#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blb s PRO -5 N 0.00 4.76 -0.57 1.97 0.01 -1.26 -5.01 135.00 134.90 1blb s PRO -5 Ca 0.00 1.42 -0.21 0.00 0.01 0.00 0.00 61.00 62.22 1blb s PRO -5 Cb 0.00 -3.31 0.07 0.00 0.01 0.00 0.00 34.50 31.27 1blb s PRO -5 CO 0.00 0.42 0.79 -1.14 0.01 0.00 0.00 177.00 177.08 1blb s GLN -4 N -0.77 3.14 0.32 5.54 -0.44 -1.26 -5.05 119.66 121.14 1blb s GLN -4 Ca 0.42 -0.86 -0.25 0.00 -2.50 0.00 0.00 55.36 52.17 1blb s GLN -4 Cb -0.25 -4.16 -0.15 0.00 -1.64 0.00 0.00 33.01 26.81 1blb s GLN -4 CO 0.30 -1.50 0.45 -0.35 0.50 0.00 0.00 175.29 174.69 1blb n PRO -3 N 6.84 0.27 -0.39 1.67 -0.05 -1.26 -4.90 135.00 137.18 1blb n PRO -3 Ca -0.05 0.10 0.09 0.00 -0.05 0.00 0.00 63.50 63.58 1blb n PRO -3 Cb 0.45 -1.20 0.27 0.00 -0.05 0.00 0.00 33.50 32.97 1blb n PRO -3 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 1blb n LEU -2 N 1.86 3.84 -3.59 1.53 4.32 -1.26 -4.98 117.00 118.73 1blb n LEU -2 Ca 0.14 -2.25 -0.05 0.00 -0.02 0.00 0.00 56.01 53.83 1blb n LEU -2 Cb 0.33 -0.43 -0.02 0.00 -1.62 0.00 0.00 43.42 41.68 1blb n LEU -2 CO 0.56 0.82 0.89 0.54 -1.22 0.00 0.00 177.39 178.97 1blb s ASN -1 N -1.08 -0.20 0.61 -1.43 4.22 -1.26 -5.16 114.94 110.64 1blb s ASN -1 Ca 0.40 -0.06 -0.18 0.00 -2.14 0.00 0.00 52.86 50.88 1blb s ASN -1 Cb 0.24 0.25 -0.05 0.00 1.28 0.00 0.00 41.25 42.98 1blb s ASN -1 CO 0.22 -0.43 0.95 -0.81 -2.04 0.00 0.00 177.10 174.99 1blb n PRO 1 N -0.23 0.86 -4.19 3.55 -0.05 -1.26 -4.96 135.00 128.72 1blb n PRO 1 Ca -0.04 0.34 -0.12 0.00 -0.05 0.00 0.00 63.50 63.62 1blb n PRO 1 Cb 0.60 -2.16 -0.10 0.00 -0.05 0.00 0.00 33.50 31.79 1blb n PRO 1 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 175.50 175.60 1blb s LYS 2 N -2.77 0.90 0.00 0.54 -0.14 -0.60 -4.56 119.74 113.11 1blb s LYS 2 Ca 0.76 -1.35 0.00 0.00 -1.36 0.00 0.00 55.97 54.02 1blb s LYS 2 Cb -0.41 -0.36 0.00 0.00 -1.68 0.00 0.00 37.83 35.38 1blb s LYS 2 CO 0.47 0.02 0.00 1.51 -0.76 0.00 0.00 175.35 176.59 1blb n ILE 3 N -0.02 0.00 -3.19 2.17 3.06 -1.11 -3.90 119.36 116.37 1blb n ILE 3 Ca -0.12 0.00 -0.40 0.00 -2.50 0.00 0.00 62.75 59.73 1blb n ILE 3 Cb 0.60 0.00 -0.01 0.00 0.54 0.00 0.00 39.64 40.77 1blb n ILE 3 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 1blb n ILE 4 N 0.00 4.53 -1.67 9.51 -0.00 0.47 -0.90 119.36 131.30 1blb n ILE 4 Ca 0.00 -5.66 -0.46 0.00 -0.00 0.00 0.00 62.75 56.63 1blb n ILE 4 Cb 0.00 -2.19 -0.04 0.00 -0.00 0.00 0.00 39.64 37.40 1blb n ILE 4 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1blb n ILE 5 N 1.56 0.14 -1.23 1.39 5.41 -1.06 -3.87 119.36 121.71 1blb n ILE 5 Ca 0.26 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.98 1blb n ILE 5 Cb 0.36 -1.64 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 1blb n ILE 5 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1blb n PHE 6 N 4.21 -1.16 0.00 1.39 3.01 -0.86 -2.18 117.46 121.87 1blb n PHE 6 Ca 0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.64 1blb n PHE 6 Cb 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.76 1blb n PHE 6 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1blb n GLU 7 N -0.33 0.00 -1.68 -1.08 0.00 -1.23 -2.74 120.64 113.59 1blb n GLU 7 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 57.16 56.70 1blb n GLU 7 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.40 1blb n GLU 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1blb n GLN 8 N 0.00 2.33 -1.72 3.44 6.02 -0.95 -4.06 117.38 122.44 1blb n GLN 8 Ca 0.00 0.85 -0.37 0.00 -0.01 0.00 0.00 57.00 57.46 1blb n GLN 8 Cb 0.00 -2.67 0.07 0.00 1.02 0.00 0.00 30.24 28.66 1blb n GLN 8 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1blb n GLU 9 N 4.85 1.16 -0.63 -1.09 -0.00 -1.26 -1.33 120.64 122.34 1blb n GLU 9 Ca 0.19 0.45 0.00 0.00 -0.00 0.00 0.00 57.16 57.80 1blb n GLU 9 Cb 0.31 -2.51 0.00 0.00 -0.00 0.00 0.00 31.44 29.25 1blb n GLU 9 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1blb n ASN 10 N -1.70 -1.89 -0.86 -1.84 4.05 -0.98 -3.82 115.26 108.22 1blb n ASN 10 Ca 0.15 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 55.07 1blb n ASN 10 Cb 0.48 -0.32 -0.05 0.00 1.23 0.00 0.00 39.78 41.12 1blb n ASN 10 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1blb n PHE 11 N -2.63 0.00 -2.99 1.20 3.72 -1.17 -4.96 117.46 110.63 1blb n PHE 11 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 1blb n PHE 11 Cb 0.00 -2.17 -0.05 0.00 -0.94 0.00 0.00 39.48 36.32 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 -2.87 4.22 1.43 -1.08 -0.21 -0.44 -4.87 119.66 115.84 1blb s GLN 12 Ca 0.00 0.81 0.00 0.00 0.02 0.00 0.00 55.36 56.19 1blb s GLN 12 Cb 0.00 -3.60 0.00 0.00 1.00 0.00 0.00 33.01 30.41 1blb s GLN 12 CO 0.00 -0.36 0.00 0.41 -2.12 0.00 0.00 175.29 173.22 1blb n GLY 13 N 3.73 0.84 3.46 3.09 0.00 -1.26 -2.24 105.19 112.81 1blb n GLY 13 Ca 0.02 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1blb n GLY 13 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1blb n HIS 14 N 3.78 0.03 -4.39 1.61 -0.00 -1.26 -4.94 115.22 110.05 1blb n HIS 14 Ca 0.00 -0.52 -0.25 0.00 0.46 0.00 0.00 57.72 57.41 1blb n HIS 14 Cb 0.00 -0.76 -0.10 0.00 -0.12 0.00 0.00 29.99 29.02 1blb n HIS 14 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 1blb s SER 15 N 6.82 3.88 -0.08 0.26 1.04 -1.26 -3.47 113.70 120.89 1blb s SER 15 Ca 0.64 -0.83 0.05 0.00 0.48 0.00 0.00 55.95 56.28 1blb s SER 15 Cb 0.14 -0.48 -0.01 0.00 0.10 0.00 0.00 66.02 65.77 1blb s SER 15 CO 0.32 0.06 -0.23 -2.28 0.98 0.00 0.00 173.24 172.09 1blb s HIS 16 N -2.16 2.53 -0.17 5.02 5.65 -0.93 -4.98 115.29 120.25 1blb s HIS 16 Ca 0.28 -0.84 -0.17 0.00 0.25 0.00 0.00 55.06 54.58 1blb s HIS 16 Cb -0.07 -1.67 -0.04 0.00 -1.18 0.00 0.00 32.58 29.63 1blb s HIS 16 CO 0.15 -0.29 0.43 -2.00 -0.65 0.00 0.00 174.74 172.38 1blb s GLU 17 N 0.07 4.24 -0.12 2.88 2.12 -1.26 -2.57 118.70 124.07 1blb s GLU 17 Ca -0.10 0.31 -0.02 0.00 0.36 0.00 0.00 54.97 55.52 1blb s GLU 17 Cb -0.16 -3.50 -0.03 0.00 0.26 0.00 0.00 34.13 30.71 1blb s GLU 17 CO 0.06 0.03 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.59 1blb s LEU 18 N 1.06 3.17 -0.09 2.70 0.20 -0.08 -4.97 118.68 120.67 1blb s LEU 18 Ca 0.22 -0.10 0.13 0.00 0.69 0.00 0.00 54.13 55.06 1blb s LEU 18 Cb -0.15 -1.73 0.28 0.00 -0.43 0.00 0.00 46.19 44.17 1blb s LEU 18 CO 0.08 0.25 1.20 0.59 -0.29 0.00 0.00 176.35 178.18 1blb n ASN 19 N 3.00 2.75 0.00 3.68 3.02 -1.26 -2.77 115.26 123.68 1blb n ASN 19 Ca -0.18 -2.63 0.00 0.00 -0.03 0.00 0.00 54.58 51.74 1blb n ASN 19 Cb 0.53 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 1blb n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1blb n GLY 20 N -0.66 -0.54 3.40 7.41 0.00 -1.26 -4.44 105.19 109.09 1blb n GLY 20 Ca 0.13 -0.95 -0.44 0.00 0.00 0.00 0.00 46.02 44.75 1blb n GLY 20 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1blb n PRO 21 N -0.04 0.28 -3.22 1.61 -0.01 -1.26 -4.78 135.00 127.58 1blb n PRO 21 Ca 0.00 0.10 -0.04 0.00 -0.01 0.00 0.00 63.50 63.55 1blb n PRO 21 Cb 0.00 -1.22 -0.03 0.00 -0.01 0.00 0.00 33.50 32.25 1blb n PRO 21 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1blb n PRO 23 N 4.23 0.49 -3.86 0.00 -0.02 -1.26 -2.22 135.00 132.37 1blb n PRO 23 Ca 0.12 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.64 1blb n PRO 23 Cb 0.54 -1.25 0.01 0.00 -0.02 0.00 0.00 33.50 32.77 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 0.82 -0.00 0.00 2.55 3.84 -0.95 -1.32 114.94 119.88 1blb s ASN 24 Ca 0.00 -0.04 0.00 0.00 0.21 0.00 0.00 52.86 53.03 1blb s ASN 24 Cb 0.00 0.03 0.00 0.00 -0.55 0.00 0.00 41.25 40.73 1blb s ASN 24 CO 0.00 -0.07 0.25 0.18 -2.79 0.00 0.00 177.10 174.67 1blb n LEU 25 N -0.79 0.00 -0.02 3.21 4.77 -1.26 -4.81 117.00 118.09 1blb n LEU 25 Ca 0.00 -0.17 -0.22 0.00 -0.03 0.00 0.00 56.01 55.60 1blb n LEU 25 Cb 0.60 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.56 1blb n LEU 25 CO 0.13 0.19 -0.63 0.50 -1.33 0.00 0.00 177.39 176.24 1blb h LYS 26 N 0.00 0.19 -3.55 3.23 3.64 -1.79 -3.27 116.57 115.01 1blb h LYS 26 Ca 0.00 -0.32 -0.65 0.00 -1.27 0.00 0.00 60.65 58.41 1blb h LYS 26 Cb 0.92 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1blb h LYS 26 CO 0.00 1.15 3.33 -0.85 -2.27 0.00 0.00 179.45 180.81 1blb n GLU 27 N -3.87 3.02 -3.54 1.90 0.00 -1.26 -4.48 120.64 112.42 1blb n GLU 27 Ca -0.30 -2.24 -0.17 0.00 0.00 0.00 0.00 57.16 54.44 1blb n GLU 27 Cb 0.91 -2.96 -0.06 0.00 0.00 0.00 0.00 31.44 29.33 1blb n GLU 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1blb s THR 28 N 2.93 0.00 0.44 3.84 2.01 -1.25 -4.97 115.64 118.64 1blb s THR 28 Ca 0.57 -0.00 0.20 0.00 0.31 0.00 0.00 61.69 62.77 1blb s THR 28 Cb 0.15 -1.00 0.40 0.00 0.01 0.00 0.00 72.50 72.07 1blb s THR 28 CO -0.05 -0.00 1.84 1.23 -0.69 0.00 0.00 174.62 176.95 1blb h GLY 328 N 3.31 0.78 -1.92 4.40 0.00 -1.85 -3.40 103.07 104.39 1blb h GLY 328 Ca -0.27 -0.16 -0.45 0.00 0.00 0.00 0.00 47.33 46.45 1blb h GLY 328 CO 0.34 -0.03 -0.03 0.54 0.00 0.00 0.00 176.54 177.36 1blb s VAL 29 N -5.36 3.16 0.06 4.60 0.11 -1.26 -5.02 120.40 116.70 1blb s VAL 29 Ca -0.08 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.42 1blb s VAL 29 Cb 0.23 -3.19 -0.00 0.00 -1.53 0.00 0.00 36.38 31.89 1blb s VAL 29 CO 0.79 -0.14 -0.01 -0.62 -3.33 0.00 0.00 175.10 171.78 1blb n GLU 30 N -2.30 0.02 -4.18 1.54 1.02 -1.23 -3.97 120.64 111.54 1blb n GLU 30 Ca 0.05 0.01 -0.35 0.00 -0.02 0.00 0.00 57.16 56.86 1blb n GLU 30 Cb 0.59 -0.42 -0.10 0.00 -0.02 0.00 0.00 31.44 31.49 1blb n GLU 30 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1blb s LYS 31 N -1.79 3.52 -0.83 3.49 2.20 -1.26 -4.51 119.74 120.56 1blb s LYS 31 Ca -0.01 -0.37 -0.22 0.00 -0.36 0.00 0.00 55.97 55.01 1blb s LYS 31 Cb 0.00 -3.02 -0.20 0.00 -1.51 0.00 0.00 37.83 33.11 1blb s LYS 31 CO 0.02 0.48 2.39 0.00 -0.36 0.00 0.00 175.35 177.87 1blb n ALA 32 N 2.86 0.65 -1.00 3.13 0.00 -1.26 -4.82 120.51 120.07 1blb n ALA 32 Ca -0.18 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1blb n ALA 32 Cb 0.53 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 17.13 1blb n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1blb n GLY 33 N 6.22 -1.86 0.28 0.00 0.00 -1.11 -4.76 105.19 103.96 1blb n GLY 33 Ca 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.54 1blb n GLY 33 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1blb n SER 34 N -0.42 0.75 -3.79 1.61 7.64 -1.26 -4.28 113.62 113.88 1blb n SER 34 Ca 0.00 -1.18 -0.13 0.00 1.01 0.00 0.00 58.87 58.57 1blb n SER 34 Cb 0.00 0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.16 1blb n SER 34 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1blb s VAL 35 N -1.75 -0.02 -0.19 0.44 1.01 -0.65 -2.02 120.40 117.21 1blb s VAL 35 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.10 1blb s VAL 35 Cb 0.00 -0.20 0.03 0.00 0.00 0.00 0.00 36.38 36.21 1blb s VAL 35 CO 0.01 0.03 -0.16 -0.22 0.00 0.00 0.00 175.10 174.77 1blb s LEU 36 N 0.57 2.29 -0.25 3.92 0.20 -1.25 -0.58 118.68 123.58 1blb s LEU 36 Ca -0.04 -0.79 -0.06 0.00 0.69 0.00 0.00 54.13 53.94 1blb s LEU 36 Cb -0.06 -1.39 -0.01 0.00 -0.43 0.00 0.00 46.19 44.30 1blb s LEU 36 CO -0.03 -0.07 0.03 -0.69 -0.29 0.00 0.00 176.35 175.30 1blb s VAL 37 N 1.31 3.78 -1.68 1.68 1.01 -1.15 -0.39 120.40 124.97 1blb s VAL 37 Ca 0.02 -0.50 0.18 0.00 0.00 0.00 0.00 61.98 61.68 1blb s VAL 37 Cb -0.15 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 1blb s VAL 37 CO -0.10 0.28 0.94 0.00 0.00 0.00 0.00 175.10 176.21 1blb n GLN 38 N 4.85 1.51 -3.18 2.72 6.02 -1.25 -3.05 117.38 124.99 1blb n GLN 38 Ca -0.16 -0.87 0.05 0.00 -0.01 0.00 0.00 57.00 56.00 1blb n GLN 38 Cb 0.50 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 30.38 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 -2.11 -3.54 0.00 -1.58 0.00 -1.25 -4.88 121.76 108.40 1blb s ALA 39 Ca 0.15 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.62 1blb s ALA 39 Cb 0.15 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.80 1blb s ALA 39 CO 0.47 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 175.33 1blb n GLY 40 N 5.19 5.26 3.93 0.00 0.00 -1.26 -1.55 105.19 116.75 1blb n GLY 40 Ca -0.08 -1.49 -0.27 0.00 0.00 0.00 0.00 46.02 44.18 1blb n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1blb s PRO 41 N 2.92 1.79 0.08 1.61 0.04 -1.26 -4.95 135.00 135.23 1blb s PRO 41 Ca 0.00 -0.25 0.03 0.00 0.04 0.00 0.00 61.00 60.82 1blb s PRO 41 Cb 0.00 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1blb s PRO 41 CO 0.00 -1.59 -0.09 -1.58 0.04 0.00 0.00 177.00 173.79 1blb s TRP 42 N -3.46 0.92 -0.13 0.56 0.52 -1.02 -1.00 118.94 115.33 1blb s TRP 42 Ca 0.64 -0.67 0.03 0.00 0.02 0.00 0.00 56.10 56.11 1blb s TRP 42 Cb -0.09 -0.52 0.01 0.00 -1.15 0.00 0.00 33.47 31.72 1blb s TRP 42 CO 0.47 -0.06 -0.22 0.54 0.02 0.00 0.00 176.95 177.70 1blb s VAL 43 N -2.42 2.04 0.00 4.03 0.11 0.06 -2.23 120.40 121.99 1blb s VAL 43 Ca 0.03 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 1blb s VAL 43 Cb -0.03 -1.79 0.00 0.00 -1.53 0.00 0.00 36.38 33.03 1blb s VAL 43 CO -0.01 0.55 0.00 0.61 -3.33 0.00 0.00 175.10 172.92 1blb n GLY 44 N 3.94 0.35 3.57 6.54 0.00 0.14 -2.43 105.19 117.30 1blb n GLY 44 Ca -0.20 -1.78 -0.07 0.00 0.00 0.00 0.00 46.02 43.97 1blb n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1blb s TYR 45 N 0.80 -0.24 -0.14 1.61 2.02 -1.16 -4.24 117.35 116.01 1blb s TYR 45 Ca 0.00 0.25 0.18 0.00 -0.37 0.00 0.00 57.07 57.13 1blb s TYR 45 Cb 0.00 0.50 -0.24 0.00 -0.40 0.00 0.00 41.96 41.82 1blb s TYR 45 CO 0.00 -0.32 0.34 -0.85 -1.57 0.00 0.00 175.55 173.15 1blb n GLU 46 N 0.12 0.67 -3.92 -0.62 0.28 -1.17 -1.75 120.64 114.25 1blb n GLU 46 Ca -0.05 0.04 -0.35 0.00 -0.16 0.00 0.00 57.16 56.64 1blb n GLU 46 Cb 0.59 -1.60 -0.14 0.00 1.43 0.00 0.00 31.44 31.72 1blb n GLU 46 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 1blb s GLN 47 N -2.75 3.42 0.55 3.44 -0.21 0.29 -4.45 119.66 119.95 1blb s GLN 47 Ca -0.08 -0.60 -0.02 0.00 0.02 0.00 0.00 55.36 54.68 1blb s GLN 47 Cb 0.08 -3.04 0.02 0.00 1.00 0.00 0.00 33.01 31.08 1blb s GLN 47 CO 0.84 -0.17 0.05 0.00 -2.12 0.00 0.00 175.29 173.89 1blb n ALA 48 N 4.75 -0.33 -0.96 6.09 0.00 -1.26 0.61 120.51 129.40 1blb n ALA 48 Ca -0.18 -0.10 -0.05 0.00 0.00 0.00 0.00 53.44 53.11 1blb n ALA 48 Cb 0.51 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 1blb n ALA 48 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1blb n ASN 49 N 2.37 -2.19 -0.05 0.00 5.15 -0.43 -2.77 115.26 117.34 1blb n ASN 49 Ca 0.01 0.14 -0.00 0.00 -0.60 0.00 0.00 54.58 54.12 1blb n ASN 49 Cb 0.04 -2.02 -0.00 0.00 -0.53 0.00 0.00 39.78 37.27 1blb n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1blb s LYS 51 N -3.17 1.70 0.00 0.00 -0.14 0.20 -4.93 119.74 113.40 1blb s LYS 51 Ca 0.00 -1.91 0.00 0.00 -1.36 0.00 0.00 55.97 52.70 1blb s LYS 51 Cb 0.00 -1.22 0.00 0.00 -1.68 0.00 0.00 37.83 34.93 1blb s LYS 51 CO 0.00 -0.04 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 1blb n GLY 52 N -0.72 -0.24 3.55 -3.33 0.00 -1.26 0.10 105.19 103.29 1blb n GLY 52 Ca -0.04 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.35 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 3.38 0.83 1.61 2.12 -1.26 -4.71 118.70 120.67 1blb s GLU 53 Ca 0.00 -0.04 -0.13 0.00 0.36 0.00 0.00 54.97 55.16 1blb s GLU 53 Cb 0.00 -4.07 0.19 0.00 0.26 0.00 0.00 34.13 30.51 1blb s GLU 53 CO 0.00 -1.72 1.14 0.00 -0.54 0.00 0.00 175.26 174.14 1blb n GLN 54 N 8.30 -1.02 -3.53 4.30 10.64 -1.26 -3.03 117.38 131.78 1blb n GLN 54 Ca 0.05 -1.87 -0.18 0.00 -1.83 0.00 0.00 57.00 53.17 1blb n GLN 54 Cb 0.48 -1.13 -0.06 0.00 -0.86 0.00 0.00 30.24 28.67 1blb n GLN 54 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 1blb s PHE 55 N -3.45 -0.66 -0.39 2.61 0.40 -1.26 -4.88 117.98 110.35 1blb s PHE 55 Ca 0.65 1.16 -0.07 0.00 -0.60 0.00 0.00 56.93 58.06 1blb s PHE 55 Cb -0.02 0.40 0.07 0.00 0.51 0.00 0.00 43.02 43.98 1blb s PHE 55 CO 0.46 -0.60 0.20 0.08 0.70 0.00 0.00 175.22 176.06 1blb s VAL 56 N -1.12 3.95 0.17 -0.44 1.01 -1.26 -0.68 120.40 122.03 1blb s VAL 56 Ca -0.11 -1.40 -0.13 0.00 0.00 0.00 0.00 61.98 60.35 1blb s VAL 56 Cb -0.00 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.91 1blb s VAL 56 CO 0.09 -0.42 0.56 -0.36 0.00 0.00 0.00 175.10 174.97 1blb s PHE 57 N 1.38 3.56 0.03 5.22 0.40 -0.95 -5.01 117.98 122.61 1blb s PHE 57 Ca 0.02 1.03 -0.01 0.00 -0.60 0.00 0.00 56.93 57.37 1blb s PHE 57 Cb -0.22 -2.35 -0.02 0.00 0.51 0.00 0.00 43.02 40.94 1blb s PHE 57 CO 0.01 0.38 -0.01 -1.83 0.70 0.00 0.00 175.22 174.48 1blb s GLU 58 N -2.17 0.39 0.01 0.44 -1.05 -1.26 -2.43 118.70 112.62 1blb s GLU 58 Ca 0.40 -0.71 -0.09 0.00 -0.15 0.00 0.00 54.97 54.43 1blb s GLU 58 Cb -0.14 0.14 -0.04 0.00 -0.44 0.00 0.00 34.13 33.64 1blb s GLU 58 CO 0.20 -0.07 0.22 1.17 0.95 0.00 0.00 175.26 177.73 1blb n LYS 59 N 1.29 0.00 0.00 -4.83 4.81 -1.26 -4.76 118.16 113.41 1blb n LYS 59 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.22 1blb n LYS 59 Cb 0.56 -0.32 0.00 0.00 0.02 0.00 0.00 35.03 35.29 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 0.37 0.98 3.56 3.14 0.00 -1.17 -5.00 105.19 107.07 1blb n GLY 60 Ca 0.05 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.70 2.85 -0.74 1.61 2.02 -1.26 -2.93 118.70 118.54 1blb s GLU 61 Ca 0.00 -0.56 0.04 0.00 0.02 0.00 0.00 54.97 54.47 1blb s GLU 61 Cb 0.00 -2.61 0.18 0.00 0.10 0.00 0.00 34.13 31.79 1blb s GLU 61 CO 0.00 0.61 0.55 0.71 0.02 0.00 0.00 175.26 177.15 1blb s TYR 62 N -0.65 3.65 0.24 1.61 2.02 0.25 -5.02 117.35 119.45 1blb s TYR 62 Ca 0.10 -3.29 0.24 0.00 -0.37 0.00 0.00 57.07 53.74 1blb s TYR 62 Cb -0.11 -2.81 1.28 0.00 -0.40 0.00 0.00 41.96 39.92 1blb s TYR 62 CO 0.02 -0.58 1.69 -1.35 -1.57 0.00 0.00 175.55 173.76 1blb h PRO 63 N 5.48 0.00 0.00 -1.71 0.11 -1.92 -1.72 132.00 132.24 1blb h PRO 63 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1blb h PRO 63 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1blb h PRO 63 CO 0.75 0.00 0.00 2.89 -0.21 0.00 0.00 178.00 181.43 1blb n ARG 64 N -2.47 0.00 0.00 1.05 1.85 -1.26 -2.31 116.66 113.52 1blb n ARG 64 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 1blb n ARG 64 Cb 0.25 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.66 1blb n ARG 64 CO 0.00 0.00 0.00 -2.67 -0.01 0.00 0.00 177.63 174.95 1blb n TRP 65 N -0.17 0.00 -0.22 2.89 4.27 -1.26 0.21 117.44 123.16 1blb n TRP 65 Ca 0.00 0.00 0.05 0.00 -3.89 0.00 0.00 57.50 53.66 1blb n TRP 