#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbs s LYS 2 N 0.00 4.02 0.53 2.12 2.20 -1.26 -4.71 119.74 122.64 3fbs s LYS 2 Ca 0.00 1.38 -0.19 0.00 -0.36 0.00 0.00 55.97 56.80 3fbs s LYS 2 Cb 0.00 -3.84 -0.07 0.00 -1.51 0.00 0.00 37.83 32.41 3fbs s LYS 2 CO 0.00 -0.98 1.05 -0.06 -0.36 0.00 0.00 175.35 175.00 3fbs s PHE 3 N 4.09 2.96 0.15 4.03 0.08 -0.29 -4.92 117.98 124.08 3fbs s PHE 3 Ca 0.56 1.55 -0.17 0.00 0.12 0.00 0.00 56.93 58.99 3fbs s PHE 3 Cb -0.18 -3.07 0.01 0.00 -0.57 0.00 0.00 43.02 39.21 3fbs s PHE 3 CO 0.20 -0.99 1.80 -0.44 -0.10 0.00 0.00 175.22 175.69 3fbs h ASP 4 N 1.17 0.39 -3.87 1.36 3.32 -0.69 -2.66 116.42 115.44 3fbs h ASP 4 Ca -0.49 -0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.36 3fbs h ASP 4 Cb 1.22 -0.09 -0.26 0.00 0.22 0.00 0.00 39.33 40.42 3fbs h ASP 4 CO 0.58 0.28 -0.59 -0.69 -1.72 0.00 0.00 179.24 177.10 3fbs s VAL 5 N -6.16 0.01 -0.10 -1.35 1.01 -1.19 -2.56 120.40 110.06 3fbs s VAL 5 Ca -0.13 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.79 3fbs s VAL 5 Cb 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.29 3fbs s VAL 5 CO 0.72 -0.03 -0.10 -0.63 0.00 0.00 0.00 175.10 175.05 3fbs s ILE 6 N -0.06 3.36 -0.24 2.22 1.01 -0.58 -1.72 121.20 125.18 3fbs s ILE 6 Ca -0.01 -0.58 -0.04 0.00 0.00 0.00 0.00 60.65 60.01 3fbs s ILE 6 Cb -0.01 -2.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.06 3fbs s ILE 6 CO 0.00 0.55 -0.02 -0.63 0.00 0.00 0.00 174.94 174.85 3fbs s ILE 7 N -0.21 3.50 -0.43 2.92 1.01 -0.12 -1.19 121.20 126.69 3fbs s ILE 7 Ca 0.02 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 3fbs s ILE 7 Cb -0.13 -2.65 0.05 0.00 0.01 0.00 0.00 42.46 39.75 3fbs s ILE 7 CO 0.03 0.35 0.32 -0.63 0.00 0.00 0.00 174.94 175.00 3fbs s ILE 8 N 1.48 4.95 0.00 2.92 1.01 -0.19 -0.92 121.20 130.46 3fbs s ILE 8 Ca 0.05 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.71 3fbs s ILE 8 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.43 3fbs s ILE 8 CO -0.02 -0.45 0.00 0.61 0.00 0.00 0.00 174.94 175.09 3fbs n GLY 9 N 5.11 2.15 2.56 6.18 0.00 0.17 -0.06 105.19 121.29 3fbs n GLY 9 Ca -0.12 -1.28 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 3fbs n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fbs n GLY 10 N 2.17 3.48 0.00 -0.02 0.00 -1.26 -4.22 105.19 105.34 3fbs n GLY 10 Ca 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.18 3fbs n GLY 10 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fbs n SER 11 N -0.38 0.00 -0.17 1.61 2.88 -1.26 -4.55 113.62 111.75 3fbs n SER 11 Ca 0.22 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.71 3fbs n SER 11 Cb 0.79 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.31 3fbs n SER 11 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3fbs h TYR 12 N 0.00 0.51 -0.02 0.66 0.05 -1.94 0.14 116.97 116.37 3fbs h TYR 12 Ca 0.00 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 3fbs h TYR 12 Cb 0.00 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.59 3fbs h TYR 12 CO 0.00 0.26 -0.06 0.00 -1.05 0.00 0.00 178.16 177.30 3fbs h ALA 13 N 1.27 0.04 -0.23 3.88 0.00 -1.91 -2.22 119.26 120.09 3fbs h ALA 13 Ca 0.23 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3fbs h ALA 13 Cb 0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3fbs h ALA 13 CO -0.15 -0.11 0.14 0.78 0.00 0.00 0.00 179.25 179.91 3fbs h GLY 14 N -0.50 0.34 1.10 0.00 0.00 -1.70 -1.14 103.07 101.17 3fbs h GLY 14 Ca -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 3fbs h GLY 14 CO 0.01 0.13 0.37 1.41 0.00 0.00 0.00 176.54 178.47 3fbs h LEU 15 N 0.29 1.05 -0.53 3.11 3.38 -0.80 -1.05 115.31 120.76 3fbs h LEU 15 Ca 0.08 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 3fbs h LEU 15 Cb 0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3fbs h LEU 15 CO -0.02 0.90 0.09 -1.28 0.09 0.00 0.00 178.44 178.23 3fbs h SER 16 N 1.14 0.84 -0.64 -0.43 0.87 -0.95 -1.06 113.55 113.32 3fbs h SER 16 Ca 0.27 -0.26 0.02 0.00 -1.23 0.00 0.00 61.79 60.60 3fbs h SER 16 Cb 0.14 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 61.84 3fbs h SER 16 CO -0.03 0.88 0.41 0.00 -0.53 0.00 0.00 176.83 177.56 3fbs h ALA 17 N 0.99 0.83 -0.85 6.23 0.00 -1.04 -3.03 119.26 122.39 3fbs h ALA 17 Ca 0.16 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3fbs h ALA 17 Cb 0.40 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3fbs h ALA 17 CO 0.01 0.18 0.42 0.00 0.00 0.00 0.00 179.25 179.85 3fbs h ALA 18 N 1.27 1.13 -0.94 0.00 0.00 -0.47 -2.02 119.26 118.23 3fbs h ALA 18 Ca 0.25 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3fbs h ALA 18 Cb -0.01 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.38 3fbs h ALA 18 CO -0.09 0.66 0.61 1.25 0.00 0.00 0.00 179.25 181.68 3fbs h LEU 19 N 1.21 1.01 -0.25 0.00 5.85 -1.10 0.21 115.31 122.23 3fbs h LEU 19 Ca 0.29 -0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.88 3fbs h LEU 19 Cb 0.11 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 3fbs h LEU 19 CO -0.04 0.68 -0.34 1.56 -0.34 0.00 0.00 178.44 179.97 3fbs h GLN 20 N 1.17 0.67 -0.06 1.25 1.08 -1.31 -2.40 115.11 115.51 3fbs h GLN 20 Ca 0.38 -0.39 -0.10 0.00 -1.45 0.00 0.00 58.65 57.09 3fbs h GLN 20 Cb 0.03 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 3fbs h GLN 20 CO -0.13 1.00 -0.42 -0.07 -0.95 0.00 0.00 178.83 178.26 3fbs h LEU 21 N 0.39 0.15 -0.52 1.46 3.38 -0.98 -2.04 115.31 117.16 3fbs h LEU 21 Ca 0.03 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 3fbs h LEU 21 Cb 0.92 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3fbs h LEU 21 CO 0.08 0.56 -0.72 1.23 0.09 0.00 0.00 178.44 179.68 3fbs h GLY 22 N 1.26 0.15 2.00 0.83 0.00 -0.52 -0.66 103.07 106.13 3fbs h GLY 22 Ca 0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 3fbs h GLY 22 CO 0.06 0.20 -0.37 3.21 0.00 0.00 0.00 176.54 179.64 3fbs h ARG 23 N 0.09 0.00 -0.03 4.80 3.08 -0.96 -1.11 114.38 120.25 3fbs h ARG 23 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3fbs h ARG 23 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3fbs h ARG 23 CO 0.10 0.37 0.00 0.00 -1.07 0.00 0.00 179.97 179.37 3fbs n ALA 24 N -2.27 2.62 -3.94 0.04 0.00 -0.81 -4.95 120.51 111.19 3fbs n ALA 24 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 3fbs n ALA 24 Cb 0.53 -1.31 0.01 0.00 0.00 0.00 0.00 19.45 18.67 3fbs n ALA 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fbs n ARG 25 N -0.45 -4.58 -2.88 0.00 1.74 -0.42 -4.99 116.66 105.08 3fbs n ARG 25 Ca 0.19 0.53 -0.32 0.00 -0.77 0.00 0.00 57.85 57.48 3fbs n ARG 25 Cb 0.20 -5.20 -0.05 0.00 -1.02 0.00 0.00 32.46 26.39 3fbs n ARG 25 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3fbs s LYS 26 N -6.55 3.99 -0.67 5.56 -0.14 -0.30 -4.98 119.74 116.66 3fbs s LYS 26 Ca 0.44 0.77 -0.23 0.00 -1.36 0.00 0.00 55.97 55.60 3fbs s LYS 26 Cb -0.23 -2.31 0.07 0.00 -1.68 0.00 0.00 37.83 33.67 3fbs s LYS 26 CO 0.86 -0.00 1.00 1.21 -0.76 0.00 0.00 175.35 177.65 3fbs s ASN 27 N -2.59 6.18 0.13 2.83 2.47 -1.26 -4.44 114.94 118.27 3fbs s ASN 27 Ca 0.56 -0.96 0.08 0.00 0.42 0.00 0.00 52.86 52.96 3fbs s ASN 27 Cb -0.10 -2.43 -0.04 0.00 -1.45 0.00 0.00 41.25 37.23 3fbs s ASN 27 CO 0.22 -1.47 -0.19 0.27 -3.72 0.00 0.00 177.10 172.20 3fbs s ILE 28 N 4.20 1.76 -0.14 -5.21 -4.36 -0.60 0.07 121.20 116.93 3fbs s ILE 28 Ca 0.24 -1.74 0.02 0.00 -0.26 0.00 0.00 60.65 58.90 3fbs s ILE 28 Cb -0.16 -1.70 0.00 0.00 1.25 0.00 0.00 42.46 41.85 3fbs s ILE 28 CO 0.10 -0.19 -0.19 -0.22 0.24 0.00 0.00 174.94 174.68 3fbs s LEU 29 N -2.30 2.29 -0.22 0.37 2.96 -0.70 -0.66 118.68 120.42 3fbs s LEU 29 Ca 0.11 -0.53 -0.05 0.00 -0.22 0.00 0.00 54.13 53.45 3fbs s LEU 29 Cb -0.08 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 3fbs s LEU 29 CO 0.05 0.10 -0.00 -0.22 -1.32 0.00 0.00 176.35 174.96 3fbs s LEU 30 N 0.71 3.11 -0.25 -0.68 2.96 0.38 -0.94 118.68 123.97 3fbs s LEU 30 Ca -0.08 -0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 53.47 3fbs s LEU 30 Cb -0.16 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 3fbs s LEU 30 CO 0.01 -0.01 0.02 -0.69 -1.32 0.00 0.00 176.35 174.36 3fbs s VAL 31 N 1.42 3.75 -0.01 1.68 1.01 -0.10 -1.19 120.40 126.97 3fbs s VAL 31 Ca 0.05 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.58 3fbs s VAL 31 Cb -0.15 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3fbs s VAL 31 CO -0.00 0.30 -0.12 -0.62 0.00 0.00 0.00 175.10 174.65 3fbs s ASP 32 N 1.51 1.46 0.00 3.32 2.15 -0.65 -0.66 116.67 123.80 3fbs s ASP 32 Ca 0.05 -0.22 0.25 0.00 0.43 0.00 0.00 52.55 53.05 3fbs s ASP 32 Cb -0.15 -0.17 0.39 0.00 -0.30 0.00 0.00 42.92 42.69 3fbs s ASP 32 CO 0.00 0.15 1.35 0.00 -0.17 0.00 0.00 175.17 176.50 3fbs n ALA 33 N 2.79 3.07 -1.68 3.66 0.00 -0.91 -1.13 120.51 126.31 3fbs n ALA 33 Ca -0.14 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.64 3fbs n ALA 33 Cb 0.56 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 3fbs n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fbs n GLY 34 N 1.35 0.65 3.04 0.00 0.00 -1.26 -4.90 105.19 104.06 3fbs n GLY 34 Ca 0.12 -0.52 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 3fbs n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fbs s GLU 35 N -3.56 2.28 0.18 1.61 0.41 -1.26 -5.08 118.70 113.28 3fbs s GLU 35 Ca 0.00 -2.53 -0.13 0.00 -0.41 0.00 0.00 54.97 51.90 3fbs s GLU 35 Cb 0.00 -3.55 -0.07 0.00 -1.78 0.00 0.00 34.13 28.73 3fbs s GLU 35 CO 0.00 -1.14 0.57 1.03 -0.49 0.00 0.00 175.26 175.23 3fbs s ARG 36 N -0.09 3.94 0.48 1.61 0.52 -1.26 -4.98 118.95 119.18 3fbs s ARG 36 Ca 0.16 0.46 0.16 0.00 -0.52 0.00 0.00 55.73 55.99 3fbs s ARG 36 Cb -0.22 -2.82 1.18 0.00 0.52 0.00 0.00 34.95 33.60 3fbs s ARG 36 CO -0.02 0.41 2.06 -0.09 0.02 0.00 0.00 175.30 177.68 3fbs h ARG 37 N 3.20 0.18 -0.65 3.54 2.43 -1.96 -2.20 114.38 118.92 3fbs h ARG 37 Ca -0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3fbs h ARG 37 Cb 1.19 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3fbs h ARG 37 CO 0.67 0.12 0.00 0.27 -1.51 0.00 0.00 179.97 179.51 3fbs n ASN 38 N -4.48 4.16 0.29 -3.80 6.94 -1.26 -4.40 115.26 112.70 3fbs n ASN 38 Ca 0.04 -2.50 0.17 0.00 -0.02 0.00 0.00 54.58 52.27 3fbs n ASN 38 Cb 0.26 -0.56 0.81 0.00 -2.36 0.00 0.00 39.78 37.93 3fbs n ASN 38 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 3fbs h ARG 39 N 3.14 0.00 0.00 -3.83 0.11 -1.80 -1.68 114.38 110.32 3fbs h ARG 39 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3fbs h ARG 39 Cb 1.