#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fyu s GLU 2 N 0.00 4.45 0.00 5.55 -1.05 -0.75 -4.80 118.70 122.10 1fyu s GLU 2 Ca 0.00 1.23 0.08 0.00 -0.15 0.00 0.00 54.97 56.13 1fyu s GLU 2 Cb 0.00 -3.50 -0.02 0.00 -0.44 0.00 0.00 34.13 30.17 1fyu s GLU 2 CO 0.00 -0.15 -0.26 0.99 0.95 0.00 0.00 175.26 176.79 1fyu s THR 3 N 1.43 2.09 0.08 1.83 2.01 -1.26 -1.70 115.64 120.12 1fyu s THR 3 Ca 0.46 -1.21 0.10 0.00 0.31 0.00 0.00 61.69 61.34 1fyu s THR 3 Cb -0.19 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 1fyu s THR 3 CO 0.21 0.50 -0.26 -0.51 -0.69 0.00 0.00 174.62 173.87 1fyu s ILE 4 N -0.68 2.12 -0.29 1.82 1.10 -1.03 -5.01 121.20 119.22 1fyu s ILE 4 Ca 0.11 -1.51 -0.15 0.00 -0.51 0.00 0.00 60.65 58.59 1fyu s ILE 4 Cb -0.10 -1.84 0.14 0.00 0.15 0.00 0.00 42.46 40.81 1fyu s ILE 4 CO 0.00 0.24 0.92 -0.55 -2.11 0.00 0.00 174.94 173.44 1fyu s SER 5 N -1.55 -0.63 0.09 4.50 0.15 -1.26 -2.07 113.70 112.93 1fyu s SER 5 Ca 0.12 0.94 0.00 0.00 0.70 0.00 0.00 55.95 57.72 1fyu s SER 5 Cb -0.10 1.45 -0.04 0.00 -1.71 0.00 0.00 66.02 65.62 1fyu s SER 5 CO 0.03 -0.14 -0.03 0.72 1.20 0.00 0.00 173.24 175.02 1fyu s PHE 6 N 1.82 0.75 -0.18 3.44 -0.71 -0.59 -5.01 117.98 117.51 1fyu s PHE 6 Ca -0.07 -1.03 -0.13 0.00 -1.04 0.00 0.00 56.93 54.66 1fyu s PHE 6 Cb -0.05 -0.47 0.05 0.00 -1.21 0.00 0.00 43.02 41.34 1fyu s PHE 6 CO -0.17 -0.30 0.45 0.45 -1.34 0.00 0.00 175.22 174.32 1fyu s SER 7 N -3.00 -0.54 -0.29 1.98 0.15 -1.26 -1.26 113.70 109.48 1fyu s SER 7 Ca 0.12 0.96 0.01 0.00 0.70 0.00 0.00 55.95 57.74 1fyu s SER 7 Cb 0.07 0.89 0.09 0.00 -1.71 0.00 0.00 66.02 65.36 1fyu s SER 7 CO -0.06 -0.18 0.04 -0.36 1.20 0.00 0.00 173.24 173.89 1fyu s PHE 8 N 0.92 2.34 0.25 3.44 0.08 0.09 -4.96 117.98 120.14 1fyu s PHE 8 Ca -0.05 -1.99 -0.03 0.00 0.12 0.00 0.00 56.93 54.97 1fyu s PHE 8 Cb -0.06 -1.93 0.31 0.00 -0.57 0.00 0.00 43.02 40.77 1fyu s PHE 8 CO -0.08 -0.85 1.78 0.77 -0.10 0.00 0.00 175.22 176.74 1fyu h SER 9 N 7.95 0.85 -5.22 1.36 0.02 -1.88 -2.46 113.55 114.17 1fyu h SER 9 Ca -0.13 -0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 60.60 1fyu h SER 9 Cb 1.04 -0.22 -0.09 0.00 0.14 0.00 0.00 62.40 63.26 1fyu h SER 9 CO 0.46 0.85 -0.09 -1.83 -1.14 0.00 0.00 176.83 175.07 1fyu s GLU 10 N -5.17 1.54 -0.03 3.45 -1.05 -1.26 -4.43 118.70 111.76 1fyu s GLU 10 Ca -0.10 -1.21 -0.02 0.00 -0.15 0.00 0.00 54.97 53.49 1fyu s GLU 10 Cb 0.15 0.48 -0.04 0.00 -0.44 0.00 0.00 34.13 34.28 1fyu s GLU 10 CO 0.82 -0.64 0.10 -0.06 0.95 0.00 0.00 175.26 176.42 1fyu s PHE 11 N -4.00 3.36 -0.07 4.83 0.08 -0.48 -5.00 117.98 116.69 1fyu s PHE 11 Ca 0.21 0.27 0.03 0.00 0.12 0.00 0.00 56.93 57.55 1fyu s PHE 11 Cb -0.01 -1.78 0.01 0.00 -0.57 0.00 0.00 43.02 40.67 1fyu s PHE 11 CO 0.08 0.58 -0.15 -1.83 -0.10 0.00 0.00 175.22 173.81 1fyu s GLU 12 N -1.62 1.94 0.32 0.44 -1.05 -1.26 -4.10 118.70 113.37 1fyu s GLU 12 Ca 0.22 -0.51 -0.28 0.00 -0.15 0.00 0.00 54.97 54.25 1fyu s GLU 12 Cb -0.12 -1.57 -0.13 0.00 -0.44 0.00 0.00 34.13 31.88 1fyu s GLU 12 CO 0.13 0.07 1.27 -2.30 0.95 0.00 0.00 175.26 175.38 1fyu n PRO 13 N 3.71 2.02 0.00 -4.83 -0.02 -1.26 -2.56 135.00 132.07 1fyu n PRO 13 Ca -0.22 