75 1blb h PHE 112 CO 0.20 0.21 -0.08 0.45 -1.61 0.00 0.00 178.31 177.47 1blb h HIS 113 N 0.00 -0.20 0.00 -0.55 3.86 -1.78 -0.62 115.15 115.85 1blb h HIS 113 Ca -0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1blb h HIS 113 Cb 0.43 0.07 -0.00 0.00 1.06 0.00 0.00 27.41 28.96 1blb h HIS 113 CO 0.00 0.03 -0.04 0.00 0.86 0.00 0.00 177.93 178.78 1blb h ALA 114 N 0.38 1.87 0.00 2.45 0.00 -1.80 0.02 119.26 122.17 1blb h ALA 114 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1blb h ALA 114 Cb 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1blb h ALA 114 CO 0.04 0.05 -0.11 0.45 0.00 0.00 0.00 179.25 179.68 1blb h HIS 116 N 0.00 0.00 0.00 0.00 -0.00 -1.13 -3.47 115.15 110.55 1blb h HIS 116 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1blb h HIS 116 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.48 1blb h HIS 116 CO 0.00 0.11 0.00 0.41 -0.00 0.00 0.00 177.93 178.45 1blb n GLY 117 N 0.86 2.29 3.63 2.45 0.00 -0.01 -5.06 105.19 109.37 1blb n GLY 117 Ca 0.03 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 1blb n GLY 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1blb s TYR 118 N -0.31 1.26 -0.12 1.61 5.04 -0.33 -4.71 117.35 119.80 1blb s TYR 118 Ca 0.00 0.01 0.07 0.00 -2.44 0.00 0.00 57.07 54.71 1blb s TYR 118 Cb 0.00 -4.10 -0.12 0.00 0.35 0.00 0.00 41.96 38.09 1blb s TYR 118 CO 0.00 -4.82 -0.02 0.94 -1.34 0.00 0.00 175.55 170.31 1blb n GLN 318 N 8.08 1.57 0.00 4.97 -0.06 -1.26 -2.95 117.38 127.72 1blb n GLN 318 Ca 0.24 0.02 0.00 0.00 -2.00 0.00 0.00 57.00 55.27 1blb n GLN 318 Cb 0.43 -1.28 0.00 0.00 -4.06 0.00 0.00 30.24 25.33 1blb n GLN 318 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 1blb n GLU 119 N -2.58 -0.16 -1.22 3.69 2.13 -1.26 -5.05 120.64 116.19 1blb n GLU 119 Ca -0.20 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.59 1blb n GLU 119 Cb 0.83 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.55 1blb n GLU 119 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1blb n LYS 120 N -0.93 0.94 -3.68 5.31 2.85 -1.26 -4.99 118.16 116.40 1blb n LYS 120 Ca 0.00 -0.36 -0.21 0.00 -1.05 0.00 0.00 58.31 56.69 1blb n LYS 120 Cb 0.00 -0.03 -0.18 0.00 -0.65 0.00 0.00 35.03 34.17 1blb n LYS 120 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1blb s VAL 121 N 0.56 -0.04 -0.19 0.58 1.01 0.14 -4.46 120.40 118.00 1blb s VAL 121 Ca 0.07 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.43 1blb s VAL 121 Cb -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.13 1blb s VAL 121 CO 0.04 0.16 0.21 -1.20 0.00 0.00 0.00 175.10 174.32 1blb n SER 122 N 5.28 0.35 -3.71 3.32 7.64 -1.24 -3.77 113.62 121.48 1blb n SER 122 Ca -0.04 -0.67 -0.11 0.00 1.01 0.00 0.00 58.87 59.05 1blb n SER 122 Cb 0.50 0.81 -0.11 0.00 -1.01 0.00 0.00 64.21 64.40 1blb n SER 122 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1blb