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.46 3fbs h ARG 39 CO 0.27 0.04 0.00 1.19 0.10 0.00 0.00 179.97 181.56 3fbs n PHE 40 N -3.19 0.10 -4.14 4.08 3.72 -1.26 -4.78 117.46 111.99 3fbs n PHE 40 Ca -0.01 0.03 -0.32 0.00 -0.05 0.00 0.00 57.45 57.11 3fbs n PHE 40 Cb 0.25 -0.55 -0.07 0.00 -0.94 0.00 0.00 39.48 38.16 3fbs n PHE 40 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fbs s ALA 41 N -3.02 3.46 -0.27 4.37 0.00 -0.63 -4.28 121.76 121.38 3fbs s ALA 41 Ca 0.11 -0.96 0.20 0.00 0.00 0.00 0.00 51.96 51.31 3fbs s ALA 41 Cb 0.15 -1.43 0.12 0.00 0.00 0.00 0.00 23.12 21.96 3fbs s ALA 41 CO 0.44 0.70 1.31 0.66 0.00 0.00 0.00 175.76 178.87 3fbs h SER 42 N 3.87 0.00 -3.73 0.00 4.64 -1.85 -3.45 113.55 113.03 3fbs h SER 42 Ca -0.48 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.61 3fbs h SER 42 Cb 1.17 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.98 3fbs h SER 42 CO 0.62 0.20 -0.69 -1.00 -0.87 0.00 0.00 176.83 175.09 3fbs s HIS 43 N -3.15 -0.03 0.18 4.77 3.76 -1.26 -4.25 115.29 115.31 3fbs s HIS 43 Ca 0.03 0.07 -0.13 0.00 -0.15 0.00 0.00 55.06 54.89 3fbs s HIS 43 Cb 0.07 -0.00 -0.07 0.00 1.11 0.00 0.00 32.58 33.69 3fbs s HIS 43 CO 0.74 -0.02 0.55 0.45 -0.85 0.00 0.00 174.74 175.61 3fbs s SER 44 N 0.07 6.75 0.05 1.40 0.15 0.11 -4.86 113.70 117.38 3fbs s SER 44 Ca -0.00 1.02 0.02 0.00 0.70 0.00 0.00 55.95 57.69 3fbs s SER 44 Cb -0.01 -2.27 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 3fbs s SER 44 CO -0.00 0.04 -0.07 -1.00 1.20 0.00 0.00 173.24 173.41 3fbs s HIS 45 N -1.59 0.68 0.00 3.44 3.76 -1.26 0.53 115.29 120.84 3fbs s HIS 45 Ca 0.41 -0.61 0.00 0.00 -0.15 0.00 0.00 55.06 54.71 3fbs s HIS 45 Cb -0.14 -0.41 0.00 0.00 1.11 0.00 0.00 32.58 33.15 3fbs s HIS 45 CO 0.20 -0.12 0.00 0.41 -0.85 0.00 0.00 174.74 174.38 3fbs n GLY 46 N 1.10 0.67 3.46 -2.22 0.00 -1.26 -4.77 105.19 102.16 3fbs n GLY 46 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 3fbs n GLY 46 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3fbs s PHE 47 N -2.39 3.10 0.08 1.61 5.36 -1.26 -4.86 117.98 119.61 3fbs s PHE 47 Ca 0.00 -0.38 -0.34 0.00 -0.96 0.00 0.00 56.93 55.25 3fbs s PHE 47 Cb 0.00 -2.25 -0.14 0.00 -0.34 0.00 0.00 43.02 40.30 3fbs s PHE 47 CO 0.00 -0.34 1.64 -0.11 -1.46 0.00 0.00 175.22 174.95 3fbs n LEU 48 N 4.92 3.02 0.00 6.12 0.00 -1.26 -0.73 117.00 129.07 3fbs n LEU 48 Ca -0.16 1.06 0.00 0.00 0.00 0.00 0.00 56.01 56.91 3fbs n LEU 48 Cb 0.51 -1.38 0.00 0.00 0.00 0.00 0.00 43.42 42.55 3fbs n LEU 48 CO 0.31 -0.31 0.00 0.61 0.00 0.00 0.00 177.39 178.00 3fbs n GLY 49 N 3.60 2.06 0.56 -3.96 0.00 -1.26 -4.84 105.19 101.35 3fbs n GLY 49 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.26 3fbs n GLY 49 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fbs n GLN 50 N -2.00 0.85 -2.10 1.61 1.13 0.09 -5.00 117.38 111.96 3fbs n GLN 50 Ca 0.00 -2.31 -0.43 0.00 -1.94 0.00 0.00 57.00 52.32 3fbs n GLN 50 Cb 0.00 -1.04 -0.03 0.00 0.11 0.00 0.00 30.24 29.28 3fbs n GLN 50 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3fbs s ASP 51 N -2.40 6.63 0.00 1.08 2.15 -1.17 -1.73 116.67 121.23 3fbs s ASP 51 Ca 0.27 1.98 0.00 0.00 0.43 0.00 0.00 52.55 55.23 3fbs s ASP 51 Cb 0.26 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 3fbs s ASP 51 CO -0.04 -0.99 0.00 0.61 -0.17 0.00 0.00 175.17 174.58 3fbs n GLY 52 N 4.20 0.97 3.78 2.66 0.00 0.19 -4.98 105.19 112.00 3fbs n GLY 52 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3fbs n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fbs s LYS 53 N -0.65 4.06 0.19 1.61 -0.14 -0.71 -4.57 119.74 119.52 3fbs s LYS 53 Ca 0.00 1.62 -0.32 0.00 -1.36 0.00 0.00 55.97 55.91 3fbs s LYS 53 Cb 0.00 -2.54 -0.11 0.00 -1.68 0.00 0.00 37.83 33.50 3fbs s LYS 53 CO 0.00 -0.26 1.67 0.00 -0.76 0.00 0.00 175.35 176.00 3fbs s ALA 54 N -1.59 3.87 0.39 5.17 0.00 -1.26 0.08 121.76 128.42 3fbs s ALA 54 Ca 0.59 1.50 0.06 0.00 0.00 0.00 0.00 51.96 54.11 3fbs s ALA 54 Cb -0.25 -3.67 0.80 0.00 0.00 0.00 0.00 23.12 20.00 3fbs s ALA 54 CO 0.31 -0.89 2.03 -1.00 0.00 0.00 0.00 175.76 176.21 3fbs h PRO 55 N 6.89 0.63 0.00 0.00 0.13 -1.86 -0.78 132.00 137.01 3fbs h PRO 55 Ca -0.43 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 3fbs h PRO 55 Cb 1.20 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 3fbs h PRO 55 CO 0.94 0.42 -0.24 0.78 -0.23 0.00 0.00 178.00 179.67 3fbs h GLY 56 N 0.65 0.00 0.61 1.56 0.00 -1.92 -2.73 103.07 101.24 3fbs h GLY 56 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 3fbs h GLY 56 CO -0.05 0.00 -0.04 0.83 0.00 0.00 0.00 176.54 177.28 3fbs h GLU 57 N 0.00 0.12 -0.64 4.80 5.08 -1.53 -1.41 114.58 121.00 3fbs h GLU 57 Ca -0.00 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.43 3fbs h GLU 57 Cb 0.60 -0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.75 3fbs h GLU 57 CO 0.03 0.54 0.08 0.82 -1.00 0.00 0.00 179.01 179.48 3fbs h ILE 58 N -0.30 0.54 -0.25 3.13 2.04 -1.22 -0.90 117.51 120.54 3fbs h ILE 58 Ca 0.01 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 3fbs h ILE 58 Cb 0.52 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3fbs h ILE 58 CO 0.01 0.03 0.10 0.40 0.00 0.00 0.00 178.15 178.70 3fbs h ILE 59 N 0.19 1.17 -0.29 -0.67 1.08 -1.48 -1.17 117.51 116.34 3fbs h ILE 59 Ca 0.34 -0.53 0.03 0.00 -0.39 0.00 0.00 64.86 64.31 3fbs h ILE 59 Cb 0.55 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 3fbs h ILE 59 CO -0.49 0.18 0.12 0.00 -0.69 0.00 0.00 178.15 177.27 3fbs h ALA 60 N 0.94 0.34 -0.18 1.87 0.00 -0.54 0.65 119.26 122.34 3fbs h ALA 60 Ca 0.08 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3fbs h ALA 60 Cb 0.18 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3fbs h ALA 60 CO -0.01 -0.27 0.10 0.93 0.00 0.00 0.00 179.25 180.00 3fbs h GLU 61 N 0.27 0.25 -0.38 0.00 5.08 -1.08 -2.42 114.58 116.30 3fbs h GLU 61 Ca 0.12 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.51 3fbs h GLU 61 Cb 0.07 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.22 3fbs h GLU 61 CO -0.11 0.23 0.09 0.00 -1.00 0.00 0.00 179.01 178.22 3fbs h ALA 62 N 1.01 0.42 -0.53 3.43 0.00 -0.90 -2.53 119.26 120.16 3fbs h ALA 62 Ca 0.06 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.09 3fbs h ALA 62 Cb 0.05 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3fbs h ALA 62 CO -0.01 -0.31 0.28 0.00 0.00 0.00 0.00 179.25 179.21 3fbs h ARG 63 N 0.22 0.53 -0.81 0.00 3.08 -0.69 -1.37 114.38 115.34 3fbs h ARG 63 Ca 0.18 -0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.33 3fbs h ARG 63 Cb 0.20 -0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.05 3fbs h ARG 63 CO -0.23 0.35 0.41 -0.09 -1.07 0.00 0.00 179.97 179.34 3fbs h ARG 64 N 0.55 0.60 -0.33 0.04 2.43 -1.14 0.21 114.38 116.73 3fbs h ARG 64 Ca 0.23 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.27 3fbs h ARG 64 Cb 0.12 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3fbs h ARG 64 CO -0.15 0.40 -0.16 1.96 -1.51 0.00 0.00 179.97 180.51 3fbs h GLN 65 N 0.62 0.70 -0.13 0.20 4.20 -0.99 -3.24 115.11 116.47 3fbs h GLN 65 Ca 0.43 -0.30 -0.14 0.00 0.06 0.00 0.00 58.65 58.69 3fbs h GLN 65 Cb 0.56 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 3fbs h GLN 65 CO -0.33 0.90 -0.53 0.82 -0.67 0.00 0.00 178.83 179.02 3fbs h ILE 66 N 0.47 1.34 0.00 2.54 2.04 -0.52 -2.70 117.51 120.68 3fbs h ILE 66 Ca 0.08 -1.79 0.00 0.00 1.00 0.00 0.00 64.86 64.14 3fbs h ILE 66 Cb 0.69 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 3fbs h ILE 66 CO 0.05 0.54 0.00 -0.33 0.00 0.00 0.00 178.15 178.41 3fbs h GLU 67 N 0.28 0.00 0.00 2.37 5.08 -0.63 -2.30 114.58 119.38 3fbs h GLU 67 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3fbs h GLU 67 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 3fbs h GLU 67 CO 0.09 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.64 3fbs n ARG 68 N -2.56 0.43 -3.43 2.33 1.74 -1.02 -4.59 116.66 109.56 3fbs n ARG 68 Ca -0.02 0.05 -0.42 0.00 -0.77 0.00 0.00 57.85 56.69 3fbs n ARG 68 Cb 0.07 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.92 3fbs n ARG 68 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3fbs s TYR 69 N -2.45 3.21 -0.18 -1.55 2.02 -0.87 -4.97 117.35 112.56 3fbs s TYR 69 Ca 0.26 -0.30 0.29 0.00 -0.37 0.00 0.00 57.07 56.94 3fbs s TYR 69 Cb 0.16 -2.64 1.21 0.00 -0.40 0.00 0.00 41.96 40.29 3fbs s TYR 69 CO 0.35 -0.51 1.85 -1.00 -1.57 0.00 0.00 175.55 174.67 3fbs h PRO 70 N 8.57 0.00 -0.01 -1.71 0.13 -1.89 -2.62 132.00 134.47 3fbs h PRO 70 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3fbs h PRO 70 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3fbs h PRO 70 CO 0.71 0.00 -0.01 0.25 -0.23 0.00 0.00 178.00 178.72 3fbs n THR 71 N -2.62 0.00 -3.34 1.56 -2.24 -1.26 -4.70 114.28 101.68 3fbs n THR 71 Ca 0.01 -0.16 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 3fbs n THR 71 Cb 0.24 0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.54 3fbs n THR 71 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fbs s ILE 72 N -2.02 5.17 0.05 2.28 1.01 -0.99 -1.55 121.20 125.15 3fbs s ILE 72 Ca 0.41 0.81 0.06 0.00 0.00 0.00 0.00 60.65 61.93 3fbs s ILE 72 Cb 0.21 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3fbs s ILE 72 CO 0.35 0.24 -0.10 -1.00 0.00 0.00 0.00 174.94 174.43 3fbs s HIS 73 N 1.30 2.76 -0.01 3.97 3.76 0.17 -4.96 115.29 122.27 3fbs s HIS 73 Ca 0.21 -0.14 0.07 0.00 -0.15 0.00 0.00 55.06 55.06 3fbs s HIS 73 Cb -0.15 -1.51 -0.02 0.00 1.11 0.00 0.00 32.58 32.02 3fbs s HIS 73 CO 0.09 0.37 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.53 3fbs s TRP 74 N -1.07 2.06 -0.05 1.40 0.52 -1.26 -0.47 118.94 120.07 3fbs s TRP 74 Ca 0.18 -0.39 0.01 0.00 0.02 0.00 0.00 