65 Cb 0.00 -0.09 0.32 0.00 -1.36 0.00 0.00 31.31 30.18 1blb n TRP 65 CO 0.00 0.00 0.00 0.38 -2.29 0.00 0.00 177.69 175.78 1blb h ASP 66 N 0.00 0.74 -0.93 -0.67 3.04 -1.96 -3.14 116.42 113.50 1blb h ASP 66 Ca 0.00 0.00 0.27 0.00 -3.24 0.00 0.00 57.03 54.06 1blb h ASP 66 Cb 0.00 -0.16 -0.04 0.00 -1.04 0.00 0.00 39.33 38.10 1blb h ASP 66 CO 0.00 0.48 1.13 -1.28 -2.04 0.00 0.00 179.24 177.53 1blb h SER 67 N 0.84 0.00 0.00 4.15 0.87 0.20 -2.24 113.55 117.37 1blb h SER 67 Ca 0.33 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.77 1blb h SER 67 Cb 0.22 0.00 -0.25 0.00 -0.44 0.00 0.00 62.40 61.93 1blb h SER 67 CO -0.11 0.00 -0.84 -2.67 -0.53 0.00 0.00 176.83 172.67 1blb n TRP 68 N -3.26 0.00 -3.31 2.24 2.14 -1.18 -4.94 117.44 109.13 1blb n TRP 68 Ca 0.21 -0.79 -0.09 0.00 2.07 0.00 0.00 57.50 58.90 1blb n TRP 68 Cb 1.42 -0.18 -0.06 0.00 -0.81 0.00 0.00 31.31 31.68 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 -1.01 -0.64 -0.54 -1.67 2.01 -0.84 -4.78 115.64 108.18 1blb s THR 69 Ca 0.34 -0.26 0.22 0.00 0.31 0.00 0.00 61.69 62.30 1blb s THR 69 Cb 0.37 -0.97 0.23 0.00 0.01 0.00 0.00 72.50 72.14 1blb s THR 69 CO -0.13 -0.26 1.66 -1.20 -0.69 0.00 0.00 174.62 174.00 1blb n SER 70 N 5.36 0.56 0.24 3.53 7.64 -1.26 -2.23 113.62 127.46 1blb n SER 70 Ca 0.00 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.66 1blb n SER 70 Cb 0.49 -0.76 0.52 0.00 -1.01 0.00 0.00 64.21 63.45 1blb n SER 70 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1blb h SER 370 N 0.00 0.00 -0.46 6.43 0.02 -1.94 -3.46 113.55 114.14 1blb h SER 370 Ca 0.00 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.78 1blb h SER 370 Cb 0.32 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.79 1blb h SER 370 CO 0.00 0.13 -0.16 -1.14 -1.14 0.00 0.00 176.83 174.52 1blb n ARG 71 N -3.26 -1.75 -3.43 3.45 3.00 -0.95 -4.87 116.66 108.85 1blb n ARG 71 Ca 0.01 0.76 -0.44 0.00 -0.00 0.00 0.00 57.85 58.18 1blb n ARG 71 Cb 0.39 -5.12 -0.08 0.00 0.00 0.00 0.00 32.46 27.66 1blb n ARG 71 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1blb s ARG 371 N -2.63 2.88 0.29 -0.14 0.52 -1.26 -5.03 118.95 113.58 1blb s ARG 371 Ca 0.00 -1.46 0.08 0.00 -0.52 0.00 0.00 55.73 53.83 1blb s ARG 371 Cb 0.00 -4.08 -0.04 0.00 0.52 0.00 0.00 34.95 31.35 1blb s ARG 371 CO 0.00 -1.07 0.15 -0.08 0.02 0.00 0.00 175.30 174.32 1blb s THR 72 N 1.57 3.67 0.00 0.02 -1.32 -1.26 -4.91 115.64 113.42 1blb s THR 72 Ca 0.04 -1.59 0.00 0.00 -1.21 0.00 0.00 61.69 58.93 1blb s THR 72 Cb -0.25 -3.12 0.00 0.00 -1.51 0.00 0.00 72.50 67.62 1blb s THR 72 CO 0.05 -0.28 0.00 -0.90 -2.21 0.00 0.00 174.62 171.28 1blb n ASP 73 N -1.14 0.00 0.00 8.08 5.75 -1.26 -5.15 116.55 122.82 1blb n ASP 73 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.73 1blb n ASP 73 Cb 0.59 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.68 1blb n ASP 73 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1blb n SER 74 N 0.00 -0.90 -4.62 -1.12 7.64 -1.26 -4.86 113.62 108.50 1blb n SER 74 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 1blb n SER 74 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1blb n SER 74 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1blb s LEU 75 N 0.00 4.07 0.00 -3.43 1.43 -1.26 -4.46 118.68 115.02 1blb s LEU 75 Ca 0.00 0.62 0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1blb s LEU 75 Cb 0.00 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.43 1blb s LEU 75 CO 0.00 -0.36 0.00 -1.54 0.23 0.00 0.00 176.35 174.68 1blb n SER 76 N 5.67 4.49 -4.29 2.29 3.41 -0.72 -4.41 113.62 120.07 1blb n SER 76 Ca -0.02 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.35 1blb n SER 76 Cb 0.49 0.39 -0.12 0.00 -0.26 0.00 0.00 64.21 64.70 1blb n SER 76 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1blb s SER 77 N -3.03 2.56 -0.32 4.04 0.01 -1.22 -2.24 113.70 113.50 1blb s SER 77 Ca 0.00 -0.69 -0.01 0.00 1.31 0.00 0.00 55.95 56.55 1blb s SER 77 Cb 0.00 -0.14 0.12 0.00 0.21 0.00 0.00 66.02 66.21 1blb s SER 77 CO 0.00 0.06 0.21 -0.22 0.41 0.00 0.00 173.24 173.69 1blb s LEU 78 N -1.94 0.48 0.00 2.44 2.96 -0.94 -2.97 118.68 118.72 1blb s LEU 78 Ca 0.07 -1.51 0.05 0.00 -0.22 0.00 0.00 54.13 52.52 1blb s LEU 78 Cb -0.10 -0.13 -0.03 0.00 0.50 0.00 0.00 46.19 46.43 1blb s LEU 78 CO 0.04 -0.37 -0.14 0.00 -1.32 0.00 0.00 176.35 174.56 1blb s ARG 79 N 1.75 2.33 0.30 1.98 1.70 -1.02 -2.05 118.95 123.94 1blb s ARG 79 Ca 0.13 -0.83 -0.26 0.00 -0.47 0.00 0.00 55.73 54.30 1blb s ARG 79 Cb -0.18 -2.32 -0.10 0.00 -0.57 0.00 0.00 34.95 31.78 1blb s ARG 79 CO -0.21 0.58 0.92 -1.25 -1.08 0.00 0.00 175.30 174.27 1blb s PRO 80 N -1.20 4.61 -0.11 3.89 0.04 -1.26 -0.77 135.00 140.20 1blb s PRO 80 Ca 0.14 1.32 -0.24 0.00 0.04 0.00 0.00 61.00 62.26 1blb s PRO 80 Cb -0.11 -2.91 -0.03 0.00 0.04 0.00 0.00 34.50 31.50 1blb s PRO 80 CO 0.04 0.34 0.75 0.42 0.04 0.00 0.00 177.00 178.60 1blb s ILE 81 N -1.52 4.98 -0.95 0.56 1.01 -0.17 -4.76 121.20 120.35 1blb s ILE 81 Ca 0.48 1.51 -0.02 0.00 0.00 0.00 0.00 60.65 62.62 1blb s ILE 81 Cb -0.20 -4.08 0.27 0.00 0.01 0.00 0.00 42.46 38.46 1blb s ILE 81 CO 0.25 0.15 1.10 0.29 0.00 0.00 0.00 174.94 176.73 1blb n LYS 82 N 4.45 3.46 -1.97 2.79 5.02 -1.26 -4.18 118.16 126.46 1blb n LYS 82 Ca 0.01 -4.55 -0.41 0.00 -2.02 0.00 0.00 58.31 51.34 1blb n LYS 82 Cb 0.50 -2.44 -0.02 0.00 -0.02 0.00 0.00 35.03 33.05 1blb n LYS 82 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1blb s VAL 83 N -2.14 2.58 -0.14 -0.18 0.11 -1.26 -5.04 120.40 114.33 1blb s VAL 83 Ca 0.32 0.48 -0.20 0.00 -2.93 0.00 0.00 61.98 59.65 1blb s VAL 83 Cb 0.02 -3.31 -0.03 0.00 -1.53 0.00 0.00 36.38 31.53 1blb s VAL 83 CO -0.01 0.07 0.58 -0.62 -3.33 0.00 0.00 175.10 171.79 1blb s ASP 84 N 0.44 6.73 -0.03 3.54 -1.08 -1.26 -5.07 116.67 119.94 1blb s ASP 84 Ca 0.61 0.88 -0.01 0.00 -0.52 0.00 0.00 52.55 53.51 1blb s ASP 84 Cb -0.43 -2.33 0.03 0.00 -1.46 0.00 0.00 42.92 38.73 1blb s ASP 84 CO 0.43 -0.13 0.05 -0.55 0.52 0.00 0.00 175.17 175.50 1blb s SER 85 N 0.90 0.02 -0.43 -0.34 0.15 -1.26 -5.13 113.70 107.62 1blb s SER 85 Ca 0.29 0.10 -0.07 0.00 0.70 0.00 0.00 55.95 56.97 1blb s SER 