s SER 123 N -1.09 -0.43 -0.11 6.43 0.01 -1.25 -0.58 113.70 116.69 1blb s SER 123 Ca 0.02 0.77 0.01 0.00 1.31 0.00 0.00 55.95 58.06 1blb s SER 123 Cb 0.02 0.68 -0.01 0.00 0.21 0.00 0.00 66.02 66.91 1blb s SER 123 CO 0.10 -0.17 -0.16 0.54 0.41 0.00 0.00 173.24 173.97 1blb s VAL 124 N 1.12 2.85 -0.35 3.43 0.11 -0.89 -2.04 120.40 124.63 1blb s VAL 124 Ca -0.08 -0.75 -0.07 0.00 -2.93 0.00 0.00 61.98 58.15 1blb s VAL 124 Cb -0.08 -2.16 0.04 0.00 -1.53 0.00 0.00 36.38 32.65 1blb s VAL 124 CO -0.09 0.54 0.14 -0.13 -3.33 0.00 0.00 175.10 172.23 1blb s ARG 125 N 0.14 2.64 -0.77 1.54 0.52 -0.28 0.89 118.95 123.61 1blb s ARG 125 Ca -0.08 -1.20 -0.13 0.00 -0.52 0.00 0.00 55.73 53.80 1blb s ARG 125 Cb -0.15 -3.54 0.20 0.00 0.52 0.00 0.00 34.95 31.98 1blb s ARG 125 CO 0.05 -0.71 0.70 0.08 0.02 0.00 0.00 175.30 175.45 1blb s VAL 126 N 1.42 5.38 0.00 3.52 1.01 -1.16 0.42 120.40 131.00 1blb s VAL 126 Ca -0.00 -2.40 -0.13 0.00 0.00 0.00 0.00 61.98 59.45 1blb s VAL 126 Cb -0.20 -4.35 -0.07 0.00 0.00 0.00 0.00 36.38 31.76 1blb s VAL 126 CO 0.03 -0.99 0.83 -0.61 0.00 0.00 0.00 175.10 174.36 1blb h GLN 127 N 7.84 -0.45 -4.28 2.72 4.15 -1.76 -3.28 115.11 120.04 1blb h GLN 127 Ca 0.05 0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.34 1blb h GLN 127 Cb 1.04 0.10 -0.14 0.00 0.21 0.00 0.00 27.48 28.69 1blb h GLN 127 CO 0.78 -0.30 -0.58 -1.54 -1.93 0.00 0.00 178.83 175.27 1blb s SER 128 N -3.54 0.27 0.00 -0.69 1.04 -0.55 -4.87 113.70 105.37 1blb s SER 128 Ca -0.07 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.26 1blb s SER 128 Cb 0.01 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1blb s SER 128 CO 0.20 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1blb n GLY 129 N -0.10 1.42 3.19 7.32 0.00 -1.26 -4.05 105.19 111.71 1blb n GLY 129 Ca -0.07 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 1blb n GLY 129 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1blb s THR 130 N -2.52 2.63 0.20 2.61 2.01 -1.26 -3.63 115.64 115.68 1blb s THR 130 Ca 0.00 -0.91 0.11 0.00 0.31 0.00 0.00 61.69 61.20 1blb s THR 130 Cb 0.00 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 1blb s THR 130 CO 0.00 0.36 -0.23 0.26 -0.69 0.00 0.00 174.62 174.33 1blb s TRP 131 N 1.33 2.21 -0.33 4.92 0.52 -0.96 0.82 118.94 127.45 1blb s TRP 131 Ca 0.03 -0.38 -0.01 0.00 0.02 0.00 0.00 56.10 55.76 1blb s TRP 131 Cb -0.15 -1.08 0.11 0.00 -1.15 0.00 0.00 33.47 31.20 1blb s TRP 131 CO -0.07 0.49 0.14 0.54 0.02 0.00 0.00 176.95 178.06 1blb s VAL 132 N -1.82 0.76 0.97 4.03 0.11 0.49 -1.17 120.40 123.78 1blb s VAL 132 Ca 0.21 -1.53 -0.12 0.00 -2.93 0.00 0.00 61.98 57.61 1blb s VAL 132 Cb -0.07 -1.57 0.17 0.00 -1.53 0.00 0.00 36.38 33.38 1blb s VAL 132 CO 0.10 -0.75 1.09 -0.83 -3.33 0.00 0.00 175.10 171.38 1blb s GLY 133 N 1.43 1.58 0.01 6.54 0.00 0.28 -3.54 107.32 113.62 