56.10 55.92 3fbs s TRP 74 Cb -0.11 -1.32 0.02 0.00 -1.15 0.00 0.00 33.47 30.91 3fbs s TRP 74 CO 0.10 -0.02 -0.06 0.08 0.02 0.00 0.00 176.95 177.07 3fbs s VAL 75 N -0.57 0.66 -0.37 4.03 1.01 -0.33 -4.94 120.40 119.89 3fbs s VAL 75 Ca 0.09 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.70 3fbs s VAL 75 Cb -0.09 -0.67 0.00 0.00 0.00 0.00 0.00 36.38 35.63 3fbs s VAL 75 CO -0.01 0.26 0.50 -0.70 0.00 0.00 0.00 175.10 175.15 3fbs s GLU 76 N 0.92 3.48 0.00 2.72 2.12 -1.26 -1.64 118.70 125.03 3fbs s GLU 76 Ca -0.11 -0.32 0.00 0.00 0.36 0.00 0.00 54.97 54.90 3fbs s GLU 76 Cb -0.15 -3.85 0.00 0.00 0.26 0.00 0.00 34.13 30.39 3fbs s GLU 76 CO 0.00 -0.71 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 3fbs n GLY 77 N 4.90 -1.63 3.23 -1.50 0.00 -0.28 -4.95 105.19 104.96 3fbs n GLY 77 Ca -0.05 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 3fbs n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fbs s ARG 78 N -1.97 3.14 -0.35 1.61 3.52 -1.26 -2.14 118.95 121.49 3fbs s ARG 78 Ca 0.00 -0.79 -0.29 0.00 -0.13 0.00 0.00 55.73 54.52 3fbs s ARG 78 Cb 0.00 -2.53 -0.00 0.00 -1.56 0.00 0.00 34.95 30.85 3fbs s ARG 78 CO 0.00 0.03 1.54 0.08 -0.81 0.00 0.00 175.30 176.14 3fbs s VAL 79 N 0.76 3.77 -0.99 7.11 1.01 -1.26 -0.55 120.40 130.25 3fbs s VAL 79 Ca -0.07 0.81 0.19 0.00 0.00 0.00 0.00 61.98 62.90 3fbs s VAL 79 Cb -0.16 -3.97 -0.18 0.00 0.00 0.00 0.00 36.38 32.08 3fbs s VAL 79 CO 0.00 -0.57 0.81 0.35 0.00 0.00 0.00 175.10 175.70 3fbs n THR 80 N 7.01 0.00 -3.52 3.92 -2.24 -0.07 -4.95 114.28 114.42 3fbs n THR 80 Ca 0.19 -0.09 -0.17 0.00 -2.27 0.00 0.00 64.05 61.70 3fbs n THR 80 Cb 0.47 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.67 3fbs n THR 80 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3fbs s ASP 81 N -2.68 -0.64 -0.16 3.42 2.15 -1.17 -4.93 116.67 112.66 3fbs s ASP 81 Ca 0.08 0.65 -0.11 0.00 0.43 0.00 0.00 52.55 53.60 3fbs s ASP 81 Cb 0.14 0.54 0.05 0.00 -0.30 0.00 0.00 42.92 43.35 3fbs s ASP 81 CO 0.73 -0.63 0.41 0.00 -0.17 0.00 0.00 175.17 175.51 3fbs s ALA 82 N -1.37 -1.03 0.31 3.66 0.00 -1.26 0.38 121.76 122.45 3fbs s ALA 82 Ca -0.10 1.41 -0.15 0.00 0.00 0.00 0.00 51.96 53.11 3fbs s ALA 82 Cb -0.00 -0.85 0.02 0.00 0.00 0.00 0.00 23.12 22.29 3fbs s ALA 82 CO 0.08 -0.24 0.64 -1.59 0.00 0.00 0.00 175.76 174.65 3fbs s LYS 83 N 1.04 1.85 0.00 0.00 -2.85 -0.38 -4.51 119.74 114.89 3fbs s LYS 83 Ca -0.07 -1.27 0.00 0.00 -1.00 0.00 0.00 55.97 53.63 3fbs s LYS 83 Cb -0.07 0.55 0.00 0.00 -2.06 0.00 0.00 37.83 36.26 3fbs s LYS 83 CO -0.09 -0.82 0.00 0.41 0.10 0.00 0.00 175.35 174.95 3fbs n GLY 84 N -0.47 0.21 1.02 0.59 0.00 -1.26 0.13 105.19 105.41 3fbs n GLY 84 Ca -0.04 -2.01 -0.02 0.00 0.00 0.00 0.00 46.02 43.95 3fbs n GLY 84 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fbs n SER 85 N 0.00 -0.58 -4.62 1.61 3.41 -0.71 -4.90 113.62 107.83 3fbs n SER 85 Ca 0.00 -1.38 -0.58 0.00 -0.26 0.00 0.00 58.87 56.66 3fbs n SER 85 Cb 0.00 0.96 -0.07 0.00 -0.26 0.00 0.00 64.21 64.83 3fbs n SER 85 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3fbs n PHE 86 N -0.16 1.46 0.00 7.33 -0.00 -1.26 0.12 117.46 124.95 3fbs n PHE 86 Ca -0.02 0.80 0.00 0.00 -0.00 0.00 0.00 57.45 58.23 3fbs n PHE 86 Cb 0.16 -2.29 0.00 0.00 -0.00 0.00 0.00 39.48 37.35 3fbs n PHE 86 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fbs n GLY 87 N 2.90 3.00 2.22 7.13 0.00 -0.57 -4.88 105.19 114.99 3fbs n GLY 87 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.02 3fbs n GLY 87 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fbs n GLU 88 N -2.00 0.91 -3.84 1.61 1.02 0.32 -4.10 120.64 114.57 3fbs n GLU 88 Ca 0.00 -3.37 -0.37 0.00 -0.02 0.00 0.00 57.16 53.40 3fbs n GLU 88 Cb 0.00 -1.38 -0.06 0.00 -0.02 0.00 0.00 31.44 29.98 3fbs n GLU 88 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3fbs s PHE 89 N -1.53 3.61 -0.10 -0.32 0.08 -0.31 -1.73 117.98 117.68 3fbs s PHE 89 Ca 0.36 0.58 0.03 0.00 0.12 0.00 0.00 56.93 58.03 3fbs s PHE 89 Cb 0.20 -1.98 -0.00 0.00 -0.57 0.00 0.00 43.02 40.67 3fbs s PHE 89 CO -0.10 0.72 -0.21 0.42 -0.10 0.00 0.00 175.22 175.95 3fbs s ILE 90 N -1.02 2.30 -0.02 0.64 1.09 0.12 -2.24 121.20 122.07 3fbs s ILE 90 Ca 0.16 -0.94 0.07 0.00 -1.10 0.00 0.00 60.65 58.85 3fbs s ILE 90 Cb -0.13 -1.90 -0.02 0.00 -1.06 0.00 0.00 42.46 39.35 3fbs s ILE 90 CO 0.05 0.55 -0.24 -0.69 -0.10 0.00 0.00 174.94 174.51 3fbs s VAL 91 N 0.29 2.21 -0.12 2.92 1.01 0.17 -1.25 120.40 125.63 3fbs s VAL 91 Ca -0.16 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 60.73 3fbs s VAL 91 Cb -0.17 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 3fbs s VAL 91 CO 0.08 0.56 -0.05 -0.70 0.00 0.00 0.00 175.10 174.98 3fbs s GLU 92 N -0.69 3.31 -0.18 2.72 2.12 0.16 -1.67 118.70 124.47 3fbs s GLU 92 Ca 0.10 -0.54 -0.04 0.00 0.36 0.00 0.00 54.97 54.86 3fbs s GLU 92 Cb -0.10 -2.78 -0.02 0.00 0.26 0.00 0.00 34.13 31.49 3fbs s GLU 92 CO -0.00 0.40 -0.03 0.42 -0.54 0.00 0.00 175.26 175.51 3fbs s ILE 93 N -0.09 3.76 -1.55 -3.70 1.01 0.22 -0.90 121.20 119.95 3fbs s ILE 93 Ca 0.01 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.14 3fbs s ILE 93 Cb -0.13 -2.67 0.09 0.00 0.01 0.00 0.00 42.46 39.76 3fbs s ILE 93 CO 0.03 0.46 0.91 0.47 0.00 0.00 0.00 174.94 176.80 3fbs n ASP 94 N 4.02 -4.13 0.00 3.58 8.00 0.29 -1.79 116.55 126.52 3fbs n ASP 94 Ca -0.17 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.49 3fbs n ASP 94 Cb 0.52 -3.63 0.00 0.00 -0.02 0.00 0.00 41.12 37.99 3fbs n ASP 94 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fbs n GLY 95 N -1.64 2.06 0.88 0.44 0.00 -1.26 -4.65 105.19 101.01 3fbs n GLY 95 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3fbs n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fbs n GLY 96 N -1.90 0.13 3.72 -0.02 0.00 -0.83 -5.08 105.19 101.21 3fbs n GLY 96 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3fbs n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3fbs n ARG 97 N -2.32 1.90 -4.61 1.61 0.00 -0.74 -4.70 116.66 107.80 3fbs n ARG 97 Ca 0.00 0.68 -0.26 0.00 -0.00 0.00 0.00 57.85 58.27 3fbs n ARG 97 Cb 0.00 -2.48 -0.17 0.00 0.00 0.00 0.00 32.46 29.82 3fbs n ARG 97 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 3fbs s ARG 98 N -2.45 1.91 0.21 -0.14 3.52 -1.26 -0.61 118.95 120.12 3fbs s ARG 98 Ca 0.64 -0.48 0.03 0.00 -0.13 0.00 0.00 55.73 55.80 3fbs s ARG 98 Cb -0.47 -1.57 -0.05 0.00 -1.56 0.00 0.00 34.95 31.30 3fbs s ARG 98 CO 0.55 0.02 -0.02 -1.21 -0.81 0.00 0.00 175.30 173.83 3fbs s GLU 99 N 0.71 1.25 0.10 5.12 0.41 -0.67 -5.00 118.70 120.63 3fbs s GLU 99 Ca -0.13 -1.61 0.03 0.00 -0.41 0.00 0.00 54.97 52.85 3fbs s GLU 99 Cb -0.16 -0.56 -0.04 0.00 -1.78 0.00 0.00 34.13 31.59 3fbs s GLU 99 CO 0.03 -0.07 -0.09 0.95 -0.49 0.00 0.00 175.26 175.59 3fbs s THR 100 N -3.44 0.91 0.03 3.63 -4.23 -1.26 -0.66 115.64 110.62 3fbs s THR 100 Ca 0.26 -1.74 -0.23 0.00 -1.18 0.00 0.00 61.69 58.80 3fbs s THR 100 Cb 0.05 -1.46 0.05 0.00 1.34 0.00 0.00 72.50 72.48 3fbs s THR 100 CO 0.07 -0.64 0.52 0.00 -0.54 0.00 0.00 174.62 174.03 3fbs s ALA 101 N -2.75 -1.33 -0.13 3.99 0.00 -0.95 -1.13 121.76 119.46 3fbs s ALA 101 Ca 0.08 0.67 0.20 0.00 0.00 0.00 0.00 51.96 52.91 3fbs s ALA 101 Cb -0.01 0.29 0.43 0.00 0.00 0.00 0.00 23.12 23.83 3fbs s ALA 101 CO -0.01 -0.46 1.62 0.78 0.00 0.00 0.00 175.76 177.69 3fbs h GLY 102 N 2.94 0.00 -4.15 0.00 0.00 -1.54 -0.82 103.07 99.49 3fbs h GLY 102 Ca -0.30 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 3fbs h GLY 102 CO 0.41 0.00 -0.69 0.50 0.00 0.00 0.00 176.54 176.76 3fbs s ARG 103 N -3.25 0.45 0.02 4.80 1.81 -1.06 -1.51 118.95 120.22 3fbs s ARG 103 Ca 0.04 -0.90 0.05 0.00 -1.72 0.00 0.00 55.73 53.20 3fbs s ARG 103 Cb 0.08 0.16 -0.02 0.00 -0.45 0.00 0.00 34.95 34.72 3fbs s ARG 103 CO 0.69 -0.08 -0.15 -0.51 -0.68 0.00 0.00 175.30 174.57 3fbs s LEU 104 N -2.15 2.12 -0.14 2.53 1.43 -0.40 -1.53 118.68 120.54 3fbs s LEU 104 Ca -0.05 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 3fbs s LEU 104 Cb -0.01 -0.71 -0.00 0.00 0.03 0.00 0.00 46.19 45.50 3fbs s LEU 104 CO -0.05 0.10 -0.17 -0.63 0.23 0.00 0.00 176.35 175.83 3fbs s ILE 105 N -0.68 2.56 -0.31 -0.59 1.01 -0.33 -0.62 121.20 122.24 3fbs s ILE 105 Ca 0.04 -0.82 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 3fbs s ILE 105 Cb -0.07 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 3fbs s ILE 105 CO 0.01 0.53 0.31 -0.76 0.00 0.00 0.00 174.94 175.02 3fbs s LEU 106 N 0.66 4.24 -0.29 2.97 1.43 0.28 -1.02 118.68 126.95 3fbs s LEU 106 Ca -0.09 -0.06 0.20 0.00 -1.03 0.00 0.00 54.13 53.16 3fbs s LEU 106 Cb -0.16 -2.28 0.49 0.00 0.03 0.00 0.00 46.19 44.26 3fbs s LEU 106 CO 0.02 -0.21 1.09 0.00 0.23 0.00 0.00 176.35 177.48 3fbs n ALA 107 N 5.26 2.82 1.16 4.21 0.00 0.91 -1.53 120.51 133.33 3fbs n ALA 107 Ca -0.11 -2.73 0.14 0.00 0.00 0.00 0.00 53.44 50.74 3fbs n ALA 107 Cb 0.50 -0.90 0.57 0.00 0.00 0.00 0.00 19.45 19.63 3fbs n ALA 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3fbs n MET 108 N -0.48 0.22 0.00 0.00 2.81 -1.12 -4.27 117.12 114.28 3fbs n MET 108 Ca 0.06 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 3fbs n MET 108 Cb 0.81 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.82 3fbs n MET 108 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fbs n GLY 109 N 1.42 -1.27 3.27 3.03 0.00 -1.26 -4.94 105.19 105.43 3fbs n GLY 109 Ca 0.10 -1.15 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 3fbs n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fbs s VAL 110 N 0.00 1.07 -0.12 1.61 -7.23 -1.26 -4.17 120.40 110.31 3fbs s VAL 110 Ca 0.00 -2.04 -0.01 0.00 -1.81 0.00 0.00 61.98 58.11 3fbs s VAL 110 Cb 0.00 -2.03 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 3fbs s VAL 110 CO 0.00 -0.59 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.25 3fbs s THR 111 N -3.39 3.73 -0.20 5.32 2.01 0.36 -4.69 115.64 118.77 3fbs s THR 111 Ca 0.21 -0.44 -0.25 0.00 0.31 0.00 0.00 61.69 61.52 3fbs s THR 111 Cb 0.04 -2.58 -0.01 0.00 0.01 0.00 0.00 72.50 69.96 3fbs s THR 111 CO 0.03 