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1fyu n PRO 13 Cb 0.52 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1fyu n PRO 13 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fyu n GLY 14 N 1.01 3.08 3.39 -1.23 0.00 -1.26 -4.97 105.19 105.21 1fyu n GLY 14 Ca 0.06 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.56 1fyu n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fyu n ASN 15 N 0.12 1.60 0.00 1.61 2.85 -1.06 -4.77 115.26 115.62 1fyu n ASN 15 Ca 0.00 0.44 0.05 0.00 -0.11 0.00 0.00 54.58 54.97 1fyu n ASN 15 Cb 0.00 -1.14 0.33 0.00 1.24 0.00 0.00 39.78 40.20 1fyu n ASN 15 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1fyu n ASP 16 N 9.41 0.00 0.00 1.20 3.85 -1.26 -2.51 116.55 127.24 1fyu n ASP 16 Ca 0.47 -0.74 0.13 0.00 -0.71 0.00 0.00 54.79 53.94 1fyu n ASP 16 Cb 0.15 0.00 0.50 0.00 -1.35 0.00 0.00 41.12 40.42 1fyu n ASP 16 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1fyu n ASN 17 N -0.82 0.17 -4.26 -1.12 3.02 -1.26 -4.79 115.26 106.20 1fyu n ASN 17 Ca 0.08 0.28 -0.30 0.00 -0.03 0.00 0.00 54.58 54.61 1fyu n ASN 17 Cb 0.04 -0.28 -0.16 0.00 -0.61 0.00 0.00 39.78 38.77 1fyu n ASN 17 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1fyu s LEU 18 N -3.04 2.05 -0.25 3.41 1.43 -1.04 -0.71 118.68 120.51 1fyu s LEU 18 Ca 0.13 -0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1fyu s LEU 18 Cb 0.18 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 1fyu s LEU 18 CO 0.58 0.26 0.11 -0.89 0.23 0.00 0.00 176.35 176.64 1fyu s THR 19 N -0.29 4.67 -0.17 5.49 2.01 0.64 -4.84 115.64 123.15 1fyu s THR 19 Ca 0.01 -0.05 -0.08 0.00 0.31 0.00 0.00 61.69 61.88 1fyu s THR 19 Cb -0.12 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 1fyu s THR 19 CO 0.02 0.32 0.09 -0.76 -0.69 0.00 0.00 174.62 173.60 1fyu s LEU 20 N 1.53 4.00 0.15 4.42 1.02 -1.26 -0.47 118.68 128.08 1fyu s LEU 20 Ca 0.06 0.20 0.08 0.00 0.02 0.00 0.00 54.13 54.48 1fyu s LEU 20 Cb -0.15 -2.00 -0.04 0.00 0.02 0.00 0.00 46.19 44.01 1fyu s LEU 20 CO 0.06 0.24 -0.17 -1.10 0.02 0.00 0.00 176.35 175.39 1fyu s GLN 21 N 0.01 1.19 6.03 1.70 -0.21 0.09 -5.00 119.66 123.47 1fyu s GLN 21 Ca 0.07 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 54.10 1fyu s GLN 21 Cb -0.12 -1.18 0.00 0.00 1.00 0.00 0.00 33.01 32.72 1fyu s GLN 21 CO 0.00 0.23 0.00 0.41 -2.12 0.00 0.00 175.29 173.82 1fyu n GLY 22 N 0.35 3.00 0.22 3.09 0.00 -1.26 -1.74 105.19 108.85 1fyu n GLY 22 Ca -0.14 -0.36 0.15 0.00 0.00 0.00 0.00 46.02 45.67 1fyu n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fyu h ALA 23 N -0.99 1.00 -0.96 4.61 0.00 -0.53 -3.47 119.26 118.92 1fyu h ALA 23 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 54.19 1fyu h ALA 23 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 17.79 17.86 1fyu h ALA 23 CO 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 179.12 1fyu n ALA 24 N -1.98 -3.30 -3.28 0.00 0.00 -1.04 -4.61 120.51 106.30 1fyu n ALA 24 Ca 0.02 0.53 -0.14 0.00 0.00 0.00 0.00 53.44 53.84 1fyu n ALA 24 Cb 0.32 -1.64 -0.08 0.00 0.00 0.00 0.00 19.45 18.04 1fyu n ALA 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1fyu s LEU 25 N 0.94 0.63 -0.25 0.00 0.20 -0.65 -4.74 