1blb s GLY 133 Ca 0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 44.72 44.54 1blb s GLY 133 CO -0.20 0.33 0.09 -0.19 0.00 0.00 0.00 173.10 173.13 1blb s TYR 134 N -2.92 0.12 0.05 1.90 1.51 0.31 -1.73 117.35 116.58 1blb s TYR 134 Ca 0.65 -0.28 -0.22 0.00 -1.01 0.00 0.00 57.07 56.21 1blb s TYR 134 Cb -0.19 -0.10 -0.11 0.00 -0.11 0.00 0.00 41.96 41.46 1blb s TYR 134 CO 0.58 -0.28 1.33 0.37 -1.11 0.00 0.00 175.55 176.44 1blb h GLN 135 N 4.28 -0.63 0.00 -0.62 4.15 -1.48 1.36 115.11 122.16 1blb h GLN 135 Ca -0.31 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.15 1blb h GLN 135 Cb 1.20 0.14 0.00 0.00 0.21 0.00 0.00 27.48 29.03 1blb h GLN 135 CO 0.42 -0.42 0.00 0.66 -1.93 0.00 0.00 178.83 177.56 1blb n TYR 136 N -4.19 -0.15 -2.03 3.99 4.01 0.16 -2.77 117.16 116.17 1blb n TYR 136 Ca -0.08 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.47 1blb n TYR 136 Cb 0.29 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.44 1blb n TYR 136 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1blb n PRO 137 N -0.05 -0.49 -2.99 -0.72 -0.02 -1.26 -2.95 135.00 126.51 1blb n PRO 137 Ca 0.00 -1.70 -0.06 0.00 -2.02 0.00 0.00 63.50 59.73 1blb n PRO 137 Cb 0.00 -0.77 -0.01 0.00 -0.02 0.00 0.00 33.50 32.70 1blb n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1blb n GLY 138 N -0.97 -0.04 3.50 -1.23 0.00 0.54 -1.68 105.19 105.32 1blb n GLY 138 Ca 0.12 0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1blb n GLY 138 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1blb n TYR 139 N -1.61 -2.15 -3.89 1.61 4.01 -1.26 -5.04 117.16 108.83 1blb n TYR 139 Ca -0.05 0.62 -0.11 0.00 -0.16 0.00 0.00 57.90 58.21 1blb n TYR 139 Cb 0.11 -3.71 -0.12 0.00 -0.31 0.00 0.00 39.34 35.32 1blb n TYR 139 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1blb s ARG 140 N -5.29 0.27 0.00 -0.72 0.52 -0.68 -5.05 118.95 107.99 1blb s ARG 140 Ca 0.46 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.41 1blb s ARG 140 Cb -0.12 0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.45 1blb s ARG 140 CO 0.81 -0.05 0.00 0.41 0.02 0.00 0.00 175.30 176.49 1blb n GLY 141 N 2.15 0.09 3.82 -3.53 0.00 -1.26 0.39 105.19 106.84 1blb n GLY 141 Ca -0.19 -2.03 -0.32 0.00 0.00 0.00 0.00 46.02 43.48 1blb n GLY 141 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1blb s LEU 142 N 0.00 3.38 -0.07 0.99 1.02 -1.26 -4.75 118.68 117.99 1blb s LEU 142 Ca 0.00 1.71 0.02 0.00 0.02 0.00 0.00 54.13 55.88 1blb s LEU 142 Cb 0.00 -4.52 -0.03 0.00 0.02 0.00 0.00 46.19 41.67 1blb s LEU 142 CO 0.00 -1.19 -0.11 -1.10 0.02 0.00 0.00 176.35 173.97 1blb s GLN 143 N -4.45 2.72 -0.22 1.70 -0.21 -1.26 -1.92 119.66 116.02 1blb s GLN 143 Ca 0.61 -0.63 -0.00 0.00 0.02 0.00 0.00 55.36 55.36 1blb s GLN 143 Cb -0.14 -2.51 0.06 0.00 1.00 0.00 0.00 33.01 31.42 1blb s GLN 143 CO 0.43 0.59 -0.03 0.71 -2.12 0.00 0.00 175.29 174.87 1blb s TYR 144 N -0.63 1.98 -1.06 0.91 2.02 -0.70 -4.94 117.35 114.92 1blb s TYR 144 Ca 0.09 -1.45 -0.23 0.00 -0.37 0.00 0.00 57.07 55.11 1blb s TYR 144 Cb -0.11 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 40.02 1blb s TYR 144 CO 0.01 -0.72 1.78 -1.17 -1.57 0.00 0.00 175.55 173.89 1blb s LEU 145 N 1.54 3.33 -0.65 -1.29 2.96 -1.26 -0.56 118.68 122.75 1blb s LEU 145 Ca -0.04 -1.38 -0.25 0.00 -0.22 0.00 0.00 54.13 52.25 1blb s LEU 145 Cb -0.18 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 43.99 1blb s LEU 145 CO -0.07 -2.25 1.06 -0.76 -1.32 0.00 0.00 176.35 173.01 1blb s LEU 146 N 8.05 3.91 0.39 -0.68 2.01 -0.32 -4.97 118.68 127.07 1blb s LEU 146 Ca 0.61 -0.60 0.08 0.00 0.01 0.00 0.00 54.13 54.23 1blb s LEU 146 Cb -0.02 -2.62 -0.03 0.00 0.01 0.00 0.00 46.19 43.53 1blb s LEU 146 CO 0.01 -1.50 0.31 -1.83 1.01 0.00 0.00 176.35 174.36 1blb s GLU 147 N 4.56 2.53 -0.59 1.70 -1.05 -1.26 -2.27 118.70 122.32 1blb s GLU 147 Ca 0.29 -1.51 -0.33 0.00 -0.15 0.00 0.00 54.97 53.28 1blb s GLU 147 Cb -0.13 -2.34 -0.17 0.00 -0.44 0.00 0.00 34.13 31.05 1blb s GLU 147 CO 0.15 -0.08 2.00 1.17 0.95 0.00 0.00 175.26 179.45 1blb n LYS 148 N -1.43 0.00 0.00 -4.83 4.81 -1.24 -4.68 118.16 110.79 1blb n LYS 148 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1blb n LYS 148 Cb 0.61 -1.27 0.00 0.00 0.02 0.00 0.00 35.03 34.39 1blb n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1blb n GLY 149 N 6.02 1.04 3.15 3.14 0.00 -1.24 -5.07 105.19 112.23 1blb n GLY 149 Ca 0.50 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.36 1blb n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1blb s ASP 150 N 2.00 -1.36 -0.55 1.61 1.11 -1.26 -2.99 116.67 115.23 1blb s ASP 150 Ca 0.00 0.72 -0.27 0.00 0.18 0.00 0.00 52.55 53.18 1blb s ASP 150 Cb 0.00 2.09 0.03 0.00 1.07 0.00 0.00 42.92 46.11 1blb s ASP 150 CO 0.00 -0.25 1.08 -0.31 1.18 0.00 0.00 175.17 176.86 1blb s TYR 151 N 2.86 2.72 0.41 4.23 1.51 0.26 -4.88 117.35 124.46 1blb s TYR 151 Ca 0.18 0.29 0.15 0.00 -1.01 0.00 0.00 57.07 56.68 1blb s TYR 151 Cb -0.14 -4.31 0.93 0.00 -0.11 0.00 0.00 41.96 38.34 1blb s TYR 151 CO -0.21 -1.43 1.93 0.87 -1.11 0.00 0.00 175.55 175.59 1blb h LYS 152 N 9.39 0.00 -2.35 -0.62 1.57 -1.87 -2.36 116.57 120.34 1blb h LYS 152 Ca -0.25 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.45 1blb h LYS 152 Cb 1.06 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.15 1blb h LYS 152 CO 1.13 0.26 -0.05 0.34 -0.57 0.00 0.00 179.45 180.56 1blb s ASP 153 N -6.87 -0.61 0.01 0.86 2.15 -1.23 -1.77 116.67 109.20 1blb s ASP 153 Ca -0.03 1.16 -0.00 0.00 0.43 0.00 0.00 52.55 54.11 1blb s ASP 153 Cb 0.15 1.17 0.01 0.00 -0.30 0.00 0.00 42.92 43.95 1blb s ASP 153 CO 0.70 -0.20 0.04 -0.24 -0.17 0.00 0.00 175.17 175.30 1blb n SER 154 N 2.91 -0.01 0.01 -0.34 2.88 