0.54 0.85 -1.81 -0.69 0.00 0.00 174.62 173.55 3fbs s ASP 112 N -0.12 6.93 -0.25 3.53 1.01 -1.26 -0.58 116.67 125.94 3fbs s ASP 112 Ca 0.02 1.15 -0.08 0.00 0.71 0.00 0.00 52.55 54.35 3fbs s ASP 112 Cb -0.13 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 3fbs s ASP 112 CO 0.03 -0.46 0.08 -0.70 0.21 0.00 0.00 175.17 174.32 3fbs s GLU 113 N 2.47 3.68 0.20 8.23 2.12 0.16 -4.91 118.70 130.65 3fbs s GLU 113 Ca 0.38 -0.46 0.04 0.00 0.36 0.00 0.00 54.97 55.29 3fbs s GLU 113 Cb -0.16 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 3fbs s GLU 113 CO 0.10 -0.18 0.28 -0.51 -0.54 0.00 0.00 175.26 174.41 3fbs s LEU 114 N 1.60 4.19 0.41 2.70 1.43 -1.26 -0.51 118.68 127.23 3fbs s LEU 114 Ca 0.06 0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 52.95 3fbs s LEU 114 Cb -0.15 -2.74 -0.11 0.00 0.03 0.00 0.00 46.19 43.22 3fbs s LEU 114 CO 0.04 -0.01 0.95 -2.65 0.23 0.00 0.00 176.35 174.91 3fbs n PRO 115 N -0.95 1.23 -2.51 1.29 -0.02 -1.26 -4.85 135.00 127.91 3fbs n PRO 115 Ca -0.08 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.41 3fbs n PRO 115 Cb 0.56 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3fbs n PRO 115 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3fbs n GLU 116 N 0.23 3.36 -3.97 -0.52 1.02 -1.26 -4.83 120.64 114.66 3fbs n GLU 116 Ca 0.10 -3.48 -0.29 0.00 -0.02 0.00 0.00 57.16 53.47 3fbs n GLU 116 Cb 0.39 -3.11 -0.16 0.00 -0.02 0.00 0.00 31.44 28.53 3fbs n GLU 116 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3fbs s ILE 117 N 1.83 1.39 0.29 -3.67 1.01 -1.26 -5.10 121.20 115.69 3fbs s ILE 117 Ca 0.44 -0.62 -0.27 0.00 0.00 0.00 0.00 60.65 60.20 3fbs s ILE 117 Cb 0.05 -1.39 -0.14 0.00 0.01 0.00 0.00 42.46 40.99 3fbs s ILE 117 CO 0.00 0.33 0.88 0.00 0.00 0.00 0.00 174.94 176.16 3fbs n ALA 118 N 4.81 -0.80 0.00 9.38 0.00 -1.26 -1.64 120.51 131.00 3fbs n ALA 118 Ca -0.15 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3fbs n ALA 118 Cb 0.49 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.01 3fbs n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fbs n GLY 119 N 1.41 2.79 0.09 0.00 0.00 -1.26 -1.36 105.19 106.85 3fbs n GLY 119 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 3fbs n GLY 119 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3fbs h LEU 120 N 0.00 0.15 -0.85 0.99 6.46 -1.56 -3.25 115.31 117.24 3fbs h LEU 120 Ca 0.00 -0.84 0.19 0.00 -0.12 0.00 0.00 57.88 57.11 3fbs h LEU 120 Cb 0.00 -0.05 -0.11 0.00 -0.73 0.00 0.00 40.66 39.77 3fbs h LEU 120 CO 0.00 0.97 0.36 -0.09 -0.62 0.00 0.00 178.44 179.07 3fbs h ARG 121 N -0.65 0.42 0.00 1.25 2.43 -1.88 -0.90 114.38 115.05 3fbs h ARG 121 Ca -0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3fbs h ARG 121 Cb 1.01 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 3fbs h ARG 121 CO 0.04 0.28 -0.03 0.93 -1.51 0.00 0.00 179.97 179.68 3fbs h GLU 122 N 0.43 0.00 -0.23 0.20 3.07 -1.94 -2.58 114.58 113.53 3fbs h GLU 122 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 3fbs h GLU 122 Cb 0.89 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.80 3fbs h GLU 122 CO -0.48 0.03 0.00 0.54 -1.40 0.00 0.00 179.01 177.69 3fbs n ARG 123 N -3.28 1.91 -2.03 2.33 1.74 -0.36 -4.95 116.66 112.02 3fbs n ARG 123 Ca -0.02 -1.76 -0.42 0.00 -0.77 0.00 0.00 57.85 54.88 3fbs n ARG 123 Cb 0.16 -1.30 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 3fbs n ARG 123 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 3fbs s TRP 124 N -1.06 2.02 0.00 -1.55 -0.11 -0.97 -0.99 118.94 116.28 3fbs s TRP 124 Ca 0.22 0.25 0.00 0.00 1.22 0.00 0.00 56.10 57.79 3fbs s TRP 124 Cb 0.13 -3.90 0.00 0.00 -1.50 0.00 0.00 33.47 28.20 3fbs s TRP 124 CO 0.18 -3.71 0.00 0.41 -4.62 0.00 0.00 176.95 169.21 3fbs n GLY 125 N 4.12 1.45 0.00 5.86 0.00 0.56 -4.81 105.19 112.38 3fbs n GLY 125 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3fbs n GLY 125 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fbs n SER 126 N 0.00 4.81 0.00 1.61 3.41 -0.74 -4.22 113.62 118.49 3fbs n SER 126 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3fbs n SER 126 Cb 0.00 0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3fbs n SER 126 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fbs n ALA 127 N -1.93 0.31 -3.30 7.33 0.00 -0.16 -5.04 120.51 117.72 3fbs n ALA 127 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3fbs n ALA 127 Cb 0.47 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.76 3fbs n ALA 127 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3fbs s VAL 128 N -0.27 2.30 0.34 0.00 1.01 -0.25 -0.68 120.40 122.85 3fbs s VAL 128 Ca 0.00 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.10 3fbs s VAL 128 Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 3fbs s VAL 128 CO 0.00 0.55 0.16 -0.36 0.00 0.00 0.00 175.10 175.45 3fbs s PHE 129 N 0.47 1.69 0.00 5.22 0.08 0.51 -0.32 117.98 125.64 3fbs s PHE 129 Ca -0.14 -1.37 0.00 0.00 0.12 0.00 0.00 56.93 55.54 3fbs s PHE 129 Cb -0.17 -0.95 0.00 0.00 -0.57 0.00 0.00 43.02 41.33 3fbs s PHE 129 CO 0.06 -0.48 0.00 -2.39 -0.10 0.00 0.00 175.22 172.30 3fbs n HIS 130 N -0.69 0.00 -3.86 0.36 1.44 -1.26 -1.43 115.22 109.77 3fbs n HIS 130 Ca -0.00 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.41 3fbs n HIS 130 Cb 0.65 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.60 3fbs n HIS 130 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3fbs h PRO 132 N 8.03 0.00 -0.14 0.00 0.13 -1.96 -2.14 132.00 135.94 3fbs h PRO 132 Ca -0.16 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.78 3fbs h PRO 132 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 3fbs h PRO 132 CO 0.40 0.09 -0.69 1.88 -0.23 0.00 0.00 178.00 179.46 3fbs h TYR 133 N 0.00 0.75 -0.33 1.56 0.05 -1.99 0.84 116.97 117.85 3fbs h TYR 133 Ca -0.00 -0.31 -0.06 0.00 0.05 0.00 0.00 58.73 58.42 3fbs h TYR 133 Cb 0.17 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 3fbs h TYR 133 CO 0.00 1.08 -0.01 0.00 -1.05 0.00 0.00 178.16 178.18 3fbs n HIS 135 N -4.52 0.00 -0.06 0.00 8.25 -1.04 -4.48 115.22 113.37 3fbs n HIS 135 Ca -0.02 -0.05 -0.11 0.00 -0.26 0.00 0.00 57.72 57.28 3fbs n HIS 135 Cb 0.27 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.33 3fbs n HIS 135 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3fbs h GLY 136 N 0.00 0.34 1.01 -1.41 0.00 -1.00 -3.33 103.07 98.68 3fbs h GLY 136 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3fbs h GLY 136 CO 0.00 0.20 0.40 -1.82 0.00 0.00 0.00 176.54 175.32 3fbs h TYR 137 N 0.14 1.04 0.00 5.60 3.20 -1.86 -1.21 116.97 123.89 3fbs h TYR 137 Ca 0.06 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3fbs h TYR 137 Cb 0.25 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.19 3fbs h TYR 137 CO 0.01 0.73 0.00 0.39 -1.64 0.00 0.00 178.16 177.65 3fbs n GLU 138 N -4.45 0.62 0.00 1.82 4.71 -1.25 -1.15 120.64 120.95 3fbs n GLU 138 Ca 0.07 0.02 0.12 0.00 -0.01 0.00 0.00 57.16 57.36 3fbs n GLU 138 Cb 0.10 -1.50 0.72 0.00 -1.01 0.00 0.00 31.44 29.75 3fbs n GLU 138 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3fbs n LEU 139 N -1.10 0.00 -3.07 -4.62 4.77 -0.46 -4.92 117.00 107.61 3fbs n LEU 139 Ca 0.16 0.04 -0.22 0.00 -0.03 0.00 0.00 56.01 55.96 3fbs n LEU 139 Cb 0.12 -0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3fbs n LEU 139 CO 0.15 -0.01 -0.01 -0.67 -1.33 0.00 0.00 177.39 175.52 3fbs n ASP 140 N -1.04 -5.67 -1.56 -1.43 2.03 -0.30 -0.99 116.55 107.58 3fbs n ASP 140 Ca 0.18 -0.30 -0.19 0.00 0.52 0.00 0.00 54.79 55.00 3fbs n ASP 140 Cb 0.10 -4.60 -0.07 0.00 -0.72 0.00 0.00 41.12 35.83 3fbs n ASP 140 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fbs n GLN 141 N -3.96 -1.36 0.00 -0.67 6.02 -1.19 -5.01 117.38 111.22 3fbs n GLN 141 Ca -0.10 1.14 0.00 0.00 -0.01 0.00 0.00 57.00 58.03 3fbs n GLN 141 Cb 0.61 -5.48 0.00 0.00 1.02 0.00 0.00 30.24 26.38 3fbs n GLN 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fbs n GLY 142 N -0.68 -1.79 3.75 1.08 0.00 -0.17 -4.39 105.19 103.00 3fbs n GLY 142 Ca -0.20 -1.55 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 3fbs n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fbs s LYS 143 N -2.68 4.53 -0.04 1.61 1.02 -1.26 -3.17 119.74 119.74 3fbs s LYS 143 Ca 0.00 1.12 0.04 0.00 0.02 0.00 0.00 55.97 57.15 3fbs s LYS 143 Cb 0.00 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 3fbs s LYS 143 CO 0.00 0.37 -0.15 0.42 -0.92 0.00 0.00 175.35 175.07 3fbs s ILE 144 N -0.39 1.28 0.07 2.17 1.01 -0.16 0.75 121.20 125.93 3fbs s ILE 144 Ca 0.38 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.43 3fbs s ILE 144 Cb -0.22 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 3fbs s ILE 144 CO 0.24 0.38 0.08 -0.83 0.00 0.00 0.00 174.94 174.82 3fbs s GLY 145 N 0.17 2.03 -0.10 6.18 0.00 -0.47 -1.02 107.32 114.10 3fbs s GLY 145 Ca -0.06 -0.98 0.02 0.00 0.00 0.00 0.00 44.72 43.70 3fbs s GLY 145 CO 0.02 -0.95 -0.16 0.14 0.00 0.00 0.00 173.10 172.15 3fbs s VAL 146 N -1.36 1.50 -0.22 1.40 1.01 -0.35 -0.24 120.40 122.14 3fbs s VAL 146 Ca 0.29 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 3fbs s VAL 146 Cb -0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 3fbs s VAL 146 CO 0.21 0.44 0.04 -0.63 0.00 0.00 0.00 175.10 175.16 3fbs s ILE 147 N 0.81 4.22 -0.05 2.22 1.01 0.45 -0.64 121.20 129.22 3fbs s ILE 147 Ca -0.10 -0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.03 3fbs s ILE 147 Cb -0.16 -2.94 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 3fbs s ILE 147 CO 0.01 0.39 1.44 0.00 0.00 0.00 0.00 174.94 176.78 3fbs s ALA 148 N 1.26 3.61 0.00 9.38 0.00 0.05 -4.42 121.76 131.63 3fbs s ALA 148 Ca 0.04 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.82 3fbs s ALA 148 Cb -0.15 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3fbs s ALA 148 CO 0.03 -1.09 0.00 0.00 0.00 0.00 0.00 175.76 174.69 3fbs n ALA 149 N 6.08 1.56 -3.04 0.00 0.00 -1.26 -4.79 120.51 119.05 3fbs n ALA 149 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.49 3fbs n ALA 149 Cb 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.84 