118.68 114.82 1fyu s LEU 25 Ca 0.79 0.21 -0.04 0.00 0.69 0.00 0.00 54.13 55.78 1fyu s LEU 25 Cb -1.11 1.44 0.01 0.00 -0.43 0.00 0.00 46.19 46.10 1fyu s LEU 25 CO 0.54 -0.45 -0.03 -0.63 -0.29 0.00 0.00 176.35 175.50 1fyu s ILE 26 N -1.23 3.28 0.86 6.68 1.01 -1.26 -0.25 121.20 130.29 1fyu s ILE 26 Ca -0.13 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 59.64 1fyu s ILE 26 Cb -0.04 -2.61 0.11 0.00 0.01 0.00 0.00 42.46 39.93 1fyu s ILE 26 CO 0.05 0.26 1.10 0.42 0.00 0.00 0.00 174.94 176.77 1fyu s THR 27 N 1.42 2.65 0.31 2.92 -4.23 -0.31 -4.69 115.64 113.71 1fyu s THR 27 Ca 0.03 0.21 0.16 0.00 -1.18 0.00 0.00 61.69 60.91 1fyu s THR 27 Cb -0.16 -2.88 0.11 0.00 1.34 0.00 0.00 72.50 70.92 1fyu s THR 27 CO -0.03 -0.28 1.81 -0.61 -0.54 0.00 0.00 174.62 174.97 1fyu h GLN 28 N -1.35 0.00 0.00 3.99 4.15 -1.95 -2.05 115.11 117.90 1fyu h GLN 28 Ca -0.49 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.93 1fyu h GLN 28 Cb 1.29 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.98 1fyu h GLN 28 CO 0.59 0.37 0.00 -1.13 -1.93 0.00 0.00 178.83 176.73 1fyu n SER 29 N -3.85 0.00 0.00 -0.69 3.41 -1.26 -4.89 113.62 106.34 1fyu n SER 29 Ca -0.01 -0.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 1fyu n SER 29 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1fyu n SER 29 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fyu n GLY 30 N 0.60 0.75 3.88 5.00 0.00 -0.77 -4.98 105.19 109.67 1fyu n GLY 30 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1fyu n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fyu s VAL 31 N -2.43 5.41 -0.41 1.61 0.11 -1.26 -1.38 120.40 122.04 1fyu s VAL 31 Ca 0.00 0.18 -0.20 0.00 -2.93 0.00 0.00 61.98 59.03 1fyu s VAL 31 Cb 0.00 -3.49 0.02 0.00 -1.53 0.00 0.00 36.38 31.37 1fyu s VAL 31 CO 0.00 0.50 0.62 -0.22 -3.33 0.00 0.00 175.10 172.67 1fyu s LEU 32 N -1.38 4.44 -0.56 2.54 2.96 -0.53 -1.17 118.68 124.98 1fyu s LEU 32 Ca 0.21 -0.21 -0.17 0.00 -0.22 0.00 0.00 54.13 53.73 1fyu s LEU 32 Cb -0.13 -2.71 0.12 0.00 0.50 0.00 0.00 46.19 43.97 1fyu s LEU 32 CO 0.10 -0.70 0.59 -1.10 -1.32 0.00 0.00 176.35 173.92 1fyu s GLN 33 N 2.72 3.02 0.20 1.98 -0.21 0.66 -0.78 119.66 127.24 1fyu s GLN 33 Ca 0.22 -1.55 -0.11 0.00 0.02 0.00 0.00 55.36 53.93 1fyu s GLN 33 Cb -0.14 -4.29 0.15 0.00 1.00 0.00 0.00 33.01 29.73 1fyu s GLN 33 CO 0.17 -1.42 1.84 -0.07 -2.12 0.00 0.00 175.29 173.69 1fyu h LEU 34 N 9.34 0.66 -9.37 2.90 3.38 -1.62 -1.72 115.31 118.88 1fyu h LEU 34 Ca -0.30 -0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.06 1fyu h LEU 34 Cb 1.09 -0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.57 1fyu h LEU 34 CO 1.06 0.47 -0.71 0.42 0.09 0.00 0.00 178.44 179.77 1fyu s THR 35 N -6.13 3.26 0.48 0.22 -4.23 -1.26 -2.53 115.64 105.45 1fyu s THR 35 Ca -0.13 -1.68 -0.24 0.00 -1.18 0.00 0.00 61.69 58.46 1fyu s THR 35 Cb 0.14 -2.64 -0.07 0.00 1.34 0.00 0.00 72.50 71.27 1fyu s THR 35 CO 0.76 -0.15 1.40 -0.75 -0.54 0.00 0.00 174.62 175.34 1fyu s LYS 36 N -2.96 3.54 -0.09 3.99 2.20 -1.26 -4.77 119.74 120.39 1fyu s LYS 36 Ca 0.26 2.35 0.01 0.00 -0.36 0.00 0.00 55.97 58.23 1fyu s LYS 36 Cb -0.08 -2.55 0.02 0.00 -1.51 0.00 0.00 37.83 33.71 