0.25 0.27 113.62 119.59 1blb n SER 154 Ca -0.14 0.05 -0.10 0.00 -1.33 0.00 0.00 58.87 57.35 1blb n SER 154 Cb 0.56 -0.01 -0.04 0.00 -0.75 0.00 0.00 64.21 63.97 1blb n SER 154 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1blb h GLY 155 N 0.00 -0.10 -0.47 0.46 0.00 -1.88 -0.97 103.07 100.11 1blb h GLY 155 Ca 0.01 0.17 0.17 0.00 0.00 0.00 0.00 47.33 47.69 1blb h GLY 155 CO -0.03 -0.14 0.29 1.22 0.00 0.00 0.00 176.54 177.88 1blb n ASP 156 N -5.28 0.09 -0.69 0.19 8.00 0.76 0.74 116.55 120.37 1blb n ASP 156 Ca -0.04 0.54 0.06 0.00 0.71 0.00 0.00 54.79 56.07 1blb n ASP 156 Cb 0.20 -0.27 0.17 0.00 -0.02 0.00 0.00 41.12 41.21 1blb n ASP 156 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1blb n PHE 157 N -3.52 0.00 -0.82 1.24 1.16 -1.17 -4.99 117.46 109.36 1blb n PHE 157 Ca 0.15 -1.28 0.00 0.00 -1.87 0.00 0.00 57.45 54.44 1blb n PHE 157 Cb 0.55 -0.22 0.00 0.00 -1.61 0.00 0.00 39.48 38.20 1blb n PHE 157 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1blb n GLY 158 N -0.89 0.87 3.70 4.97 0.00 0.23 -4.66 105.19 109.41 1blb n GLY 158 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1blb n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1blb s ALA 159 N -3.42 3.55 -0.85 4.61 0.00 -0.38 -4.87 121.76 120.41 1blb s ALA 159 Ca 0.00 0.96 0.22 0.00 0.00 0.00 0.00 51.96 53.14 1blb s ALA 159 Cb 0.00 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 1blb s ALA 159 CO 0.00 -0.73 0.97 -2.30 0.00 0.00 0.00 175.76 173.69 1blb n PRO 160 N 4.65 0.11 -4.05 0.00 -0.02 -1.26 -3.70 135.00 130.73 1blb n PRO 160 Ca 0.12 -0.02 -0.13 0.00 -2.02 0.00 0.00 63.50 61.45 1blb n PRO 160 Cb 0.44 -1.52 -0.13 0.00 -0.02 0.00 0.00 33.50 32.27 1blb n PRO 160 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1blb s GLN 161 N -3.08 0.38 -0.96 -0.52 -1.52 -1.26 -5.05 119.66 107.66 1blb s GLN 161 Ca 0.06 -0.45 -0.06 0.00 -1.95 0.00 0.00 55.36 52.96 1blb s GLN 161 Cb 0.16 -0.21 -0.01 0.00 -0.22 0.00 0.00 33.01 32.72 1blb s GLN 161 CO 0.83 0.04 2.84 -2.30 -0.25 0.00 0.00 175.29 176.46 1blb n PRO 162 N 2.17 3.41 -3.82 2.91 -0.02 -1.26 -4.82 135.00 133.57 1blb n PRO 162 Ca -0.18 -2.46 -0.29 0.00 -2.02 0.00 0.00 63.50 58.55 1blb n PRO 162 Cb 0.57 -2.44 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 1blb n PRO 162 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1blb s GLN 163 N -0.10 1.04 -0.17 -0.52 0.74 -1.25 0.26 119.66 119.66 1blb s GLN 163 Ca 0.61 -0.64 0.01 0.00 0.05 0.00 0.00 55.36 55.39 1blb s GLN 163 Cb 0.25 -2.29 0.02 0.00 1.10 0.00 0.00 33.01 32.09 1blb s GLN 163 CO -0.10 -0.62 -0.20 0.08 -0.55 0.00 0.00 175.29 173.90 1blb s VAL 164 N 1.68 2.03 -0.09 1.34 1.01 -1.26 -4.39 120.40 120.71 1blb s VAL 164 Ca -0.03 -0.93 0.14 0.00 0.00 0.00 0.00 61.98 61.17 1blb s VAL 164 Cb -0.18 -1.83 -0.20 0.00 0.00 0.00 0.00 36.38 34.17 1blb s VAL 164 CO -0.07 