3fbs n ALA 149 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fbs s SER 150 N -1.07 -0.14 0.24 0.00 1.04 -1.26 -4.99 113.70 107.53 3fbs s SER 150 Ca 0.00 -0.61 0.23 0.00 0.48 0.00 0.00 55.95 56.05 3fbs s SER 150 Cb 0.00 0.51 0.96 0.00 0.10 0.00 0.00 66.02 67.59 3fbs s SER 150 CO 0.00 -0.96 1.69 -0.81 0.98 0.00 0.00 173.24 174.13 3fbs n PRO 151 N -0.27 0.18 -0.24 4.02 -0.04 -1.26 -1.23 135.00 136.15 3fbs n PRO 151 Ca -0.10 0.43 0.07 0.00 -0.04 0.00 0.00 63.50 63.86 3fbs n PRO 151 Cb 0.63 -1.85 0.19 0.00 -0.04 0.00 0.00 33.50 32.43 3fbs n PRO 151 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3fbs n MET 152 N -2.19 2.09 -0.22 0.54 2.81 -1.26 -4.57 117.12 114.32 3fbs n MET 152 Ca 0.02 -1.58 0.03 0.00 -1.81 0.00 0.00 57.70 54.36 3fbs n MET 152 Cb 0.21 -1.38 0.13 0.00 -0.71 0.00 0.00 33.22 31.47 3fbs n MET 152 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3fbs h ALA 153 N 3.75 0.73 -0.94 3.04 0.00 -1.58 0.51 119.26 124.77 3fbs h ALA 153 Ca 0.00 0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.16 3fbs h ALA 153 Cb 0.63 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.64 3fbs h ALA 153 CO 0.02 -0.37 0.61 0.82 0.00 0.00 0.00 179.25 180.33 3fbs h ILE 154 N 0.18 1.06 -0.39 0.00 5.03 -1.85 0.29 117.51 121.84 3fbs h ILE 154 Ca 0.35 -0.36 -0.07 0.00 -0.12 0.00 0.00 64.86 64.66 3fbs h ILE 154 Cb 0.58 -0.09 -0.01 0.00 -3.03 0.00 0.00 36.82 34.26 3fbs h ILE 154 CO -0.51 0.19 -0.03 -0.74 -0.68 0.00 0.00 178.15 176.38 3fbs h HIS 155 N 1.06 0.78 -0.69 1.37 2.76 -1.26 -0.56 115.15 118.61 3fbs h HIS 155 Ca 0.41 -0.15 -0.07 0.00 -2.20 0.00 0.00 60.37 58.36 3fbs h HIS 155 Cb 0.21 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.94 3fbs h HIS 155 CO -0.00 0.81 0.16 0.45 -1.30 0.00 0.00 177.93 178.05 3fbs h HIS 156 N 0.53 1.18 -0.72 5.26 3.86 -0.89 -2.80 115.15 121.58 3fbs h HIS 156 Ca 0.11 -0.15 0.05 0.00 -1.16 0.00 0.00 60.37 59.22 3fbs h HIS 156 Cb 0.52 -0.33 -0.04 0.00 1.06 0.00 0.00 27.41 28.62 3fbs h HIS 156 CO 0.04 0.96 0.47 0.00 0.86 0.00 0.00 177.93 180.27 3fbs h ALA 157 N 1.07 1.64 0.00 2.45 0.00 -0.34 -2.12 119.26 121.97 3fbs h ALA 157 Ca 0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3fbs h ALA 157 Cb 0.39 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3fbs h ALA 157 CO 0.00 0.27 -0.15 -0.07 0.00 0.00 0.00 179.25 179.30 3fbs h LEU 158 N 0.82 0.00 0.02 0.00 3.38 -0.89 -3.21 115.31 115.42 3fbs h LEU 158 Ca 0.30 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.99 3fbs h LEU 158 Cb 0.14 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.91 3fbs h LEU 158 CO -0.09 0.15 -1.12 0.24 0.09 0.00 0.00 178.44 177.71 3fbs h MET 159 N 0.00 0.61 0.00 1.13 2.86 -1.13 -3.38 114.93 115.02 3fbs h MET 159 Ca -0.00 -0.73 -0.01 0.00 -2.06 0.00 0.00 59.70 56.90 3fbs h MET 159 Cb 0.87 0.22 -0.00 0.00 0.06 0.00 0.00 31.60 32.76 3fbs h MET 159 CO 0.02 1.31 -0.04 -0.07 1.06 0.00 0.00 176.91 179.19 3fbs h LEU 160 N 0.31 0.00 -1.13 1.22 -0.00 -1.53 -2.07 115.31 112.12 3fbs h LEU 160 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 3fbs h LEU 160 Cb 1.78 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.44 3fbs h LEU 160 CO 0.21 0.04 0.00 -2.65 -0.00 0.00 0.00 178.44 176.04 3fbs n PRO 161 N -3.68 0.14 0.00 1.13 -0.02 -1.26 -0.63 135.00 130.68 3fbs n PRO 161 Ca -0.03 0.57 0.09 0.00 -2.02 0.00 0.00 63.50 62.11 3fbs n PRO 161 Cb 0.13 -1.89 0.39 0.00 -0.02 0.00 0.00 33.50 32.11 3fbs n PRO 161 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3fbs n ASP 162 N -2.18 0.00 -0.00 2.55 9.92 -0.78 -3.38 116.55 122.68 3fbs n ASP 162 Ca -0.00 0.47 0.06 0.00 -0.53 0.00 0.00 54.79 54.79 3fbs n ASP 162 Cb 0.08 -0.49 -0.09 0.00 -0.64 0.00 0.00 41.12 39.98 3fbs n ASP 162 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3fbs n TRP 163 N -1.49 0.00 0.00 1.24 8.01 0.20 -5.07 117.44 120.33 3fbs n TRP 163 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 3fbs n TRP 163 Cb 0.21 -0.23 0.00 0.00 -2.01 0.00 0.00 31.31 29.28 3fbs n TRP 163 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3fbs n GLY 164 N 1.67 -0.30 3.68 6.99 0.00 -1.12 -3.16 105.19 112.96 3fbs n GLY 164 Ca -0.01 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 3fbs n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fbs s GLU 165 N -2.00 4.20 -0.09 1.61 2.02 -1.19 -4.12 118.70 119.13 3fbs s GLU 165 Ca 0.00 2.30 0.01 0.00 0.02 0.00 0.00 54.97 57.30 3fbs s GLU 165 Cb 0.00 -3.67 -0.02 0.00 0.10 0.00 0.00 34.13 30.54 3fbs s GLU 165 CO 0.00 -0.75 -0.10 0.99 0.02 0.00 0.00 175.26 175.42 3fbs s THR 166 N 2.87 3.38 -0.04 3.63 2.01 -1.26 -0.99 115.64 125.25 3fbs s THR 166 Ca 0.74 -0.58 0.06 0.00 0.31 0.00 0.00 61.69 62.21 3fbs s THR 166 Cb -0.38 -2.39 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 3fbs s THR 166 CO 0.32 0.56 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.72 3fbs s THR 167 N -0.35 2.57 -0.23 -0.82 2.01 -0.19 -2.05 115.64 116.58 3fbs s THR 167 Ca 0.04 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.11 3fbs s THR 167 Cb -0.12 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.43 3fbs s THR 167 CO 0.02 0.58 -0.07 0.12 -0.69 0.00 0.00 174.62 174.59 3fbs s PHE 168 N -0.62 2.99 -0.46 4.92 5.36 0.40 -1.21 117.98 129.36 3fbs s PHE 168 Ca 0.09 -1.31 -0.16 0.00 -0.96 0.00 0.00 56.93 54.60 3fbs s PHE 168 Cb -0.11 -2.07 0.06 0.00 -0.34 0.00 0.00 43.02 40.57 3fbs s PHE 168 CO 0.00 -0.67 0.40 -0.06 -1.46 0.00 0.00 175.22 173.44 3fbs s PHE 169 N 1.39 3.22 0.26 10.12 0.40 0.19 0.03 117.98 133.58 3fbs s PHE 169 Ca 0.03 -0.81 0.13 0.00 -0.60 0.00 0.00 56.93 55.68 3fbs s PHE 169 Cb -0.15 -3.09 0.50 0.00 0.51 0.00 0.00 43.02 40.79 3fbs s PHE 169 CO -0.05 -0.78 1.68 1.79 0.70 0.00 0.00 175.22 178.56 3fbs h THR 170 N 5.74 1.26 -6.87 0.64 1.35 -1.73 0.17 112.91 113.47 3fbs h THR 170 Ca -0.28 -1.83 -0.57 0.00 -0.55 0.00 0.00 66.41 63.17 3fbs h THR 170 Cb 1.11 2.02 -0.25 0.00 -1.73 0.00 0.00 68.15 69.30 3fbs h THR 170 CO 0.86 0.51 -0.86 -3.20 -0.25 0.00 0.00 175.52 172.57 3fbs n ASN 171 N -3.76 -2.55 -0.21 5.36 5.15 -1.26 -0.66 115.26 117.32 3fbs n ASN 171 Ca -0.01 -1.09 -0.03 0.00 -0.60 0.00 0.00 54.58 52.85 3fbs n ASN 171 Cb 0.56 -2.41 -0.01 0.00 -0.53 0.00 0.00 39.78 37.39 3fbs n ASN 171 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3fbs n GLY 172 N -1.39 0.41 0.10 8.20 0.00 -1.26 -4.82 105.19 106.42 3fbs n GLY 172 Ca 0.05 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3fbs n GLY 172 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3fbs n ILE 173 N -2.35 1.59 -3.78 -0.61 2.08 0.17 -4.96 119.36 111.50 3fbs n ILE 173 Ca -0.03 -0.77 -0.13 0.00 0.56 0.00 0.00 62.75 62.38 3fbs n ILE 173 Cb 0.38 -1.07 -0.12 0.00 -0.75 0.00 0.00 39.64 38.08 3fbs n ILE 173 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3fbs s VAL 174 N -2.57 -0.01 -0.29 1.39 1.01 -1.24 -5.03 120.40 113.67 3fbs s VAL 174 Ca -0.10 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 3fbs s VAL 174 Cb 0.07 -0.33 0.06 0.00 0.00 0.00 0.00 36.38 36.18 3fbs s VAL 174 CO 0.81 0.01 -0.03 -1.61 0.00 0.00 0.00 175.10 174.28 3fbs s GLU 175 N 0.38 2.33 0.79 2.72 8.01 -1.26 -4.79 118.70 126.88 3fbs s GLU 175 Ca -0.02 -1.33 -0.11 0.00 0.01 0.00 0.00 54.97 53.52 3fbs s GLU 175 Cb -0.04 -3.09 0.07 0.00 -4.31 0.00 0.00 34.13 26.76 3fbs s GLU 175 CO -0.02 -0.62 1.12 -1.25 0.01 0.00 0.00 175.26 174.50 3fbs s PRO 176 N 1.19 2.02 0.00 0.39 0.05 -1.26 -5.04 135.00 132.35 3fbs s PRO 176 Ca -0.06 1.33 0.00 0.00 0.05 0.00 0.00 61.00 62.33 3fbs s PRO 176 Cb -0.20 -1.86 0.00 0.00 0.05 0.00 0.00 34.50 32.49 3fbs s PRO 176 CO -0.03 -1.84 0.00 -0.40 0.05 0.00 0.00 177.00 174.78 3fbs n ASP 177 N -3.48 0.00 0.09 6.66 5.68 -1.26 -4.84 116.55 119.40 3fbs n ASP 177 Ca 0.10 -0.87 -0.04 0.00 -0.50 0.00 0.00 54.79 53.47 3fbs n ASP 177 Cb 0.52 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.50 3fbs n ASP 177 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3fbs h ALA 178 N -1.57 0.58 -0.52 2.12 0.00 -1.98 -1.88 119.26 116.01 3fbs h ALA 178 Ca 0.00 -0.76 -0.06 0.00 0.00 0.00 0.00 54.91 54.09 3fbs h ALA 178 Cb 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3fbs h ALA 178 CO 0.00 1.05 0.09 -0.44 0.00 0.00 0.00 179.25 179.95 3fbs h ASP 179 N 0.00 0.81 0.09 0.00 3.32 -1.99 -1.88 116.42 116.77 3fbs h ASP 179 Ca -0.01 -0.25 -0.15 0.00 0.02 0.00 0.00 57.03 56.64 3fbs h ASP 179 Cb 1.51 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 3fbs h ASP 179 CO 0.11 0.86 -0.54 1.56 -1.72 0.00 0.00 179.24 179.51 3fbs h GLN 180 N 0.73 0.49 -0.19 3.56 4.20 -1.92 -0.51 115.11 121.47 3fbs h GLN 180 Ca 0.16 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 3fbs h GLN 180 Cb 0.38 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 3fbs h GLN 180 CO 0.01 0.90 0.10 0.45 -0.67 0.00 0.00 178.83 179.62 3fbs h HIS 181 N 0.38 0.28 -0.93 2.96 3.86 -1.31 0.31 115.15 120.69 3fbs h HIS 181 Ca 0.01 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3fbs h HIS 181 Cb 1.06 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 29.40 3fbs h HIS 181 CO 0.04 0.28 0.56 0.00 0.86 0.00 0.00 177.93 179.66 3fbs h ALA 182 N 0.97 1.24 0.66 2.45 0.00 -1.19 0.15 119.26 123.55 3fbs h ALA 182 Ca 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3fbs h ALA 182 Cb 0.10 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.52 3fbs h ALA 182 CO -0.01 0.65 -0.32 1.25 0.00 0.00 0.00 179.25 180.82 3fbs h LEU 183 N 1.28 -0.75 -0.91 0.00 5.85 -0.54 -0.15 115.31 120.09 3fbs h LEU 183 Ca 0.33 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 59.20 3fbs h LEU 183 Cb -0.06 0.20 -0.10 0.00 0.37 0.00 0.00 40.66 41.07 3fbs h LEU 183 CO -0.06 -0.44 0.51 -0.07 -0.34 0.00 0.00 178.44 178.03 3fbs h LEU 184 N -1.05 0.65 -0.27 2.25 3.38 -0.17 -1.98 115.31 118.12 3fbs h LEU 184 Ca -0.09 0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 3fbs h LEU 184 Cb 0.72 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3fbs h LEU 184 CO 0.15 0.27 -0.53 0.00 0.09 0.00 0.00 178.44 178.42 3fbs h ALA 185 N 1.58 0.43 -0.36 1.53 0.00 -0.54 -1.29 119.26 120.61 3fbs h ALA 185 Ca 0.50 -0.51 0.10 0.00 0.00 0.00 0.00 54.91 55.00 3fbs h ALA 185 Cb 0.70 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3fbs h ALA 185 CO -0.36 0.63 0.26 0.00 0.00 0.00 0.00 179.25 179.78 3fbs h ALA 186 N 0.66 2.34 0.00 0.00 0.00 -0.31 -0.29 119.26 121.66 3fbs h ALA 186 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fbs h ALA 186 Cb 1.