1fyu s LYS 36 CO 0.16 -0.91 -0.08 0.42 -0.36 0.00 0.00 175.35 174.58 1fyu s ILE 37 N -1.23 0.96 1.04 5.43 1.01 -1.26 -1.48 121.20 125.66 1fyu s ILE 37 Ca 0.64 -0.30 -0.12 0.00 0.00 0.00 0.00 60.65 60.87 1fyu s ILE 37 Cb -0.42 -0.95 0.22 0.00 0.01 0.00 0.00 42.46 41.31 1fyu s ILE 37 CO 0.53 0.34 1.07 0.20 0.00 0.00 0.00 174.94 177.08 1fyu s ASN 38 N 1.30 2.06 0.60 3.58 0.01 0.71 -4.86 114.94 118.34 1fyu s ASN 38 Ca -0.03 1.53 0.40 0.00 -0.71 0.00 0.00 52.86 54.05 1fyu s ASN 38 Cb -0.14 -2.22 2.08 0.00 0.41 0.00 0.00 41.25 41.38 1fyu s ASN 38 CO -0.03 -3.53 2.21 -0.61 -1.51 0.00 0.00 177.10 173.63 1fyu h GLN 39 N -2.16 0.00 -0.23 -0.60 4.15 -2.01 -0.96 115.11 113.29 1fyu h GLN 39 Ca -0.55 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.87 1fyu h GLN 39 Cb 1.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1fyu h GLN 39 CO 0.52 0.00 0.00 0.27 -1.93 0.00 0.00 178.83 177.69 1fyu n ASN 40 N -2.97 1.56 0.00 -0.69 6.94 -1.26 -4.91 115.26 113.93 1fyu n ASN 40 Ca -0.02 -1.84 0.00 0.00 -0.02 0.00 0.00 54.58 52.70 1fyu n ASN 40 Cb 0.11 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 1fyu n ASN 40 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fyu n GLY 41 N 1.04 0.76 3.89 4.83 0.00 -0.36 -5.05 105.19 110.29 1fyu n GLY 41 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1fyu n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fyu s MET 42 N -0.16 3.41 0.27 1.61 -1.94 -1.26 -4.86 119.30 116.38 1fyu s MET 42 Ca 0.00 -0.29 -0.29 0.00 -1.71 0.00 0.00 55.69 53.40 1fyu s MET 42 Cb 0.00 -3.10 -0.09 0.00 2.01 0.00 0.00 34.83 33.64 1fyu s MET 42 CO 0.00 0.70 1.14 -1.25 -0.01 0.00 0.00 175.02 175.60 1fyu s PRO 43 N -1.69 4.58 0.00 2.03 0.04 -1.26 -0.21 135.00 138.50 1fyu s PRO 43 Ca 0.24 1.87 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 1fyu s PRO 43 Cb -0.12 -3.18 -0.06 0.00 0.04 0.00 0.00 34.50 31.18 1fyu s PRO 43 CO 0.15 0.12 0.41 0.00 0.04 0.00 0.00 177.00 177.72 1fyu s ALA 44 N -1.02 3.70 0.85 8.56 0.00 -0.55 -4.76 121.76 128.54 1fyu s ALA 44 Ca 0.46 -0.21 -0.13 0.00 0.00 0.00 0.00 51.96 52.08 1fyu s ALA 44 Cb -0.33 -2.39 0.10 0.00 0.00 0.00 0.00 23.12 20.50 1fyu s ALA 44 CO 0.42 0.48 1.19 1.67 0.00 0.00 0.00 175.76 179.53 1fyu s TRP 45 N -1.09 2.70 -1.41 0.00 1.48 -1.26 -4.20 118.94 115.15 1fyu s TRP 45 Ca 0.24 0.70 -0.09 0.00 -1.06 0.00 0.00 56.10 55.90 1fyu s TRP 45 Cb -0.17 -3.57 0.04 0.00 -1.16 0.00 0.00 33.47 28.62 1fyu s TRP 45 CO 0.14 -1.98 0.99 -3.47 -4.06 0.00 0.00 176.95 168.57 1fyu n ASP 46 N -3.44 -4.37 -4.27 -2.66 4.64 0.23 -4.92 116.55 101.75 1fyu n ASP 46 Ca 0.09 -0.70 -0.28 0.00 -1.38 0.00 0.00 54.79 52.52 1fyu n ASP 46 Cb 0.61 -4.36 -0.15 0.00 -1.04 0.00 0.00 41.12 36.18 1fyu n ASP 46 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 1fyu s SER 47 N -3.60 2.69 -0.01 1.67 0.15 -1.25 -4.96 113.70 108.38 1fyu s SER 47 Ca 0.47 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.64 1fyu s SER 47 Cb -0.22 -0.26 0.02 0.00 -1.71 0.00 0.00 66.02 63.84 1fyu s SER 47 CO 0.79 0.23 0.01 -0.89 1.20 0.00 0.00 173.24 174.58 1fyu s THR 48 N -0.67 0.02 -0.03 6.45 2.01 -1.26 -0.52 115.64 121.64 1fyu s THR 48 Ca 0.09 0.10 -0.13 0.00 0.31 