85 Cb -0.16 -0.00 0.10 0.00 -1.71 0.00 0.00 66.02 64.25 1blb s SER 85 CO 0.12 -0.12 0.26 -1.10 1.20 0.00 0.00 173.24 173.60 1blb s GLN 86 N 0.98 2.34 0.32 5.44 -0.21 -1.26 -5.07 119.66 122.19 1blb s GLN 86 Ca -0.08 -1.69 0.07 0.00 0.02 0.00 0.00 55.36 53.68 1blb s GLN 86 Cb -0.11 -3.73 -0.02 0.00 1.00 0.00 0.00 33.01 30.14 1blb s GLN 86 CO -0.03 -1.07 0.36 -1.83 -2.12 0.00 0.00 175.29 170.60 1blb s GLU 87 N 1.29 2.96 -0.22 2.91 -1.05 -1.26 -5.08 118.70 118.26 1blb s GLU 87 Ca 0.05 -1.11 -0.01 0.00 -0.15 0.00 0.00 54.97 53.75 1blb s GLU 87 Cb -0.24 -2.66 0.06 0.00 -0.44 0.00 0.00 34.13 30.86 1blb s GLU 87 CO -0.01 0.15 0.01 -1.01 0.95 0.00 0.00 175.26 175.35 1blb s HIS 88 N -2.21 1.59 -0.15 4.83 3.76 -1.26 -4.82 115.29 117.03 1blb s HIS 88 Ca 0.41 -1.28 0.01 0.00 -0.15 0.00 0.00 55.06 54.05 1blb s HIS 88 Cb -0.08 -1.30 -0.00 0.00 1.11 0.00 0.00 32.58 32.31 1blb s HIS 88 CO 0.28 -0.70 -0.16 -1.59 -0.85 0.00 0.00 174.74 171.72 1blb s LYS 89 N 1.67 3.19 -0.07 1.40 -2.85 -1.24 -0.71 119.74 121.14 1blb s LYS 89 Ca -0.01 -0.77 0.01 0.00 -1.00 0.00 0.00 55.97 54.20 1blb s LYS 89 Cb -0.18 -2.59 -0.03 0.00 -2.06 0.00 0.00 37.83 32.97 1blb s LYS 89 CO -0.09 0.02 -0.09 -1.50 0.10 0.00 0.00 175.35 173.80 1blb s ILE 90 N 0.79 3.56 -0.26 3.79 2.07 -1.03 -1.48 121.20 128.63 1blb s ILE 90 Ca -0.06 -0.53 -0.00 0.00 -1.41 0.00 0.00 60.65 58.64 1blb s ILE 90 Cb -0.15 -2.44 0.08 0.00 0.13 0.00 0.00 42.46 40.07 1blb s ILE 90 CO 0.00 0.60 0.02 -0.89 -1.91 0.00 0.00 174.94 172.76 1blb s THR 91 N -0.77 1.12 0.52 4.00 2.01 -1.16 -1.64 115.64 119.72 1blb s THR 91 Ca 0.12 -1.19 -0.17 0.00 0.31 0.00 0.00 61.69 60.76 1blb s THR 91 Cb -0.11 -1.62 -0.07 0.00 0.01 0.00 0.00 72.50 70.70 1blb s THR 91 CO 0.01 -0.35 1.00 -0.76 -0.69 0.00 0.00 174.62 173.84 1blb s LEU 92 N 1.55 3.65 0.06 4.42 1.02 -0.05 -2.60 118.68 126.73 1blb s LEU 92 Ca 0.02 1.67 0.06 0.00 0.02 0.00 0.00 54.13 55.89 1blb s LEU 92 Cb -0.18 -4.52 -0.03 0.00 0.02 0.00 0.00 46.19 41.48 1blb s LEU 92 CO -0.13 -0.71 -0.16 -0.31 0.02 0.00 0.00 176.35 175.07 1blb s TYR 93 N -2.47 1.35 0.02 0.29 2.02 0.74 -2.18 117.35 117.12 1blb s TYR 93 Ca 0.61 -0.40 -0.16 0.00 -0.37 0.00 0.00 57.07 56.75 1blb s TYR 93 Cb -0.12 -0.78 -0.09 0.00 -0.40 0.00 0.00 41.96 40.57 1blb s TYR 93 CO 0.29 0.07 1.20 1.49 -1.57 0.00 0.00 175.55 177.03 1blb h GLU 94 N 4.62 -0.57 -6.08 -0.62 4.81 0.10 0.51 114.58 117.36 1blb h GLU 94 Ca -0.40 0.04 -0.65 0.00 -0.13 0.00 0.00 59.36 58.22 1blb h GLU 94 Cb 1.18 0.13 -0.09 0.00 0.63 0.00 0.00 28.75 30.60 1blb h GLU 94 CO 0.42 -0.38 -0.59 0.54 -0.73 0.00 0.00 179.01 178.28 1blb s ASN 95 N -2.95 5.63 0.85 1.04 6.03 -1.15 -2.90 114.94 121.48 1blb s ASN 95 Ca -0.09 0.08 -0.09 0.00 -1.03 0.00 0.00 52.86 51.74 1blb s ASN 95 Cb 0.01 -1.58 0.12 0.00 -3.03 0.00 0.00 41.25 36.78 1blb s ASN 95 CO 0.26 0.23 0.25 -2.65 -2.03 0.00 0.00 177.10 173.16 1blb n PRO 96 N 0.85 -1.65 -2.28 3.55 -0.02 -1.26 -3.32 135.00 130.87 1blb n PRO 96 Ca -0.11 -0.49 -0.21 0.00 -2.02 0.00 0.00 63.50 60.68 1blb n PRO 96 Cb 0.52 -1.32 -0.02 0.00 -0.02 0.00 0.00 33.50 32.66 1blb n PRO 96 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1blb n ASN 97 N 0.02 -5.78 -4.18 2.55 4.13 -1.23 -3.54 115.26 107.22 1blb n ASN 97 Ca 0.04 0.07 -0.34 0.00 1.68 0.00 0.00 54.58 56.04 1blb n ASN 97 Cb 0.23 -4.85 -0.03 0.00 -1.54 0.00 0.00 39.78 33.58 1blb n ASN 97 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1blb n PHE 98 N -3.75 -1.66 -4.48 3.10 3.72 -1.24 -4.99 117.46 108.17 1blb n PHE 98 Ca -0.24 0.77 -0.23 0.00 -0.05 0.00 0.00 57.45 57.70 1blb n PHE 98 Cb 0.68 -3.08 -0.11 0.00 -0.94 0.00 0.00 39.48 36.04 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 -3.53 1.40 0.00 4.37 2.01 -1.21 -5.02 115.64 113.67 1blb s THR 99 Ca 0.52 -2.02 0.00 0.00 0.31 0.00 0.00 61.69 60.50 1blb s THR 99 Cb -0.28 -2.79 0.00 0.00 0.01 0.00 0.00 72.50 69.44 1blb s THR 99 CO 0.93 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 175.43 1blb n GLY 100 N -0.73 -1.06 3.72 4.40 0.00 -1.26 -2.95 105.19 107.31 1blb n GLY 100 Ca -0.03 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 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 4.29 0.37 1.61 2.47 -1.26 -4.73 119.74 122.48 1blb s LYS 101 Ca 0.00 2.20 0.07 0.00 -1.56 0.00 0.00 55.97 56.68 1blb s LYS 101 Cb 0.00 -3.19 -0.07 0.00 -1.46 0.00 0.00 37.83 33.11 1blb s LYS 101 CO 0.00 -0.46 -0.01 -1.59 0.16 0.00 0.00 175.35 173.44 1blb s LYS 102 N 0.70 1.84 -0.31 4.03 -2.85 -1.26 0.63 119.74 122.51 1blb s LYS 102 Ca 0.64 -2.01 -0.01 0.00 -1.00 0.00 0.00 55.97 53.60 1blb s LYS 102 Cb -0.40 -1.48 0.10 0.00 -2.06 0.00 0.00 37.83 33.99 1blb s LYS 102 CO 0.34 -0.02 0.10 1.41 0.10 0.00 0.00 175.35 177.28 1blb s MET 103 N -3.72 0.68 -0.44 1.78 1.75 -0.93 -4.98 119.30 113.45 1blb s MET 103 Ca 0.34 -1.03 -0.18 0.00 -1.25 0.00 0.00 55.69 53.57 1blb s MET 103 Cb 0.07 -1.94 0.03 0.00 2.84 0.00 0.00 34.83 35.83 1blb s MET 103 CO 0.17 -0.98 0.50 -2.00 -0.65 0.00 0.00 175.02 172.05 1blb s GLU 104 N 1.65 3.13 0.11 4.11 2.12 -1.26 -0.87 118.70 127.69 1blb s GLU 104 Ca 0.10 -0.72 0.08 0.00 0.36 0.00 0.00 54.97 54.79 1blb s GLU 104 Cb -0.17 -3.98 -0.04 0.00 0.26 0.00 0.00 34.13 30.19 1blb s GLU 104 CO -0.26 -0.93 -0.12 0.08 -0.54 0.00 0.00 175.26 173.49 1blb s VAL 105 N 2.31 3.24 -0.03 3.70 1.01 -0.65 -5.02 120.40 124.95 1blb s VAL 105 Ca 0.14 -1.36 -0.01 0.00 0.00 0.00 0.00 61.98 60.76 1blb s VAL 105 Cb -0.17 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.73 1blb s VAL 105 CO 0.14 0.09 0.06 -0.63 0.00 0.00 0.00 175.10 174.76 1blb s ILE 106 N -1.24 -0.08 0.00 2.22 1.01 -1.26 -2.47 121.20 119.38 1blb s ILE 106 Ca 0.21 0.26 0.00 0.00 0.00 0.00 0.00 60.65 61.12 1blb s ILE 106 Cb -0.11 -0.12 0.00 0.00 0.01 0.00 0.00 42.46 42.24 1blb s ILE 106 CO 0.13 0.11 0.00 0.47 0.00 0.00 0.00 174.94 175.65 1blb n ASP 306 N 4.45 0.00 -4.68 3.58 9.92 0.12 -4.63 116.55 125.31 1blb n ASP 306 Ca -0.22 0.00 -0.63 0.00 -0.53 0.00 0.00 54.79 53.41 1blb n ASP 306 Cb 0.50 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.90 1blb n ASP 306 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1blb