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3fbs h ALA 186 CO 0.12 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.93 3fbs h ARG 187 N 0.00 0.00 0.00 0.00 2.47 -1.16 -3.47 114.38 112.21 3fbs h ARG 187 Ca 0.17 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 3fbs h ARG 187 Cb 0.68 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.00 3fbs h ARG 187 CO -0.00 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.94 3fbs n GLY 188 N 0.81 0.48 3.75 0.04 0.00 -0.12 -4.96 105.19 105.20 3fbs n GLY 188 Ca 0.03 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 3fbs n GLY 188 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fbs s VAL 189 N -2.00 5.16 -0.17 1.61 1.01 -0.51 -4.54 120.40 120.97 3fbs s VAL 189 Ca 0.00 0.84 -0.12 0.00 0.00 0.00 0.00 61.98 62.70 3fbs s VAL 189 Cb 0.00 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 3fbs s VAL 189 CO 0.00 0.41 0.24 -0.60 0.00 0.00 0.00 175.10 175.15 3fbs s ARG 190 N 0.11 4.20 -0.14 2.72 3.00 -0.87 -4.35 118.95 123.63 3fbs s ARG 190 Ca 0.23 -0.01 -0.07 0.00 -1.00 0.00 0.00 55.73 54.89 3fbs s ARG 190 Cb -0.15 -3.41 -0.04 0.00 0.00 0.00 0.00 34.95 31.35 3fbs s ARG 190 CO 0.10 0.29 0.11 0.08 0.00 0.00 0.00 175.30 175.88 3fbs s VAL 191 N 0.34 5.25 -0.07 7.11 1.01 -1.26 -0.46 120.40 132.32 3fbs s VAL 191 Ca 0.14 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.25 3fbs s VAL 191 Cb -0.12 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 32.97 3fbs s VAL 191 CO 0.02 0.57 -0.12 -0.70 0.00 0.00 0.00 175.10 174.87 3fbs s GLU 192 N -0.60 1.67 -0.00 2.72 2.56 0.10 -4.91 118.70 120.23 3fbs s GLU 192 Ca 0.12 -0.39 0.07 0.00 0.00 0.00 0.00 54.97 54.77 3fbs s GLU 192 Cb -0.12 -1.42 -0.08 0.00 2.00 0.00 0.00 34.13 34.51 3fbs s GLU 192 CO 0.02 -0.01 0.25 0.25 -0.56 0.00 0.00 175.26 175.21 3fbs n THR 193 N 3.95 0.00 -2.09 -1.70 -2.24 -1.26 -2.17 114.28 108.78 3fbs n THR 193 Ca -0.22 -0.29 -0.39 0.00 -2.27 0.00 0.00 64.05 60.88 3fbs n THR 193 Cb 0.51 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 3fbs n THR 193 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3fbs s THR 194 N -1.86 2.69 0.52 4.28 2.01 -1.26 -4.48 115.64 117.54 3fbs s THR 194 Ca 0.01 0.61 -0.20 0.00 0.31 0.00 0.00 61.69 62.42 3fbs s THR 194 Cb 0.05 -3.36 -0.06 0.00 0.01 0.00 0.00 72.50 69.14 3fbs s THR 194 CO 0.28 0.09 1.13 -0.13 -0.69 0.00 0.00 174.62 175.29 3fbs s ARG 195 N -2.24 3.49 -0.14 4.92 0.52 -1.26 -4.54 118.95 119.70 3fbs s ARG 195 Ca 0.57 1.62 -0.29 0.00 -0.52 0.00 0.00 55.73 57.11 3fbs s ARG 195 Cb -0.37 -2.11 -0.01 0.00 0.52 0.00 0.00 34.95 32.98 3fbs s ARG 195 CO 0.47 -0.74 1.08 0.42 0.02 0.00 0.00 175.30 176.56 3fbs s ILE 196 N -1.74 4.59 -0.10 1.52 1.01 -1.26 -0.02 121.20 125.20 3fbs s ILE 196 Ca 0.70 1.89 -0.22 0.00 0.00 0.00 0.00 60.65 63.03 3fbs s ILE 196 Cb -0.24 -4.22 -0.28 0.00 0.01 0.00 0.00 42.46 37.73 3fbs s ILE 196 CO 0.28 -0.07 0.71 -0.09 0.00 0.00 0.00 174.94 175.77 3fbs h ARG 197 N 7.41 0.19 -2.46 2.79 2.43 0.39 -3.45 114.38 121.67 3fbs h ARG 197 Ca -0.27 -0.32 0.13 0.00 -0.81 0.00 0.00 59.98 58.70 3fbs h ARG 197 Cb 1.12 0.12 -0.10 0.00 -0.42 0.00 0.00 29.97 30.69 3fbs h ARG 197 CO 0.91 1.15 0.43 -1.83 -1.51 0.00 0.00 179.97 179.13 3fbs s GLU 198 N -2.39 1.16 -0.23 0.20 -1.05 -0.91 -4.39 118.70 111.09 3fbs s GLU 198 Ca -0.18 -0.57 -0.13 0.00 -0.15 0.00 0.00 54.97 53.94 3fbs s GLU 198 Cb 0.01 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 34.10 3fbs s GLU 198 CO 0.76 -0.52 0.26 0.42 0.95 0.00 0.00 175.26 177.13 3fbs s ILE 199 N -3.35 5.28 0.38 1.83 -1.09 -0.47 -0.87 121.20 122.92 3fbs s ILE 199 Ca 0.09 0.39 0.04 0.00 -2.23 0.00 0.00 60.65 58.94 3fbs s ILE 199 Cb -0.02 -3.60 -0.03 0.00 -1.58 0.00 0.00 42.46 37.23 3fbs s ILE 199 CO -0.02 0.29 0.11 0.00 -1.23 0.00 0.00 174.94 174.09 3fbs s ALA 200 N 1.29 2.74 0.00 9.38 0.00 0.15 -4.39 121.76 130.93 3fbs s ALA 200 Ca 0.12 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.64 3fbs s ALA 200 Cb -0.14 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.73 3fbs s ALA 200 CO 0.07 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.90 3fbs n GLY 201 N -0.84 2.92 0.06 0.00 0.00 -1.26 -0.22 105.19 105.85 3fbs n GLY 201 Ca -0.05 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.58 3fbs n GLY 201 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3fbs h HIS 202 N 0.00 -0.12 -0.81 1.61 -0.00 -1.98 -3.43 115.15 110.42 3fbs h HIS 202 Ca 0.00 -0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 60.05 3fbs h HIS 202 Cb 0.00 0.04 -0.40 0.00 -0.00 0.00 0.00 27.41 27.05 3fbs h HIS 202 CO 0.00 -0.07 -1.16 0.00 -0.00 0.00 0.00 177.93 176.70 3fbs n ALA 203 N -2.21 3.13 -2.56 5.26 0.00 -1.23 -4.82 120.51 118.09 3fbs n ALA 203 Ca -0.02 -2.98 -0.38 0.00 0.00 0.00 0.00 53.44 50.06 3fbs n ALA 203 Cb 0.05 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 3fbs n ALA 203 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fbs s ASP 204 N -3.29 6.84 -0.38 0.00 1.01 0.69 -3.66 116.67 117.88 3fbs s ASP 204 Ca 0.27 1.00 -0.15 0.00 0.71 0.00 0.00 52.55 54.37 3fbs s ASP 204 Cb 0.42 -2.31 0.01 0.00 1.01 0.00 0.00 42.92 42.04 3fbs s ASP 204 CO 0.01 0.12 0.34 -0.69 0.21 0.00 0.00 175.17 175.17 3fbs s VAL 205 N -0.14 5.20 -0.39 -1.27 1.01 -0.68 0.32 120.40 124.46 3fbs s VAL 205 Ca 0.27 -0.32 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 3fbs s VAL 205 Cb -0.17 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.33 3fbs s VAL 205 CO 0.14 -0.23 0.63 -0.69 0.00 0.00 0.00 175.10 174.95 3fbs s VAL 206 N 1.89 4.87 0.55 2.92 1.01 -0.05 -0.57 120.40 131.03 3fbs s VAL 206 Ca 0.09 0.39 -0.10 0.00 0.00 0.00 0.00 61.98 62.36 3fbs s VAL 206 Cb -0.18 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 3fbs s VAL 206 CO 0.11 -0.42 0.94 -0.76 0.00 0.00 0.00 175.10 174.98 3fbs s LEU 207 N 2.75 3.43 0.27 3.92 1.43 -0.15 0.99 118.68 131.32 3fbs s LEU 207 Ca 0.24 1.31 -0.00 0.00 -1.03 0.00 0.00 54.13 54.64 3fbs s LEU 207 Cb -0.14 -4.30 0.52 0.00 0.03 0.00 0.00 46.19 42.29 3fbs s LEU 207 CO 0.16 -0.72 1.81 0.00 0.23 0.00 0.00 176.35 177.83 3fbs h ALA 208 N 0.13 1.38 0.00 4.21 0.00 -0.74 -1.43 119.26 122.80 3fbs h ALA 208 Ca -0.45 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3fbs h ALA 208 Cb 1.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3fbs h ALA 208 CO 0.62 0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.56 3fbs n ASP 209 N -4.72 0.00 0.00 0.00 5.68 -1.26 -4.86 116.55 111.38 3fbs n ASP 209 Ca 0.17 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 54.02 3fbs n ASP 209 Cb 0.37 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 3fbs n ASP 209 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fbs n GLY 210 N 0.32 1.12 3.76 6.12 0.00 -0.54 -5.05 105.19 110.92 3fbs n GLY 210 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 3fbs n GLY 210 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fbs s ARG 211 N -0.98 2.95 -0.09 1.61 0.52 -1.26 -4.82 118.95 116.89 3fbs s ARG 211 Ca 0.00 1.56 0.02 0.00 -0.52 0.00 0.00 55.73 56.79 3fbs s ARG 211 Cb 0.00 -1.96 0.01 0.00 0.52 0.00 0.00 34.95 33.53 3fbs s ARG 211 CO 0.00 -1.16 -0.14 0.45 0.02 0.00 0.00 175.30 174.47 3fbs s SER 212 N -2.12 2.19 -0.33 0.23 0.15 -1.26 -0.97 113.70 111.59 3fbs s SER 212 Ca 0.71 -0.38 -0.12 0.00 0.70 0.00 0.00 55.95 56.86 3fbs s SER 212 Cb -0.24 -0.99 -0.02 0.00 -1.71 0.00 0.00 66.02 63.06 3fbs s SER 212 CO 0.36 0.03 0.22 -0.63 1.20 0.00 0.00 173.24 174.42 3fbs s ILE 213 N 0.82 5.20 -0.10 6.45 -1.09 0.27 -4.94 121.20 127.81 3fbs s ILE 213 Ca -0.11 -0.18 -0.26 0.00 -2.23 0.00 0.00 60.65 57.88 3fbs s ILE 213 Cb -0.15 -3.63 -0.03 0.00 -1.58 0.00 0.00 42.46 37.07 3fbs s ILE 213 CO 0.01 0.04 0.82 0.00 -1.23 0.00 0.00 174.94 174.58 3fbs s ALA 214 N 1.71 3.39 0.10 9.38 0.00 -1.26 -1.69 121.76 133.39 3fbs s ALA 214 Ca 0.06 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.23 3fbs s ALA 214 Cb -0.17 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 3fbs s ALA 214 CO 0.10 -0.38 -0.11 -0.51 0.00 0.00 0.00 175.76 174.86 3fbs s LEU 215 N 1.46 2.40 0.27 0.00 1.43 -1.24 -4.91 118.68 118.10 3fbs s LEU 215 Ca 0.41 -0.81 0.11 0.00 -1.03 0.00 0.00 54.13 52.81 3fbs s LEU 215 Cb -0.18 -0.35 0.32 0.00 0.03 0.00 0.00 46.19 46.02 3fbs s LEU 215 CO 0.17 -0.24 1.59 0.00 0.23 0.00 0.00 176.35 178.10 3fbs h ALA 216 N 3.58 0.91 -2.05 4.21 0.00 0.04 -3.38 119.26 122.56 3fbs h ALA 216 Ca -0.38 -0.58 0.15 0.00 0.00 0.00 0.00 54.91 54.11 3fbs h ALA 216 Cb 1.19 -0.10 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 3fbs h ALA 216 CO 0.52 0.79 0.58 0.20 0.00 0.00 0.00 179.25 181.34 3fbs s GLY 217 N -4.48 -0.42 0.03 0.00 0.00 -1.19 -4.82 107.32 96.44 3fbs s GLY 217 Ca -0.01 1.19 0.06 0.00 0.00 0.00 0.00 44.72 45.96 3fbs s GLY 217 CO 0.76 0.40 -0.17 1.08 0.00 0.00 0.00 173.10 175.17 3fbs s LEU 218 N -2.38 2.15 -0.03 0.66 1.43 0.14 -1.37 118.68 119.27 3fbs s LEU 218 Ca 0.06 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 3fbs s LEU 218 Cb -0.01 -0.76 -0.01 0.00 0.03 0.00 0.00 46.19 45.44 3fbs s LEU 218 CO -0.08 0.10 -0.18 -0.36 0.23 0.00 0.00 176.35 176.06 3fbs s PHE 219 N -0.75 1.76 0.24 0.29 0.08 0.67 -0.36 117.98 119.92 3fbs s PHE 219 Ca 0.04 -0.45 -0.14 0.00 0.12 0.00 0.00 56.93 56.50 3fbs s PHE 219 Cb -0.08 -1.17 0.00 0.00 -0.57 0.00 0.00 43.02 41.21 3fbs s PHE 219 CO 0.01 -0.12 0.50 -0.08 -0.10 0.00 0.00 175.22 175.43 3fbs s THR 220 N -0.15 0.01 -0.24 0.64 -1.32 -0.52 -0.41 115.64 113.64 3fbs s THR 220 Ca 0.00 -1.28 -0.06 0.00 -1.21 0.00 0.00 61.69 59.14 3fbs s THR 220 Cb -0.10 -2.07 -0.02 0.00 -1.51 0.00 0.00 72.50 68.80 3fbs s THR 220 CO 0.01 -0.04 0.04 -1.58 -2.21 0.00 0.00 174.62 170.85 3fbs s GLN 221 N -3.98 3.54 0.71 7.08 0.74 -1.26 -4.17 119.66 122.31 3fbs s GLN 221 Ca 0.19 -0.54 -0.09 0.00 0.05 0.00 0.00 55.36 54.97 3fbs s GLN 221 Cb -0.01 -3.25 0.04 0.00 1.10 0.00 0.00 33.01 30.90 3fbs s GLN 221 CO 0.07 -0.21 1.06 -1.25 -0.55 0.00 0.00 175.29 174.40 3fbs s PRO 222 N 1.57 2.47 -0.19 1.67 0.04 -1.26 -4.74 135.00 134.56 3fbs s PRO 222 Ca 0.06 0.09 -0.06 0.00 0.04 0.00 0.00 61.00 61.13 3fbs s PRO 222 Cb -0.15 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 3fbs s PRO 222 CO 0.02 -1.16 0.02 0.21 0.04 0.00 0.00 177.00 176.13 3fbs s LYS 223 N -5.31 3.78 -0.12 4.56 2.20 0.33 -4.88 119.74 120.30 3fbs s LYS 223 Ca 0.59 -0.44 -0.21 0.00 -0.36 0.00 0.00 55.97 55.54 3fbs s LYS 223 Cb -0.11 -3.12 -0.03 0.00 -1.51 0.00 0.00 37.83 33.06 3fbs s LYS 223 CO 0.48 0.16 0.62 -0.51 -0.36 0.00 0.00 175.35 175.74 3fbs s LEU 224 N 0.63 4.25 -0.00 5.43 1.43 -0.68 -0.66 118.68 129.07 3fbs s LEU 224 Ca 0.01 0.99 0.07 0.00 -1.03 0.00 0.00 54.13 54.16 3fbs s LEU 224 Cb -0.14 -2.