0.54 0.17 0.00 0.00 0.00 0.00 175.10 175.73 1blb n GLN 165 N 4.54 1.16 -3.68 2.72 6.02 0.47 -4.81 117.38 123.80 1blb n GLN 165 Ca -0.21 -0.06 -0.14 0.00 -0.01 0.00 0.00 57.00 56.58 1blb n GLN 165 Cb 0.50 -1.37 -0.08 0.00 1.02 0.00 0.00 30.24 30.31 1blb n GLN 165 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1blb s SER 166 N -4.38 -0.55 0.31 1.08 0.01 -1.09 -1.17 113.70 107.91 1blb s SER 166 Ca -0.07 0.98 0.05 0.00 1.31 0.00 0.00 55.95 58.23 1blb s SER 166 Cb 0.07 1.00 -0.06 0.00 0.21 0.00 0.00 66.02 67.23 1blb s SER 166 CO 0.62 -0.25 0.01 0.54 0.41 0.00 0.00 173.24 174.57 1blb s VAL 167 N 0.03 1.45 -0.06 3.43 0.11 -0.23 0.11 120.40 125.23 1blb s VAL 167 Ca -0.02 -2.05 -0.31 0.00 -2.93 0.00 0.00 61.98 56.68 1blb s VAL 167 Cb -0.04 -2.68 0.07 0.00 -1.53 0.00 0.00 36.38 32.21 1blb s VAL 167 CO 0.02 -0.12 0.69 0.00 -3.33 0.00 0.00 175.10 172.35 1blb s ARG 168 N -3.81 1.04 0.11 1.54 1.70 -1.23 -1.03 118.95 117.26 1blb s ARG 168 Ca 0.33 0.30 0.05 0.00 -0.47 0.00 0.00 55.73 55.94 1blb s ARG 168 Cb 0.07 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.90 1blb s ARG 168 CO 0.14 -0.32 0.02 0.50 -1.08 0.00 0.00 175.30 174.57 1blb s ARG 169 N -1.10 2.60 -0.09 3.89 3.52 -1.26 -0.38 118.95 126.13 1blb s ARG 169 Ca -0.10 -0.86 -0.10 0.00 -0.13 0.00 0.00 55.73 54.54 1blb s ARG 169 Cb -0.00 -2.55 -0.05 0.00 -1.56 0.00 0.00 34.95 30.79 1blb s ARG 169 CO 0.09 0.53 0.25 0.42 -0.81 0.00 0.00 175.30 175.78 1blb s ILE 170 N -1.41 5.32 0.00 4.11 -1.09 0.24 -4.92 121.20 123.45 1blb s ILE 170 Ca 0.27 0.46 0.18 0.00 -2.23 0.00 0.00 60.65 59.33 1blb s ILE 170 Cb -0.11 -3.53 0.30 0.00 -1.58 0.00 0.00 42.46 37.53 1blb s ILE 170 CO 0.19 0.58 1.11 -2.11 -1.23 0.00 0.00 174.94 173.48 1blb n ARG 171 N 2.15 0.00 -4.32 2.79 1.85 -1.26 -4.51 116.66 113.36 1blb n ARG 171 Ca -0.17 -1.67 -0.17 0.00 -1.00 0.00 0.00 57.85 54.84 1blb n ARG 171 Cb 0.54 -0.09 -0.10 0.00 -1.05 0.00 0.00 32.46 31.76 1blb n ARG 171 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1blb s ASP 172 N -1.67 2.28 -0.26 2.89 1.01 -1.26 -5.14 116.67 114.52 1blb s ASP 172 Ca 0.23 -1.03 -0.23 0.00 0.71 0.00 0.00 52.55 52.23 1blb s ASP 172 Cb 0.27 -0.09 0.07 0.00 1.01 0.00 0.00 42.92 44.18 1blb s ASP 172 CO -0.12 -0.25 0.69 -0.04 0.21 0.00 0.00 175.17 175.67 1blb s MET 173 N -3.69 0.79 -0.27 8.23 -1.94 -1.26 -5.03 119.30 116.13 1blb s MET 173 Ca 0.21 1.01 0.08 0.00 -1.71 0.00 0.00 55.69 55.28 1blb s MET 173 Cb 0.01 0.35 0.45 0.00 2.01 0.00 0.00 34.83 37.65 1blb s MET 173 CO 0.05 -0.11 1.20 1.04 -0.01 0.00 0.00 175.02 177.20 1blb n GLN 174 N 2.98 2.99 0.00 2.03 3.00 -1.26 -5.35 117.38 121.77 1blb n GLN 174 Ca -0.15 -3.90 0.00 0.00 -0.01 0.00 0.00 57.00 52.94 1blb n GLN 174 Cb 0.56 -2.08 0.00 0.00 0.00 0.00 0.00 30.24 28.72 1blb n GLN 174 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.06 174.39