0.00 0.00 61.69 62.06 1fyu s THR 48 Cb -0.09 -0.10 0.02 0.00 0.01 0.00 0.00 72.50 72.34 1fyu s THR 48 CO 0.01 0.07 0.28 -0.83 -0.69 0.00 0.00 174.62 173.45 1fyu s GLY 49 N 0.63 -0.13 0.05 4.40 0.00 -0.77 0.15 107.32 111.65 1fyu s GLY 49 Ca -0.05 0.33 -0.03 0.00 0.00 0.00 0.00 44.72 44.96 1fyu s GLY 49 CO -0.02 0.14 0.03 0.50 0.00 0.00 0.00 173.10 173.76 1fyu s ARG 50 N -1.12 0.60 -0.06 2.90 0.52 -0.71 -1.26 118.95 119.82 1fyu s ARG 50 Ca -0.12 -0.98 -0.01 0.00 -0.52 0.00 0.00 55.73 54.10 1fyu s ARG 50 Cb -0.05 0.22 0.03 0.00 0.52 0.00 0.00 34.95 35.67 1fyu s ARG 50 CO 0.03 -0.13 0.01 0.99 0.02 0.00 0.00 175.30 176.22 1fyu s THR 51 N -3.26 0.29 0.05 0.02 2.01 0.41 -0.73 115.64 114.43 1fyu s THR 51 Ca 0.01 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1fyu s THR 51 Cb 0.03 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.05 1fyu s THR 51 CO -0.08 0.24 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.26 1fyu s LEU 52 N 1.93 3.12 0.19 4.42 2.01 0.38 -0.74 118.68 129.99 1fyu s LEU 52 Ca 0.04 -0.25 -0.30 0.00 0.01 0.00 0.00 54.13 53.63 1fyu s LEU 52 Cb -0.12 -1.85 -0.08 0.00 0.01 0.00 0.00 46.19 44.14 1fyu s LEU 52 CO -0.05 0.23 1.27 -0.47 1.01 0.00 0.00 176.35 178.35 1fyu s TYR 53 N -1.10 3.32 -1.00 0.29 6.04 -0.49 -0.26 117.35 124.14 1fyu s TYR 53 Ca 0.19 1.28 0.00 0.00 0.04 0.00 0.00 57.07 58.59 1fyu s TYR 53 Cb -0.11 -3.54 0.00 0.00 -1.04 0.00 0.00 41.96 37.27 1fyu s TYR 53 CO 0.11 -1.65 1.00 0.00 -1.54 0.00 0.00 175.55 173.46 1fyu n ALA 54 N 2.68 1.00 -2.98 3.97 0.00 0.11 -4.61 120.51 120.68 1fyu n ALA 54 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.26 1fyu n ALA 54 Cb 0.43 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 18.73 1fyu n ALA 54 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1fyu s LYS 55 N -2.99 1.49 0.62 0.00 1.02 -1.26 -5.02 119.74 113.60 1fyu s LYS 55 Ca 0.00 -0.49 -0.16 0.00 0.02 0.00 0.00 55.97 55.33 1fyu s LYS 55 Cb 0.00 -1.32 -0.02 0.00 -0.52 0.00 0.00 37.83 35.98 1fyu s LYS 55 CO 0.00 0.19 1.12 -1.25 -0.92 0.00 0.00 175.35 174.49 1fyu s PRO 56 N 0.13 2.95 0.07 -1.68 0.04 -1.26 -4.80 135.00 130.45 1fyu s PRO 56 Ca -0.04 1.47 0.08 0.00 0.04 0.00 0.00 61.00 62.55 1fyu s PRO 56 Cb -0.11 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1fyu s PRO 56 CO 0.02 -1.14 -0.20 0.14 0.04 0.00 0.00 177.00 175.85 1fyu s VAL 57 N -2.15 2.65 -0.59 -0.36 -7.23 -0.41 -4.91 120.40 107.40 1fyu s VAL 57 Ca 0.69 -1.36 -0.23 0.00 -1.81 0.00 0.00 61.98 59.27 1fyu s VAL 57 Cb -0.22 -2.14 0.05 0.00 0.56 0.00 0.00 36.38 34.64 1fyu s VAL 57 CO 0.37 0.26 0.94 -2.28 -0.31 0.00 0.00 175.10 174.07 1fyu s HIS 58 N -0.98 2.75 0.05 2.82 2.46 -1.26 -1.93 115.29 119.21 1fyu s HIS 58 Ca 0.15 -0.24 0.08 0.00 0.47 0.00 0.00 55.06 55.51 1fyu s HIS 58 Cb -0.10 -4.13 -0.22 0.00 -0.13 0.00 0.00 32.58 27.99 1fyu s HIS 58 CO 0.06 -1.46 1.02 0.82 -2.47 0.00 0.00 174.74 172.72 1fyu h ILE 59 N 5.99 1.36 -2.91 0.89 1.08 -1.52 -3.44 117.51 118.96 1fyu h ILE 59 Ca -0.27 -3.11 0.06 0.00 -0.39 0.00 0.00 64.86 61.15 1fyu h ILE 59 Cb 1.07 2.69 -0.07 0.00 -3.07 0.00 0.00 36.82 37.45 1fyu h ILE 59 CO 1.12 0.79 0.26 -1.66 -0.69 0.00 0.00 178.15 177.97 1fyu s