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.13 3fbs s LEU 224 CO 0.02 -0.13 -0.21 -0.13 0.23 0.00 0.00 176.35 176.13 3fbs s ARG 225 N 1.09 2.17 -0.36 1.70 0.52 0.26 -1.21 118.95 123.12 3fbs s ARG 225 Ca 0.32 -0.90 -0.13 0.00 -0.52 0.00 0.00 55.73 54.50 3fbs s ARG 225 Cb -0.16 -2.17 -0.00 0.00 0.52 0.00 0.00 34.95 33.13 3fbs s ARG 225 CO 0.14 0.57 0.25 0.42 0.02 0.00 0.00 175.30 176.69 3fbs s ILE 226 N -0.76 5.19 -0.86 1.52 1.01 -1.26 -0.49 121.20 125.56 3fbs s ILE 226 Ca 0.12 -0.38 -0.00 0.00 0.00 0.00 0.00 60.65 60.39 3fbs s ILE 226 Cb -0.10 -3.74 0.34 0.00 0.01 0.00 0.00 42.46 38.98 3fbs s ILE 226 CO 0.01 -0.09 1.78 0.35 0.00 0.00 0.00 174.94 176.99 3fbs n THR 227 N 5.11 4.39 -4.41 2.92 -2.24 -1.26 -4.87 114.28 113.91 3fbs n THR 227 Ca -0.12 -5.10 -0.24 0.00 -2.27 0.00 0.00 64.05 56.31 3fbs n THR 227 Cb 0.49 -1.37 -0.11 0.00 -2.10 0.00 0.00 70.33 67.24 3fbs n THR 227 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3fbs s VAL 228 N -4.80 2.21 -1.91 2.28 -7.23 -1.26 -5.06 120.40 104.64 3fbs s VAL 228 Ca 0.46 -2.15 0.22 0.00 -1.81 0.00 0.00 61.98 58.70 3fbs s VAL 228 Cb 0.33 -2.11 0.65 0.00 0.56 0.00 0.00 36.38 35.81 3fbs s VAL 228 CO -0.27 -0.31 1.55 -0.90 -0.31 0.00 0.00 175.10 174.86 3fbs n ASP 229 N -0.09 3.99 -0.14 4.85 5.68 -1.26 -4.59 116.55 124.98 3fbs n ASP 229 Ca -0.10 -2.05 0.03 0.00 -0.50 0.00 0.00 54.79 52.17 3fbs n ASP 229 Cb 0.58 -0.50 0.05 0.00 -1.14 0.00 0.00 41.12 40.12 3fbs n ASP 229 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 3fbs n TRP 230 N 1.58 0.10 -0.17 2.11 4.27 -1.26 -4.65 117.44 119.42 3fbs n TRP 230 Ca 0.24 -0.58 -0.08 0.00 -3.89 0.00 0.00 57.50 53.19 3fbs n TRP 230 Cb 0.64 -0.07 0.01 0.00 -1.36 0.00 0.00 31.31 30.53 3fbs n TRP 230 CO 0.00 0.00 0.00 0.82 -2.29 0.00 0.00 177.69 176.22 3fbs h ILE 231 N 0.38 1.22 -0.75 -1.67 1.08 -1.91 -2.87 117.51 112.99 3fbs h ILE 231 Ca 0.00 -0.69 0.12 0.00 -0.39 0.00 0.00 64.86 63.90 3fbs h ILE 231 Cb 0.64 0.74 -0.08 0.00 -3.07 0.00 0.00 36.82 35.04 3fbs h ILE 231 CO 0.01 0.26 0.34 -0.33 -0.69 0.00 0.00 178.15 177.73 3fbs h GLU 232 N 0.67 0.51 -0.00 2.37 5.08 -1.87 -1.05 114.58 120.29 3fbs h GLU 232 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3fbs h GLU 232 Cb 0.22 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3fbs h GLU 232 CO -0.01 0.34 -0.09 0.36 -1.00 0.00 0.00 179.01 178.61 3fbs n LYS 233 N -4.93 0.47 0.14 2.33 2.85 -1.10 -1.01 118.16 116.92 3fbs n LYS 233 Ca 0.13 -0.12 0.12 0.00 -1.05 0.00 0.00 58.31 57.40 3fbs n LYS 233 Cb 0.36 -1.50 0.16 0.00 -0.65 0.00 0.00 35.03 33.40 3fbs n LYS 233 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 3fbs h LEU 234 N 0.28 0.00 0.00 -5.58 3.38 -1.06 -3.41 115.31 108.93 3fbs h LEU 234 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3fbs h LEU 234 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3fbs h LEU 234 CO 0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 3fbs n GLY 235 N 1.20 0.54 3.73 0.83 0.00 -0.18 -4.86 105.19 106.44 3fbs n GLY 235 Ca 0.03 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3fbs n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fbs s ALA 237 N 0.42 3.10 -0.04 0.00 0.00 -1.26 -4.79 121.76 119.19 3fbs s ALA 237 Ca 0.54 0.95 0.04 0.00 0.00 0.00 0.00 51.96 53.49 3fbs s ALA 237 Cb -0.29 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.45 3fbs s ALA 237 CO 0.32 -0.55 -0.17 0.08 0.00 0.00 0.00 175.76 175.44 3fbs s VAL 238 N -1.46 1.41 -0.21 0.00 1.01 -1.26 -1.56 120.40 118.34 3fbs s VAL 238 Ca 0.59 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 61.62 3fbs s VAL 238 Cb -0.30 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 3fbs s VAL 238 CO 0.37 0.41 0.74 -0.70 0.00 0.00 0.00 175.10 175.92 3fbs s GLU 239 N -0.04 4.21 -0.15 2.72 2.12 0.16 -4.90 118.70 122.82 3fbs s GLU 239 Ca -0.02 0.82 0.01 0.00 0.36 0.00 0.00 54.97 56.14 3fbs s GLU 239 Cb -0.11 -3.61 0.01 0.00 0.26 0.00 0.00 34.13 30.68 3fbs s GLU 239 CO 0.02 -0.37 -0.18 -1.21 -0.54 0.00 0.00 175.26 172.97 3fbs s GLU 240 N 2.32 3.10 0.30 4.30 0.41 -1.26 -1.00 118.70 126.88 3fbs s GLU 240 Ca 0.33 -0.80 0.03 0.00 -0.41 0.00 0.00 54.97 54.11 3fbs s GLU 240 Cb -0.16 -2.55 -0.01 0.00 -1.78 0.00 0.00 34.13 29.63 3fbs s GLU 240 CO 0.10 -0.04 0.33 0.41 -0.49 0.00 0.00 175.26 175.57 3fbs n GLY 241 N 4.17 2.67 0.37 -1.39 0.00 -0.44 -5.00 105.19 105.57 3fbs n GLY 241 Ca -0.20 -1.74 0.04 0.00 0.00 0.00 0.00 46.02 44.12 3fbs n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fbs h PRO 242 N 0.00 1.11 -0.69 1.61 0.13 -2.02 -1.73 132.00 130.41 3fbs h PRO 242 Ca -0.22 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3fbs h PRO 242 Cb 1.05 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3fbs h PRO 242 CO 0.31 0.73 0.00 -1.33 -0.23 0.00 0.00 178.00 177.48 3fbs n MET 243 N -4.52 3.46 0.00 0.86 2.81 -1.26 -4.91 117.12 113.55 3fbs n MET 243 Ca 0.16 -2.11 0.00 0.00 -1.81 0.00 0.00 57.70 53.94 3fbs n MET 243 Cb 0.22 -1.94 0.00 0.00 -0.71 0.00 0.00 33.22 30.79 3fbs n MET 243 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fbs n GLY 244 N 0.55 0.44 3.23 3.03 0.00 -0.65 -1.69 105.19 110.10 3fbs n GLY 244 Ca 0.19 -2.13 -0.28 0.00 0.00 0.00 0.00 46.02 43.79 3fbs n GLY 244 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fbs s SER 245 N -4.00 2.62 -0.03 1.61 0.01 -0.35 -1.32 113.70 112.24 3fbs s SER 245 Ca 0.00 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.85 3fbs s SER 245 Cb 0.00 -0.46 0.03 0.00 0.21 0.00 0.00 66.02 65.80 3fbs s SER 245 CO 0.00 0.25 -0.00 -0.89 0.41 0.00 0.00 173.24 173.00 3fbs s THR 246 N -0.35 0.21 0.19 1.44 2.01 -0.17 -4.75 115.64 114.22 3fbs s THR 246 Ca 0.04 0.07 -0.32 0.00 0.31 0.00 0.00 61.69 61.79 3fbs s THR 246 Cb -0.10 -0.30 -0.11 0.00 0.01 0.00 0.00 72.50 72.00 3fbs s THR 246 CO 0.01 0.15 1.62 -0.63 -0.69 0.00 0.00 174.62 175.08 3fbs s ILE 247 N 1.02 2.38 0.15 1.82 1.01 -0.29 0.37 121.20 127.66 3fbs s ILE 247 Ca -0.10 0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 3fbs s ILE 247 Cb -0.14 -3.18 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 3fbs s ILE 247 CO -0.02 0.02 1.29 -0.69 0.00 0.00 0.00 174.94 175.55 3fbs s VAL 248 N 1.08 3.45 0.05 2.92 1.01 -0.60 -4.58 120.40 123.73 3fbs s VAL 248 Ca 0.71 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 63.80 3fbs s VAL 248 Cb -0.46 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 3fbs s VAL 248 CO 0.32 0.14 0.00 0.42 0.00 0.00 0.00 175.10 175.98 3fbs s THR 249 N 0.50 0.19 0.37 3.92 -4.23 -1.26 -4.01 115.64 111.11 3fbs s THR 249 Ca 0.58 -1.56 -0.03 0.00 -1.18 0.00 0.00 61.69 59.51 3fbs s THR 249 Cb -0.35 -1.27 0.08 0.00 1.34 0.00 0.00 72.50 72.30 3fbs s THR 249 CO 0.34 -0.86 0.50 -0.90 -0.54 0.00 0.00 174.62 173.17 3fbs n ASP 250 N 0.36 0.41 0.03 3.99 5.68 -0.17 -4.91 116.55 121.94 3fbs n ASP 250 Ca -0.16 -1.41 0.11 0.00 -0.50 0.00 0.00 54.79 52.83 3fbs n ASP 250 Cb 0.60 -0.35 0.44 0.00 -1.14 0.00 0.00 41.12 40.67 3fbs n ASP 250 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 3fbs n PRO 251 N -1.99 0.06 -0.44 0.11 -0.02 -1.26 -1.31 135.00 130.15 3fbs n PRO 251 Ca 0.07 0.19 0.06 0.00 -2.02 0.00 0.00 63.50 61.81 3fbs n PRO 251 Cb 0.26 -1.59 0.24 0.00 -0.02 0.00 0.00 33.50 32.39 3fbs n PRO 251 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3fbs n MET 252 N -1.69 2.93 -1.27 -0.52 2.81 -1.26 -4.94 117.12 113.18 3fbs n MET 252 Ca 0.05 -1.88 -0.09 0.00 -1.81 0.00 0.00 57.70 53.97 3fbs n MET 252 Cb 0.26 -1.74 -0.04 0.00 -0.71 0.00 0.00 33.22 30.99 3fbs n MET 252 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3fbs n LYS 253 N 0.59 -1.30 -3.01 0.03 4.76 -0.43 -4.68 118.16 114.12 3fbs n LYS 253 Ca 0.17 0.78 -0.39 0.00 -2.87 0.00 0.00 58.31 55.99 3fbs n LYS 253 Cb 0.67 -4.95 -0.06 0.00 -1.84 0.00 0.00 35.03 28.85 3fbs n LYS 253 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3fbs s GLN 254 N -2.59 4.51 0.86 1.97 0.74 -1.26 -0.78 119.66 123.11 3fbs s GLN 254 Ca 0.00 1.09 -0.15 0.00 0.05 0.00 0.00 55.36 56.35 3fbs s GLN 254 Cb 0.00 -3.29 0.20 0.00 1.10 0.00 0.00 33.01 31.02 3fbs s GLN 254 CO 0.00 0.50 1.08 0.25 -0.55 0.00 0.00 175.29 176.57 3fbs n THR 255 N 1.95 0.00 1.06 -0.34 -2.24 -0.14 -1.00 114.28 113.57 3fbs n THR 255 Ca -0.05 -0.75 0.10 0.00 -2.27 0.00 0.00 64.05 61.08 3fbs n THR 255 Cb 0.49 -1.52 0.54 0.00 -2.10 0.00 0.00 70.33 67.74 3fbs n THR 255 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3fbs n THR 256 N -3.70 0.27 -3.72 4.28 -2.24 -1.26 -4.57 114.28 103.34 3fbs n THR 256 Ca 0.14 0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.61 3fbs n THR 256 Cb 0.49 -0.74 -0.12 0.00 -2.10 0.00 0.00 70.33 67.85 3fbs n THR 256 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fbs s ALA 257 N -2.38 3.18 0.06 6.98 0.00 -1.26 -4.90 121.76 123.43 3fbs s ALA 257 Ca 0.23 -1.28 -0.36 0.00 0.00 0.00 0.00 51.96 50.54 3fbs s ALA 257 Cb 0.14 -2.19 -0.15 0.00 0.00 0.00 0.00 23.12 20.91 3fbs s ALA 257 CO 0.28 -0.72 1.50 -2.13 0.00 0.00 0.00 175.76 174.69 3fbs n ARG 258 N 4.93 1.53 -0.72 0.00 0.63 -1.26 -1.85 116.66 119.91 3fbs n ARG 258 Ca -0.15 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.33 3fbs n ARG 258 Cb 0.50 -2.25 0.00 0.00 0.45 0.00 0.00 32.46 31.16 3fbs n ARG 258 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fbs n GLY 259 N 3.12 0.80 3.22 5.14 0.00 -1.26 -4.13 105.19 112.07 3fbs n GLY 259 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3fbs n GLY 259 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fbs s ILE 260 N -3.02 2.35 0.28 -0.61 1.01 -0.77 -1.27 121.20 119.16 3fbs s ILE 260 Ca 0.00 -0.89 0.11 0.00 0.00 0.00 0.00 60.65 59.87 3fbs s ILE 260 Cb 0.00 -1.