n ASP 107 N 0.00 1.26 -4.85 -2.24 -0.08 -1.26 -4.82 116.55 104.56 1blb n ASP 107 Ca 0.00 1.15 -0.32 0.00 -1.51 0.00 0.00 54.79 54.12 1blb n ASP 107 Cb 0.00 -0.97 -0.04 0.00 2.34 0.00 0.00 41.12 42.45 1blb n ASP 107 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1blb s ASP 108 N 2.31 6.61 -0.07 1.67 1.11 -1.26 -4.96 116.67 122.08 1blb s ASP 108 Ca 0.99 1.40 0.01 0.00 0.18 0.00 0.00 52.55 55.13 1blb s ASP 108 Cb -1.31 -2.44 0.02 0.00 1.07 0.00 0.00 42.92 40.26 1blb s ASP 108 CO 0.70 -0.49 -0.06 0.54 1.18 0.00 0.00 175.17 177.04 1blb s VAL 109 N -2.48 0.76 -0.15 -1.27 0.11 -0.92 -5.02 120.40 111.42 1blb s VAL 109 Ca 0.56 -0.20 -0.11 0.00 -2.93 0.00 0.00 61.98 59.29 1blb s VAL 109 Cb -0.10 -0.77 -0.06 0.00 -1.53 0.00 0.00 36.38 33.91 1blb s VAL 109 CO 0.30 0.29 -0.08 1.55 -3.33 0.00 0.00 175.10 173.83 1blb h PRO 110 N 7.52 0.00 -5.06 1.54 0.13 -1.89 0.79 132.00 135.03 1blb h PRO 110 Ca -0.32 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.18 1blb h PRO 110 Cb 1.15 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.08 1blb h PRO 110 CO 0.42 0.22 -0.59 0.45 -0.23 0.00 0.00 178.00 178.27 1blb s SER 111 N -5.96 5.38 0.28 1.44 0.15 -1.26 -3.22 113.70 110.51 1blb s SER 111 Ca -0.17 -0.09 0.10 0.00 0.70 0.00 0.00 55.95 56.49 1blb s SER 111 Cb 0.03 -1.95 0.39 0.00 -1.71 0.00 0.00 66.02 62.78 1blb s SER 111 CO 0.29 0.04 1.64 -0.26 1.20 0.00 0.00 173.24 176.14 1blb h PHE 112 N 7.72 0.02 -0.01 3.44 -1.00 0.20 -2.64 116.94 124.67 1blb h PHE 112 Ca -0.37 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.41 1blb h PHE 112 Cb 1.18 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.73 1blb h PHE 112 CO 0.64 0.60 0.02 0.45 -1.61 0.00 0.00 178.31 178.41 1blb h HIS 113 N 0.01 0.00 -0.03 -0.55 3.86 -1.73 -0.22 115.15 116.49 1blb h HIS 113 Ca -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1blb h HIS 113 Cb 1.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.51 1blb h HIS 113 CO 0.00 0.00 -0.01 0.00 0.86 0.00 0.00 177.93 178.78 1blb n ALA 114 N -2.21 2.49 -0.38 2.45 0.00 -1.00 -4.00 120.51 117.87 1blb n ALA 114 Ca -0.03 -0.67 0.10 0.00 0.00 0.00 0.00 53.44 52.84 1blb n ALA 114 Cb 0.09 -0.72 0.28 0.00 0.00 0.00 0.00 19.45 19.10 1blb n ALA 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1blb n HIS 116 N 1.17 0.93 -0.00 0.00 -0.00 -0.17 -4.91 115.22 112.24 1blb n HIS 116 Ca 0.12 -0.53 0.00 0.00 -0.00 0.00 0.00 57.72 57.32 1blb n HIS 116 Cb 0.53 -0.05 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 1blb n HIS 116 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1blb n GLY 117 N 1.23 0.92 3.77 -1.41 0.00 -1.19 -5.08 105.19 103.43 1blb n GLY 117 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.31 3.57 0.00 1.61 5.04 -0.74 -4.91 117.35 119.62 1blb s TYR 118 Ca 0.00 1.73 0.00 0.00 -2.44 0.00 0.00 57.07 56.36 1blb s TYR 118 Cb 0.00 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.15 1blb s TYR 118 CO 0.00 -0.33 0.00 1.04 -1.34 0.00 0.00 175.55 174.92 1blb n GLN 318 N 0.84 1.88 -0.67 4.97 6.02 -1.26 -3.07 117.38 126.08 1blb n GLN 318 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.69 1blb n GLN 318 Cb 0.47 -0.77 0.17 0.00 1.02 0.00 0.00 30.24 31.13 1blb n GLN 318 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1blb n GLU 119 N -1.43 -0.90 -1.00 -1.09 0.00 -1.26 -4.98 120.64 109.98 1blb n GLU 119 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 57.16 56.66 1blb n GLU 119 Cb 0.27 -2.14 0.19 0.00 0.00 0.00 0.00 31.44 29.77 1blb n GLU 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.13 175.54 1blb s LYS 120 N -4.22 0.21 -0.25 3.44 -2.85 -1.26 -4.97 119.74 109.84 1blb s LYS 120 Ca 0.64 0.67 0.02 0.00 -1.00 0.00 0.00 55.97 56.30 1blb s LYS 120 Cb -0.22 -1.70 0.06 0.00 -2.06 0.00 0.00 37.83 33.91 1blb s LYS 120 CO 0.63 -2.92 -0.07 0.08 0.10 0.00 0.00 175.35 173.16 1blb s VAL 121 N -2.82 1.77 -0.09 1.79 1.01 0.09 -4.33 120.40 117.82 1blb s VAL 121 Ca 0.66 -1.40 0.07 0.00 0.00 0.00 0.00 61.98 61.31 1blb s VAL 121 Cb -0.20 -1.99 -0.10 0.00 0.00 0.00 0.00 36.38 34.08 1blb s VAL 121 CO 0.59 -0.09 0.19 -1.54 0.00 0.00 0.00 175.10 174.25 1blb n SER 122 N 4.58 2.62 -4.31 3.32 3.41 0.17 -4.42 113.62 118.99 1blb n SER 122 Ca -0.12 -0.16 -0.16 0.00 -0.26 0.00 0.00 58.87 58.17 1blb n SER 122 Cb 0.43 1.25 -0.10 0.00 -0.26 0.00 0.00 64.21 65.53 1blb n SER 122 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1blb s SER 123 N -2.55 1.57 -0.21 4.04 0.01 -0.96 -4.17 113.70 111.43 1blb s SER 123 Ca -0.01 -1.24 -0.27 0.00 1.31 0.00 0.00 55.95 55.74 1blb s SER 123 Cb 0.05 0.06 0.09 0.00 0.21 0.00 0.00 66.02 66.43 1blb s SER 123 CO 0.30 -0.57 0.81 0.68 0.41 0.00 0.00 173.24 174.87 1blb s VAL 124 N -3.54 0.00 -0.25 3.43 -7.23 -0.27 -0.19 120.40 112.36 1blb s VAL 124 Ca 0.29 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 1blb s VAL 124 Cb 0.06 -1.00 0.07 0.00 0.56 0.00 0.00 36.38 36.07 1blb s VAL 124 CO 0.08 0.00 -0.01 -0.13 -0.31 0.00 0.00 175.10 174.74 1blb s ARG 125 N -0.14 1.31 -0.79 4.82 0.52 -1.07 0.11 118.95 123.71 1blb s ARG 125 Ca -0.02 -1.00 -0.20 0.00 -0.52 0.00 0.00 55.73 53.99 1blb s ARG 125 Cb -0.03 -2.48 0.11 0.00 0.52 0.00 0.00 34.95 33.07 1blb s ARG 125 CO 0.01 -0.70 1.01 0.08 0.02 0.00 0.00 175.30 175.72 1blb s VAL 126 N 1.46 4.61 0.16 3.52 1.01 -1.04 -2.98 120.40 127.15 1blb s VAL 126 Ca -0.01 -1.10 -0.13 0.00 0.00 0.00 0.00 61.98 60.75 1blb s VAL 126 Cb -0.18 -4.71 0.06 0.00 0.00 0.00 0.00 36.38 31.55 1blb s VAL 126 CO -0.10 -1.43 1.72 1.56 0.00 0.00 0.00 175.10 176.85 1blb h GLN 127 N 9.12 0.83 -2.65 2.72 7.50 -1.60 -2.96 115.11 128.07 1blb h GLN 127 Ca -0.06 -0.15 0.11 0.00 0.50 0.00 0.00 58.65 59.06 1blb h GLN 127 Cb 1.05 -0.14 -0.04 0.00 0.05 0.00 0.00 27.48 28.40 1blb h GLN 127 CO 1.13 0.72 0.44 -1.54 -1.50 0.00 0.00 178.83 178.07 1blb s SER 128 N -6.04 -0.08 0.09 1.46 1.04 -1.20 -4.87 113.70 104.11 1blb s SER 128 Ca -0.13 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1blb s SER 128 Cb 0.12 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1blb s SER 128 CO 0.79 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1blb n GLY 129 N -0.56 -2.00 3.20 7.32 0.00 -1.26 -3.60 105.19 108.29 1blb n GLY 129 Ca -0.05 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.13 3.09 0.07 2.61 2.01 -1.26 -4.44 115.64 115.59 1blb s THR 130 Ca 0.00 -1.18 0.05 0.00 0.31 0.00 0.00 61.69 60.86 1blb s THR 130 Cb 0.00 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.78 1blb s THR 130 CO 0.00 0.01 -0.03 0.26 -0.69 0.00 0.00 174.62 174.17 1blb s TRP 131 N 1.31 2.93 -0.38 4.92 0.52 -1.20 0.39 118.94 127.43 1blb s TRP 131 Ca -0.03 -0.05 0.01 0.00 0.02 0.00 0.00 56.10 56.06 1blb s TRP 131 Cb -0.18 -1.54 0.15 0.00 -1.15 0.00 0.00 33.47 30.74 1blb s TRP 131 CO -0.02 0.45 0.25 0.08 0.02 0.00 0.00 176.95 177.73 1blb s VAL 132 N -1.21 0.37 -0.24 4.03 1.01 0.21 -0.64 120.40 123.93 1blb s VAL 132 Ca 0.23 -2.06 -0.29 0.00 0.00 0.00 0.00 61.98 59.85 1blb s VAL 132 Cb -0.11 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 1blb s VAL 132 CO 0.15 -1.04 1.54 -0.83 0.00 0.00 0.00 175.10 174.92 1blb s GLY 133 N 0.72 1.26 0.00 4.51 0.00 -0.96 -3.45 107.32 109.39 1blb s GLY 133 Ca 0.22 0.39 0.00 0.00 0.00 0.00 0.00 44.72 45.33 1blb s GLY 133 CO -0.04 2.91 0.00 -1.72 0.00 0.00 0.00 173.10 174.25 1blb n TYR 134 N 8.25 0.00 0.00 1.90 4.02 -0.61 -2.43 117.16 128.29 1blb n TYR 134 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.07 1blb n TYR 134 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.77 1blb n TYR 134 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1blb n GLN 135 N 0.00 1.89 -1.40 -0.72 7.27 -1.05 -3.94 117.38 119.44 1blb n GLN 135 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1blb n GLN 135 Cb 0.00 -0.94 0.00 0.00 2.41 0.00 0.00 30.24 31.71 1blb n GLN 135 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1blb n TYR 136 N -1.53 0.00 -2.53 3.69 4.01 -0.29 -3.15 117.16 117.36 1blb n TYR 136 Ca 0.00 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.47 1blb n TYR 136 Cb 0.18 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.23 1blb n TYR 136 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1blb s PRO 137 N -1.10 3.28 -0.90 -0.72 0.02 -1.26 -2.75 135.00 131.57 1blb s PRO 137 Ca 0.00 0.11 -0.03 0.00 0.02 0.00 0.00 61.00 61.10 1blb s PRO 137 Cb 0.00 -2.33 0.00 0.00 0.02 0.00 0.00 34.50 32.19 1blb s PRO 137 CO 0.00 -0.42 0.40 0.41 -0.33 0.00 0.00 177.00 177.06 1blb n GLY 138 N -2.40 -0.01 2.67 0.52 0.00 -1.24 -4.03 105.19 100.70 1blb n GLY 138 Ca 0.02 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 1blb n GLY 138 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1blb n TYR 139 N -3.99 -1.68 -3.75 1.61 0.18 -1.26 -4.96 117.16 103.31 1blb n TYR 139 Ca -0.06 0.71 -0.13 0.00 1.88 0.00 0.00 57.90 60.30 1blb n TYR 139 Cb 0.57 -1.14 -0.08 0.00 -0.38 0.00 0.00 39.34 38.31 1blb n TYR 139 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1blb s ARG 140 N -1.58 0.71 2.39 -3.48 0.52 -1.26 -5.02 118.95 111.23 1blb s ARG 140 Ca 0.24 -0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.21 1blb s ARG 140 Cb -0.02 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.76 1blb s ARG 140 CO 0.55 -0.20 0.00 0.41 0.02 0.00 0.00 175.30 176.08 1blb n GLY 141 N 1.12 0.72 3.70 -3.53 0.00 -1.26 -1.13 105.19 104.81 1blb n GLY 141 Ca -0.21 -1.11 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 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 4.34 -0.08 0.99 1.43 -1.26 -4.81 118.68 119.29 1blb s LEU 142 Ca 0.00 1.93 -0.00 0.00 -1.03 0.00 0.00 54.13 55.03 1blb s LEU 142 Cb 0.00 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.62 1blb s LEU 142 CO 0.00 -0.49 -0.05 -1.10 0.23 0.00 0.00 176.35 174.94 1blb s GLN 143 N 1.44 2.94 -0.10 1.70 -0.21 -1.26 -2.52 119.66 121.65 1blb s GLN 143 Ca 0.57 -0.51 0.03 0.00 0.02 0.00 0.00 55.36 55.47 1blb s GLN 143 Cb -0.27 -2.68 0.01 0.00 1.00 0.00 0.00 33.01 31.06 1blb s GLN 143 CO 0.27 0.61 -0.18 0.71 -2.12 0.00 0.00 175.29 174.58 1blb s TYR 144 N -0.66 2.10 0.31 0.91 2.02 -1.02 -5.04 117.35 115.98 1blb s TYR 144 Ca 0.10 -0.91 -0.19 0.00 -0.37 0.00 0.00 57.07 55.71 1blb s TYR 144 Cb -0.12 -1.47 -0.09 0.00 -0.40 0.00 0.00 41.96 39.89 1blb s TYR 144 CO 0.02 -0.42 0.79 -1.17 -1.57 0.00 0.00 175.55 173.20 1blb s LEU 145 N 0.67 4.16 -0.35 -1.29 2.96 -1.26 -2.27 118.68 121.30 1blb s LEU 145 Ca -0.13 1.46 0.02 0.00 -0.22 0.00 0.00 54.13 55.26 1blb s LEU 145 Cb -0.16 -4.00 0.15 0.00 0.50 0.00 0.00 46.19 42.67 1blb s LEU 145 CO 0.03 -0.14 0.33 -0.76 -1.32 0.00 0.00 176.35 174.49 1blb s LEU 146 N -2.60 0.07 0.00 -0.68 1.02 0.18 -4.92 118.68 111.75 1blb s LEU 146 Ca 0.52 -1.48 0.05 0.00 0.02 0.00 0.00 54.13 53.23 1blb s LEU 146 Cb -0.13 0.39 0.11 0.00 0.02 0.00 0.00 46.19 46.58 1blb s LEU 146 CO 0.18 -0.30 0.86 -0.62 0.02 0.00 0.00 176.35 176.50 1blb n GLU 147 N 4.47 0.29 -1.62 1.70 1.02 -1.26 -3.24 120.64 122.00 1blb n GLU 147 Ca 0.08 -2.83 -0.52 0.00 -0.02 0.00 0.00 57.16 53.86 1blb n GLU 147 Cb 0.44 -0.42 -0.06 0.00 -0.02 0.00 0.00 31.44 31.38 1blb n GLU 147 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1blb n LYS 148 N -2.48 1.27 0.00 3.49 4.81 -1.26 -4.60 118.16 119.38 1blb n LYS 148 Ca 0.16 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1blb n LYS 148 Cb 0.57 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 33.50 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 2.97 4.75 3.80 3.14 0.00 -1.12 -4.98 105.19 113.75 1blb n GLY 149 Ca 0.20 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.73 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 0.00 7.15 -0.27 1.61 1.11 -1.26 -2.48 116.67 122.52 1blb s ASP 150 Ca 0.00 1.76 0.02 0.00 0.18 0.00 0.00 52.55 54.51 1blb s ASP 150 Cb 0.00 -2.56 0.07 0.00 1.07 0.00 0.00 42.92 41.50 1blb s ASP 150 CO 0.00 -0.20 -0.05 -0.31 1.18 0.00 0.00 175.17 175.79 1blb s TYR 151 N -1.88 3.02 0.12 4.23 1.51 0.31 -4.96 117.35 119.71 1blb s TYR 151 Ca 0.56 -2.25 -0.09 0.00 -1.01 0.00 0.00 57.07 54.27 1blb s TYR 151 Cb -0.14 -2.00 -0.10 0.00 -0.11 0.00 0.00 41.96 39.61 1blb s TYR 151 CO 0.19 -0.86 1.33 1.57 -1.11 0.00 0.00 175.55 176.67 1blb h LYS 152 N 7.81 0.66 -4.32 -0.62 2.10 -1.87 -0.70 116.57 119.64 1blb h LYS 152 Ca -0.15 -0.56 -0.16 0.00 -2.00 0.00 0.00 60.65 57.77 1blb h LYS 152 Cb 1.04 0.12 -0.15 0.00 -0.90 0.00 0.00 32.23 32.35 1blb h LYS 152 CO 0.46 1.18 -0.61 0.34 -2.00 0.00 0.00 179.45 178.81 1blb s ASP 153 N -7.09 0.30 0.37 7.07 -1.08 -1.26 -3.58 116.67 111.41 1blb s ASP 153 Ca -0.09 -1.12 0.12 0.00 -0.52 0.00 0.00 52.55 50.94 1blb s ASP 153 Cb 0.09 0.30 0.91 0.00 -1.46 0.00 0.00 42.92 42.76 1blb s ASP 153 CO 0.89 -0.73 1.85 0.28 0.52 0.00 0.00 175.17 177.98 1blb h SER 154 N 2.87 0.58 -1.91 -0.34 0.02 -1.86 0.50 113.55 113.41 1blb h SER 154 Ca -0.34 0.05 0.55 0.00 -0.84 0.00 0.00 61.79 61.21 1blb h SER 154 Cb 1.19 -0.06 -0.08 0.00 0.14 0.00 0.00 62.40 63.60 1blb h SER 154 CO 0.59 0.25 1.38 1.23 -1.14 0.00 0.00 176.83 179.14 1blb h GLY 155 N 0.59 0.00 -0.01 -3.77 0.00 -1.93 0.41 103.07 98.36 1blb h GLY 155 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1blb h GLY 155 CO -0.22 0.00 -0.01 2.09 0.00 0.00 0.00 176.54 178.40 1blb n ASP 156 N -3.95 1.39 -1.10 0.19 5.68 0.16 -4.68 116.55 114.24 1blb n ASP 156 Ca 0.43 -1.73 0.04 0.00 -0.50 0.00 0.00 54.79 53.02 1blb n ASP 156 Cb 1.95 -0.01 0.04 0.00 -1.14 0.00 0.00 41.12 41.96 1blb n ASP 156 CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 1blb n PHE 157 N -0.37 0.00 -4.02 2.11 -1.74 0.12 -4.91 117.46 108.65 1blb n PHE 157 Ca 0.00 -0.51 -0.33 0.00 -0.56 0.00 0.00 57.45 56.05 1blb n PHE 157 Cb 0.34 -0.14 -0.02 0.00 1.52 0.00 0.00 39.48 41.18 1blb n PHE 157 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1blb n GLY 158 N 0.12 -0.46 3.60 4.97 0.00 0.40 -4.86 105.19 108.96 1blb n GLY 158 Ca 0.06 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.18 3.04 0.00 4.61 0.00 -1.07 -4.99 121.76 120.17 1blb s ALA 159 Ca 0.67 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 51.01 1blb s ALA 159 Cb -0.36 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.06 1blb s ALA 159 CO 0.82 0.33 0.00 -2.30 0.00 0.00 0.00 175.76 174.61 1blb n PRO 160 N -0.56 0.00 -2.75 0.00 -0.02 -1.26 -4.52 135.00 125.89 1blb n PRO 160 Ca -0.08 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.98 1blb n PRO 160 Cb 0.58 -0.08 -0.03 0.00 -0.02 0.00 0.00 33.50 33.95 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 0.00 4.46 -0.05 -0.52 -0.21 -1.26 -4.88 119.66 117.20 1blb s GLN 161 Ca 0.00 1.32 -0.25 0.00 0.02 0.00 0.00 55.36 56.45 1blb s GLN 161 Cb 0.00 -3.51 -0.30 0.00 1.00 0.00 0.00 33.01 30.20 1blb s GLN 161 CO 0.00 -0.19 1.50 -2.30 -2.12 0.00 0.00 175.29 172.18 1blb n PRO 162 N 4.55 0.10 -3.87 2.91 -0.02 -1.26 -4.70 135.00 132.71 1blb n PRO 162 Ca 0.06 -0.96 -0.30 0.00 -2.02 0.00 0.00 63.50 60.29 1blb n PRO 162 Cb 0.50 -2.43 -0.12 0.00 -0.02 0.00 0.00 33.50 31.43 1blb n PRO 162 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1blb s GLN 163 N 6.49 2.49 -0.32 -0.52 -1.52 -1.26 -0.73 119.66 124.29 1blb s GLN 163 Ca 0.55 -3.19 -0.03 0.00 -1.95 0.00 0.00 55.36 50.75 1blb s GLN 163 Cb 0.12 -3.49 0.06 0.00 -0.22 0.00 0.00 33.01 29.48 1blb s GLN 163 CO 0.27 -1.25 0.05 0.08 -0.25 0.00 0.00 175.29 174.19 1blb s VAL 164 N -1.19 3.14 0.02 1.09 1.01 -1.26 -4.19 120.40 119.01 1blb s VAL 164 Ca 0.24 -1.46 -0.01 0.00 0.00 0.00 0.00 61.98 60.74 1blb s VAL 164 Cb -0.09 -2.86 -0.27 0.00 0.00 0.00 0.00 36.38 33.16 1blb s VAL 164 CO -0.13 -0.21 0.91 1.56 0.00 0.00 0.00 175.10 177.23 1blb h GLN 165 N 8.03 0.21 -5.29 2.72 4.20 -1.67 -3.46 115.11 119.85 1blb h GLN 165 Ca -0.20 -0.35 -0.38 0.00 0.06 0.00 0.00 58.65 57.78 1blb h GLN 165 Cb 1.06 0.13 -0.15 0.00 0.30 0.00 0.00 27.48 28.82 1blb h GLN 165 CO 0.57 1.06 -0.73 -1.54 -0.67 0.00 0.00 178.83 177.52 1blb s SER 166 N -6.90 2.10 0.03 1.46 1.04 -1.11 0.20 113.70 110.52 1blb s SER 166 Ca -0.07 -0.99 0.04 0.00 0.48 0.00 0.00 55.95 55.42 1blb s SER 166 Cb 0.07 -0.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.11 1blb s SER 166 CO 0.85 -0.25 -0.13 0.54 0.98 0.00 0.00 173.24 175.23 1blb s VAL 167 N -3.03 1.04 -0.01 5.02 0.11 0.27 -1.57 120.40 122.23 1blb s VAL 167 Ca 0.18 -0.90 -0.01 0.00 -2.93 0.00 0.00 61.98 58.32 1blb s VAL 167 Cb 0.00 -0.94 0.01 0.00 -1.53 0.00 0.00 36.38 33.92 1blb s VAL 167 CO 0.03 0.04 0.04 -0.60 -3.33 0.00 0.00 175.10 171.28 1blb s ARG 168 N -0.98 0.03 -0.20 1.54 3.52 -1.22 -2.17 118.95 119.47 1blb s ARG 168 Ca 0.02 0.07 -0.08 0.00 -0.13 0.00 0.00 55.73 55.60 1blb s ARG 168 Cb -0.07 -0.01 -0.04 0.00 -1.56 0.00 0.00 34.95 33.26 1blb s ARG 168 CO 0.01 -0.02 0.09 0.50 -0.81 0.00 0.00 175.30 175.07 1blb s ARG 169 N 0.14 4.02 0.28 5.12 3.52 -1.26 0.68 118.95 131.45 1blb s ARG 169 Ca -0.01 -0.31 -0.29 0.00 -0.13 0.00 0.00 55.73 54.98 1blb s ARG 169 Cb -0.02 -3.31 -0.10 0.00 -1.56 0.00 0.00 34.95 29.97 1blb s ARG 169 CO -0.00 0.23 1.18 0.42 -0.81 0.00 0.00 175.30 176.31 1blb s ILE 170 N 0.53 3.26 -0.01 4.11 -1.09 1.28 -4.88 121.20 124.39 1blb s ILE 170 Ca 0.05 1.23 0.02 0.00 -2.23 0.00 0.00 60.65 59.72 1blb s ILE 170 Cb -0.12 -3.79 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 1blb s ILE 170 CO 0.00 0.28 0.04 -1.14 -1.23 0.00 0.00 174.94 172.90 1blb n ARG 171 N 1.27 1.03 -3.87 2.79 0.63 -1.26 -4.35 116.66 112.90 1blb n ARG 171 Ca 0.00 -0.01 -0.12 0.00 -0.92 0.00 0.00 57.85 56.80 1blb n ARG 171 Cb 0.44 -0.97 -0.12 0.00 0.45 0.00 0.00 32.46 32.25 1blb n ARG 171 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 1blb s ASP 172 N -2.05 -0.03 0.57 6.15 1.47 -1.26 -5.12 116.67 116.40 1blb s ASP 172 Ca -0.00 0.02 0.08 0.00 1.18 0.00 0.00 52.55 53.83 1blb s ASP 172 Cb 0.01 0.16 0.07 0.00 -0.34 0.00 0.00 42.92 42.82 1blb s ASP 172 CO 0.07 -0.11 0.62 -0.32 0.68 0.00 0.00 175.17 176.12 1blb s MET 173 N -0.35 2.27 -0.13 2.11 1.75 -1.26 -5.08 119.30 118.61 1blb s MET 173 Ca -0.04 -1.83 0.05 0.00 -1.25 0.00 0.00 55.69 52.62 1blb s MET 173 Cb -0.03 -2.40 0.15 0.00 2.84 0.00 0.00 34.83 35.40 1blb s MET 173 CO 0.00 -0.77 0.89 0.00 -0.65 0.00 0.00 175.02 174.49 1blb n GLN 174 N -2.04 0.52 0.00 4.11 0.00 -1.26 -5.31 117.38 113.39 1blb n GLN 174 Ca 0.08 -0.49 0.00 0.00 0.00 0.00 0.00 57.00 56.59 1blb n GLN 174 Cb 0.63 0.21 0.00 0.00 0.00 0.00 0.00 30.24 31.07 1blb n GLN 174 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.06 174.39