TRP 60 N -2.66 -0.26 -0.04 1.37 1.48 -1.21 0.49 118.94 118.10 1fyu s TRP 60 Ca -0.02 -0.12 0.00 0.00 -1.06 0.00 0.00 56.10 54.90 1fyu s TRP 60 Cb 0.09 0.67 0.02 0.00 -1.16 0.00 0.00 33.47 33.09 1fyu s TRP 60 CO 0.83 -1.09 -0.02 0.34 -4.06 0.00 0.00 176.95 172.94 1fyu s ASP 61 N -2.87 0.89 0.07 -2.66 -1.08 -0.27 -4.63 116.67 106.11 1fyu s ASP 61 Ca 0.09 -0.08 -0.33 0.00 -0.52 0.00 0.00 52.55 51.71 1fyu s ASP 61 Cb -0.04 -0.36 -0.19 0.00 -1.46 0.00 0.00 42.92 40.87 1fyu s ASP 61 CO 0.02 -0.10 1.62 0.24 0.52 0.00 0.00 175.17 177.47 1fyu h MET 62 N 7.46 -0.89 -0.06 4.34 2.86 -1.95 0.46 114.93 127.15 1fyu h MET 62 Ca -0.35 0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.35 1fyu h MET 62 Cb 1.14 0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.99 1fyu h MET 62 CO 0.42 -0.59 -0.03 2.41 1.06 0.00 0.00 176.91 180.18 1fyu n THR 63 N -5.49 -0.04 0.08 2.22 -1.04 -1.26 -2.05 114.28 106.70 1fyu n THR 63 Ca -0.14 1.21 -0.10 0.00 -2.04 0.00 0.00 64.05 62.99 1fyu n THR 63 Cb 0.38 -1.60 -0.05 0.00 -1.82 0.00 0.00 70.33 67.23 1fyu n THR 63 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1fyu h THR 64 N 0.00 1.54 0.00 12.58 1.35 -2.01 -3.47 112.91 122.90 1fyu h THR 64 Ca 0.01 -2.86 0.00 0.00 -0.55 0.00 0.00 66.41 63.01 1fyu h THR 64 Cb 0.02 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1fyu h THR 64 CO -0.06 0.83 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 1fyu n GLY 65 N 1.09 0.69 3.78 5.82 0.00 0.16 -5.03 105.19 111.69 1fyu n GLY 65 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1fyu n GLY 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fyu s THR 66 N -2.17 4.55 -0.03 2.61 -4.23 -1.20 -4.86 115.64 110.30 1fyu s THR 66 Ca 0.00 1.56 0.07 0.00 -1.18 0.00 0.00 61.69 62.14 1fyu s THR 66 Cb 0.00 -4.07 -0.02 0.00 1.34 0.00 0.00 72.50 69.75 1fyu s THR 66 CO 0.00 0.49 -0.24 0.54 -0.54 0.00 0.00 174.62 174.87 1fyu s VAL 67 N -0.86 2.21 0.65 2.29 0.11 -1.26 -1.12 120.40 122.42 1fyu s VAL 67 Ca 0.35 -1.04 -0.12 0.00 -2.93 0.00 0.00 61.98 58.23 1fyu s VAL 67 Cb -0.22 -1.79 -0.01 0.00 -1.53 0.00 0.00 36.38 32.84 1fyu s VAL 67 CO 0.24 0.58 1.05 0.00 -3.33 0.00 0.00 175.10 173.64 1fyu s ALA 68 N -0.54 2.74 -0.03 1.54 0.00 0.18 -4.73 121.76 120.91 1fyu s ALA 68 Ca 0.08 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1fyu s ALA 68 Cb -0.11 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1fyu s ALA 68 CO 0.00 -1.03 -0.03 -1.12 0.00 0.00 0.00 175.76 173.58 1fyu s SER 69 N -3.51 4.95 0.17 0.00 0.01 -0.95 -4.45 113.70 109.92 1fyu s SER 69 Ca 0.59 -0.00 -0.03 0.00 1.31 0.00 0.00 55.95 57.83 1fyu s SER 69 Cb -0.14 -1.28 -0.03 0.00 0.21 0.00 0.00 66.02 64.77 1fyu s SER 69 CO 0.49 0.32 0.14 0.72 0.41 0.00 0.00 173.24 175.32 1fyu s PHE 70 N -0.96 0.92 -0.14 2.43 -0.71 -1.03 -0.75 117.98 117.74 1fyu s PHE 70 Ca 0.16 -1.22 -0.13 0.00 -1.04 0.00 0.00 56.93 54.69 1fyu s PHE 70 Cb -0.11 -0.43 0.04 0.00 -1.21 0.00 0.00 43.02 41.30 1fyu s PHE 70 CO 0.06 -0.62 0.38 -2.00 -1.34 0.00 0.00 175.22 171.70 1fyu s GLU 71 N -4.09 0.46 0.02 1.99 2.12 0.01 -0.86 118.70 118.34 1fyu s GLU 71 Ca 0.30 0.50 -0.00 0.00 0.36 0.00 0.00 54.97 56.13 1fyu s GLU 71 Cb 0.06 0.22 -0.02 0.00 0.26 0.00 0.00 34.13 34.66 1fyu s GLU 71 CO 0.07 -0.06 -0.02 -0.08 -0.54 0.00 0.00 175.26 174.63 1fyu s THR 72 N 0.13 0.09 -0.05 -1.70 -1.32 -0.13 -1.30 115.64 111.37 1fyu s THR 72 Ca -0.01 -0.77 -0.04 0.00 -1.21 0.00 0.00 61.69 59.66 1fyu s THR 72 Cb -0.03 -0.24 0.02 0.00 -1.51 0.00 0.00 72.50 70.75 1fyu s THR 72 CO 0.01 -0.43 0.13 -0.13 -2.21 0.00 0.00 174.62 171.99 1fyu s ARG 73 N -1.26 0.13 0.15 7.08 0.52 -0.56 -1.14 118.95 123.87 1fyu s ARG 73 Ca -0.14 0.23 -0.19 0.00 -0.52 0.00 0.00 55.73 55.11 1fyu s ARG 73 Cb -0.09 -0.00 0.05 0.00 0.52 0.00 0.00 34.95 35.43 1fyu s ARG 73 CO -0.01 -0.06 0.50 -0.59 0.02 0.00 0.00 175.30 175.16 1fyu s PHE 74 N 0.38 -0.31 -0.01 -0.53 -0.12 -0.95 -0.39 117.98 116.05 1fyu s PHE 74 Ca -0.03 0.02 0.07 0.00 -0.05 0.00 0.00 56.93 56.95 1fyu s PHE 74 Cb -0.04 0.40 -0.02 0.00 -0.63 0.00 0.00 43.02 42.73 1fyu s PHE 74 CO -0.02 -0.80 -0.24 -1.12 -0.05 0.00 0.00 175.22 172.99 1fyu s SER 75 N -2.80 2.80 0.22 1.98 0.01 -0.88 -0.93 113.70 114.11 1fyu s SER 75 Ca 0.03 -0.44 -0.12 0.00 1.31 0.00 0.00 55.95 56.73 1fyu s SER 75 Cb 0.00 -0.31 -0.00 0.00 0.21 0.00 0.00 66.02 65.92 1fyu s SER 75 CO -0.10 0.29 0.44 0.72 0.41 0.00 0.00 173.24 175.00 1fyu s PHE 76 N -0.58 0.32 -0.06 2.43 -0.12 -0.88 -0.61 117.98 118.49 1fyu s PHE 76 Ca 0.09 -0.68 -0.05 0.00 -0.05 0.00 0.00 56.93 56.25 1fyu s PHE 76 Cb -0.09 0.16 0.02 0.00 -0.63 0.00 0.00 43.02 42.47 1fyu s PHE 76 CO -0.01 -0.93 0.15 -1.54 -0.05 0.00 0.00 175.22 172.85 1fyu s SER 77 N -2.99 -0.15 -0.14 1.98 1.04 -0.22 -0.29 113.70 112.93 1fyu s SER 77 Ca 0.20 0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.95 1fyu s SER 77 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1fyu s SER 77 CO 0.06 -0.07 -0.19 -0.63 0.98 0.00 0.00 173.24 173.39 1fyu s ILE 78 N 0.32 2.35 -0.16 -1.02 1.01 -1.26 -2.21 121.20 120.24 1fyu s ILE 78 Ca -0.02 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.76 1fyu s ILE 78 Cb -0.03 -1.96 0.00 0.00 0.01 0.00 0.00 42.46 40.48 1fyu s ILE 78 CO -0.01 0.53 -0.17 -0.70 0.00 0.00 0.00 174.94 174.59 1fyu s GLU 79 N 0.76 3.13 -0.59 2.79 2.12 -1.25 -0.91 118.70 124.74 1fyu s GLU 79 Ca -0.07 -0.79 -0.07 0.00 0.36 0.00 0.00 54.97 54.40 1fyu s GLU 79 Cb -0.16 -2.58 0.15 0.00 0.26 0.00 0.00 34.13 31.81 1fyu s GLU 79 CO 0.00 -0.04 0.45 -0.65 -0.54 0.00 0.00 175.26 174.48 1fyu s GLN 80 N 0.92 2.66 0.35 4.30 -0.21 -1.26 -1.38 119.66 125.05 1fyu s GLN 80 Ca -0.04 -2.22 0.18 0.00 0.02 0.00 0.00 55.36 53.30 1fyu s GLN 80 Cb -0.15 -3.89 0.49 0.00 1.00 0.00 0.00 33.01 30.46 1fyu s GLN 80 CO -0.03 -1.19 1.64 -1.00 -2.12 0.00 0.00 175.29 172.59 1fyu h PRO 81 N 7.68 0.00 -5.80 2.91 0.13 -1.98 -3.46 132.00 131.48 1fyu h PRO 81 Ca -0.06 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.43 1fyu h PRO 81 Cb 1.01 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.09 1fyu h PRO 81 CO 0.76 0.40 -0.45 0.71 -0.23 0.00 0.00 178.00 179.20 1fyu s TYR 82 N -3.37 3.58 0.06 1.56 1.51 -1.26 -5.00 117.35 114.42 1fyu s TYR 82 Ca 0.02 0.49 -0.16 0.00 -1.01 0.00 0.00 57.07 56.41 1fyu s TYR 82 Cb 0.10 -1.92 -0.18 0.00 -0.11 0.00 0.00 41.96 39.84 1fyu s TYR 82 CO 0.70 0.66 1.24 1.79 -1.11 