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.46 3fbs s ILE 260 CO 0.00 0.53 -0.10 -0.36 0.00 0.00 0.00 174.94 175.02 3fbs s PHE 261 N 0.76 2.48 -0.07 3.97 0.08 0.21 -0.96 117.98 124.45 3fbs s PHE 261 Ca -0.07 -0.30 -0.09 0.00 0.12 0.00 0.00 56.93 56.59 3fbs s PHE 261 Cb -0.16 -1.13 0.02 0.00 -0.57 0.00 0.00 43.02 41.18 3fbs s PHE 261 CO 0.00 0.65 0.23 0.00 -0.10 0.00 0.00 175.22 176.00 3fbs s ALA 262 N -2.44 -0.56 0.16 5.36 0.00 0.04 0.99 121.76 125.30 3fbs s ALA 262 Ca 0.31 0.53 -0.21 0.00 0.00 0.00 0.00 51.96 52.59 3fbs s ALA 262 Cb -0.05 -0.28 0.06 0.00 0.00 0.00 0.00 23.12 22.85 3fbs s ALA 262 CO 0.17 -0.14 0.54 0.00 0.00 0.00 0.00 175.76 176.34 3fbs n GLY 264 N -0.34 -1.59 0.32 0.00 0.00 -1.26 -4.34 105.19 97.98 3fbs n GLY 264 Ca -0.16 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.59 3fbs n GLY 264 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3fbs h ASP 265 N 0.00 0.17 0.16 1.61 5.19 -1.91 0.56 116.42 122.19 3fbs h ASP 265 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 3fbs h ASP 265 Cb 0.00 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 39.47 3fbs h ASP 265 CO 0.00 0.11 -0.05 1.62 -3.12 0.00 0.00 179.24 177.80 3fbs h VAL 266 N 0.19 0.52 -0.13 -1.35 3.04 -1.76 -2.53 116.25 114.22 3fbs h VAL 266 Ca 0.15 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3fbs h VAL 266 Cb 0.35 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 3fbs h VAL 266 CO -0.02 0.05 0.00 0.00 -1.01 0.00 0.00 177.57 176.58 3fbs n ALA 267 N -2.29 2.09 -3.39 3.17 0.00 0.13 -1.14 120.51 119.08 3fbs n ALA 267 Ca -0.02 -1.03 -0.12 0.00 0.00 0.00 0.00 53.44 52.27 3fbs n ALA 267 Cb 0.15 -0.18 -0.09 0.00 0.00 0.00 0.00 19.45 19.33 3fbs n ALA 267 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3fbs s ARG 268 N -0.97 0.31 0.43 0.00 3.52 -0.85 -4.82 118.95 116.57 3fbs s ARG 268 Ca 0.09 0.44 0.17 0.00 -0.13 0.00 0.00 55.73 56.30 3fbs s ARG 268 Cb 0.05 -0.67 0.98 0.00 -1.56 0.00 0.00 34.95 33.74 3fbs s ARG 268 CO 0.06 -0.65 1.93 -1.00 -0.81 0.00 0.00 175.30 174.83 3fbs h PRO 269 N 8.22 0.00 -2.87 5.12 0.13 -1.90 -3.15 132.00 137.55 3fbs h PRO 269 Ca -0.19 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.28 3fbs h PRO 269 Cb 1.15 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.90 3fbs h PRO 269 CO 0.28 0.25 -0.23 0.00 -0.23 0.00 0.00 178.00 178.07 3fbs n ALA 270 N -2.43 3.99 -2.26 -0.56 0.00 -1.26 -5.07 120.51 112.92 3fbs n ALA 270 Ca -0.02 -4.67 -0.22 0.00 0.00 0.00 0.00 53.44 48.54 3fbs n ALA 270 Cb 0.32 -1.40 0.01 0.00 0.00 0.00 0.00 19.45 18.39 3fbs n ALA 270 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3fbs s GLY 271 N -1.37 1.64 0.30 0.00 0.00 -1.19 -5.07 107.32 101.63 3fbs s GLY 271 Ca 0.31 -1.20 -0.09 0.00 0.00 0.00 0.00 44.72 43.74 3fbs s GLY 271 CO -0.07 -1.02 0.50 -1.35 0.00 0.00 0.00 173.10 171.16 3fbs s SER 272 N -4.26 0.29 0.09 1.64 1.04 -1.26 -5.03 113.70 106.21 3fbs s SER 272 Ca 0.50 -1.17 -0.19 0.00 0.48 0.00 0.00 55.95 55.57 3fbs s SER 272 Cb -0.10 0.64 -0.08 0.00 0.10 0.00 0.00 66.02 66.58 3fbs s SER 272 CO 0.37 -1.25 1.58 0.58 0.98 0.00 0.00 173.24 175.49 3fbs h VAL 273 N 2.18 1.22 -0.60 5.02 2.07 -1.96 0.13 116.25 124.31 3fbs h VAL 273 Ca -0.28 -0.72 0.08 0.00 0.82 0.00 0.00 66.70 66.60 3fbs h VAL 273 Cb 1.25 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 32.17 3fbs h VAL 273 CO 0.38 0.23 0.26 0.00 0.02 0.00 0.00 177.57 178.45 3fbs h ALA 274 N 0.87 0.78 0.01 1.67 0.00 -1.96 -0.62 119.26 120.01 3fbs h ALA 274 Ca 0.08 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 3fbs h ALA 274 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3fbs h ALA 274 CO 0.00 -0.14 -0.93 -0.07 0.00 0.00 0.00 179.25 178.11 3fbs h LEU 275 N 0.47 0.07 -0.82 0.00 3.38 -1.90 -2.17 115.31 114.33 3fbs h LEU 275 Ca 0.29 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.21 3fbs h LEU 275 Cb 0.31 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3fbs h LEU 275 CO -0.26 0.96 0.54 0.00 0.09 0.00 0.00 178.44 179.77 3fbs h ALA 276 N 1.03 1.05 -0.29 1.53 0.00 -0.03 0.20 119.26 122.76 3fbs h ALA 276 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3fbs h ALA 276 Cb 1.63 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 3fbs h ALA 276 CO 0.13 0.42 0.09 0.28 0.00 0.00 0.00 179.25 180.17 3fbs h VAL 277 N 1.09 1.20 0.06 0.00 2.07 -1.04 0.12 116.25 119.75 3fbs h VAL 277 Ca 0.31 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 3fbs h VAL 277 Cb -0.10 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3fbs h VAL 277 CO -0.08 0.21 -0.03 1.23 0.02 0.00 0.00 177.57 178.93 3fbs h GLY 278 N 0.30 -0.08 1.33 2.17 0.00 -1.31 -1.65 103.07 103.82 3fbs h GLY 278 Ca 0.09 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.41 3fbs h GLY 278 CO -0.00 -0.03 0.16 -0.55 0.00 0.00 0.00 176.54 176.12 3fbs h ASP 279 N -0.14 0.79 -0.62 0.19 3.32 -0.87 -2.01 116.42 117.08 3fbs h ASP 279 Ca -0.01 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.82 3fbs h ASP 279 Cb 0.12 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3fbs h ASP 279 CO 0.01 0.75 0.04 1.23 -1.72 0.00 0.00 179.24 179.55 3fbs h GLY 280 N 0.97 1.16 1.01 2.75 0.00 -0.61 0.37 103.07 108.73 3fbs h GLY 280 Ca 0.19 -0.82 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 3fbs h GLY 280 CO -0.01 0.76 0.21 0.00 0.00 0.00 0.00 176.54 177.50 3fbs h ALA 281 N 1.03 0.82 -0.64 3.60 0.00 -0.95 -0.67 119.26 122.46 3fbs h ALA 281 Ca 0.18 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3fbs h ALA 281 Cb 0.52 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3fbs h ALA 281 CO 0.02 0.48 0.25 0.52 0.00 0.00 0.00 179.25 180.52 3fbs h MET 282 N 0.90 0.96 -0.47 0.00 2.07 -1.10 -2.12 114.93 115.17 3fbs h MET 282 Ca 0.21 -0.18 -0.11 0.00 -2.07 0.00 0.00 59.70 57.55 3fbs h MET 282 Cb 0.27 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 29.83 3fbs h MET 282 CO -0.01 0.81 -0.13 0.00 1.07 0.00 0.00 176.91 178.66 3fbs h ALA 283 N 1.10 0.88 -0.49 6.32 0.00 -0.57 -0.68 119.26 125.81 3fbs h ALA 283 Ca 0.21 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 3fbs h ALA 283 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3fbs h ALA 283 CO -0.02 0.64 -0.01 0.78 0.00 0.00 0.00 179.25 180.64 3fbs h GLY 284 N 0.96 0.95 1.47 0.00 0.00 -1.04 -1.43 103.07 103.98 3fbs h GLY 284 Ca 0.12 -0.71 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 3fbs h GLY 284 CO 0.05 0.65 -0.01 0.00 0.00 0.00 0.00 176.54 177.23 3fbs h ALA 285 N 0.93 1.23 -0.25 3.60 0.00 -1.21 -1.86 119.26 121.69 3fbs h ALA 285 Ca 0.14 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 3fbs h ALA 285 Cb 0.53 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3fbs h ALA 285 CO 0.03 0.51 -0.46 0.00 0.00 0.00 0.00 179.25 179.32 3fbs h ALA 286 N 1.38 0.71 -0.30 0.00 0.00 -0.85 0.13 119.26 120.32 3fbs h ALA 286 Ca 0.12 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 3fbs h ALA 286 Cb 0.40 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3fbs h ALA 286 CO 0.02 0.67 0.07 0.00 0.00 0.00 0.00 179.25 180.00 3fbs h ALA 287 N 0.95 0.39 -0.26 0.00 0.00 -1.19 0.21 119.26 119.36 3fbs h ALA 287 Ca 0.03 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.82 3fbs h ALA 287 Cb 1.01 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 3fbs h ALA 287 CO 0.09 0.06 -0.07 1.25 0.00 0.00 0.00 179.25 180.58 3fbs h HIS 288 N 0.31 -0.16 -0.31 0.00 6.17 -1.01 -2.41 115.15 117.74 3fbs h HIS 288 Ca 0.09 0.02 -0.02 0.00 0.71 0.00 0.00 60.37 61.17 3fbs h HIS 288 Cb 0.30 0.11 -0.02 0.00 2.52 0.00 0.00 27.41 30.33 3fbs h HIS 288 CO 0.02 -0.12 0.10 0.00 0.71 0.00 0.00 177.93 178.63 3fbs h ARG 289 N -0.02 0.45 0.00 5.26 3.08 -0.68 -1.28 114.38 121.19 3fbs h ARG 289 Ca 0.13 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 3fbs h ARG 289 Cb 0.21 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 3fbs h ARG 289 CO -0.27 0.40 -0.12 0.66 -1.07 0.00 0.00 179.97 179.56 3fbs h SER 290 N 0.44 0.00 0.12 7.04 4.64 -0.63 0.20 113.55 125.37 3fbs h SER 290 Ca 0.11 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.24 3fbs h SER 290 Cb 0.14 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.25 3fbs h SER 290 CO -0.01 0.12 -0.81 0.40 -0.87 0.00 0.00 176.83 175.67 3fbs h ILE 291 N 0.00 1.49 -0.48 0.95 2.04 -0.78 -3.22 117.51 117.51 3fbs h ILE 291 Ca -0.00 -2.47 -0.11 0.00 1.00 0.00 0.00 64.86 63.28 3fbs h ILE 291 Cb 0.71 3.10 -0.02 0.00 -0.74 0.00 0.00 36.82 39.87 3fbs h ILE 291 CO 0.02 0.70 -0.13 -0.07 0.00 0.00 0.00 178.15 178.67 3fbs h LEU 292 N -0.31 0.89 -6.28 1.44 3.38 -1.26 -3.36 115.31 109.81 3fbs h LEU 292 Ca -0.14 -0.29 -0.59 0.00 0.09 0.00 0.00 57.88 56.95 3fbs h LEU 292 Cb 1.61 -0.24 -0.41 0.00 0.09 0.00 0.00 40.66 41.71 3fbs h LEU 292 CO 0.15 1.03 -0.73 0.49 0.09 0.00 0.00 178.44 179.46 3fbs n PHE 293 N -4.15 2.37 -2.39 1.13 3.72 0.69 -5.09 117.46 113.74 3fbs n PHE 293 Ca 0.01 -3.99 -0.43 0.00 -0.05 0.00 0.00 57.45 53.00 3fbs n PHE 293 Cb 0.39 -0.47 -0.02 0.00 -0.94 0.00 0.00 39.48 38.44 3fbs n PHE 293 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3fbs s PRO 294 N -1.88 4.28 0.00 -1.08 0.04 -1.22 -4.67 135.00 130.47 3fbs s PRO 294 Ca 0.36 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.13 3fbs s PRO 294 Cb 0.12 -3.68 0.00 0.00 0.04 0.00 0.00 34.50 30.98 3fbs s PRO 294 CO -0.07 -0.60 0.00 -1.91 0.04 0.00 0.00 177.00 174.46