0.00 0.00 175.55 178.83 1fyu h THR 83 N 3.22 1.34 -3.10 -0.71 1.35 -1.96 -3.45 112.91 109.59 1fyu h THR 83 Ca -0.51 -1.93 -0.12 0.00 -0.55 0.00 0.00 66.41 63.29 1fyu h THR 83 Cb 1.20 2.18 -0.21 0.00 -1.73 0.00 0.00 68.15 69.60 1fyu h THR 83 CO 0.65 0.59 -0.31 0.00 -0.25 0.00 0.00 175.52 176.20 1fyu s ARG 84 N -3.62 0.61 0.73 4.72 1.70 -1.26 -4.66 118.95 117.17 1fyu s ARG 84 Ca -0.12 -0.17 -0.12 0.00 -0.47 0.00 0.00 55.73 54.85 1fyu s ARG 84 Cb 0.06 0.27 0.18 0.00 -0.57 0.00 0.00 34.95 34.89 1fyu s ARG 84 CO 0.86 -0.16 0.72 -0.35 -1.08 0.00 0.00 175.30 175.29 1fyu n PRO 85 N 1.45 -1.96 -2.02 3.89 -0.04 -1.26 -4.99 135.00 130.08 1fyu n PRO 85 Ca -0.21 -1.15 -0.41 0.00 -0.04 0.00 0.00 63.50 61.69 1fyu n PRO 85 Cb 0.56 -0.98 -0.02 0.00 -0.04 0.00 0.00 33.50 33.02 1fyu n PRO 85 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fyu s LEU 86 N 0.00 4.39 0.76 1.53 1.02 -1.26 -4.80 118.68 120.32 1fyu s LEU 86 Ca 0.45 2.75 -0.12 0.00 0.02 0.00 0.00 54.13 57.24 1fyu s LEU 86 Cb -0.04 -3.64 0.05 0.00 0.02 0.00 0.00 46.19 42.58 1fyu s LEU 86 CO 0.34 -0.66 1.10 -2.16 0.02 0.00 0.00 176.35 174.99 1fyu s PRO 87 N -1.34 2.26 0.12 1.29 0.04 -1.26 -4.55 135.00 131.55 1fyu s PRO 87 Ca 0.53 1.28 -0.25 0.00 0.04 0.00 0.00 61.00 62.60 1fyu s PRO 87 Cb -0.42 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.31 1fyu s PRO 87 CO 0.51 -1.66 0.74 0.00 0.04 0.00 0.00 177.00 176.63 1fyu s ALA 88 N -2.72 -1.64 -0.03 8.56 0.00 -1.25 -4.43 121.76 120.25 1fyu s ALA 88 Ca 0.63 0.55 0.03 0.00 0.00 0.00 0.00 51.96 53.17 1fyu s ALA 88 Cb -0.19 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 1fyu s ALA 88 CO 0.53 -0.79 0.01 -0.25 0.00 0.00 0.00 175.76 175.25 1fyu n ASP 89 N -0.35 4.27 0.00 0.00 9.92 0.17 -3.09 116.55 127.48 1fyu n ASP 89 Ca -0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.14 1fyu n ASP 89 Cb 0.63 0.59 0.00 0.00 -0.64 0.00 0.00 41.12 41.70 1fyu n ASP 89 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1fyu n GLY 90 N 2.80 0.96 3.09 0.44 0.00 -1.13 -1.09 105.19 110.26 1fyu n GLY 90 Ca -0.05 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 43.98 1fyu n GLY 90 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fyu s LEU 91 N 0.00 2.43 0.01 0.99 0.05 -0.80 -1.92 118.68 119.45 1fyu s LEU 91 Ca 0.00 -0.88 -0.01 0.00 0.05 0.00 0.00 54.13 53.29 1fyu s LEU 91 Cb 0.00 0.08 -0.01 0.00 -2.05 0.00 0.00 46.19 44.21 1fyu s LEU 91 CO 0.00 -0.48 -0.00 -0.69 -0.55 0.00 0.00 176.35 174.63 1fyu s VAL 92 N -3.22 0.09 -0.19 1.48 1.01 0.17 -0.85 120.40 118.89 1fyu s VAL 92 Ca 0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 1fyu s VAL 92 Cb 0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1fyu s VAL 92 CO -0.06 -0.40 0.06 0.12 0.00 0.00 0.00 175.10 174.81 1fyu s PHE 93 N -1.21 3.23 0.07 5.22 2.19 -0.73 -0.85 117.98 125.90 1fyu s PHE 93 Ca -0.13 0.03 -0.08 0.00 0.33 0.00 0.00 56.93 57.09 1fyu s PHE 93 Cb -0.08 -2.09 -0.01 0.00 -1.31 0.00 0.00 43.02 39.54 1fyu s PHE 93 CO -0.01 0.12 0.15 -0.59 1.83 0.00 0.00 175.22 176.72 1fyu s PHE 94 N 0.45 0.18 -0.05 10.12 -0.12 -0.03 -1.22 117.98 127.32 1fyu s PHE 94 Ca 0.03 -0.58 0.03 0.00 -0.05 0.00 0.00 56.93 56.36 1fyu s PHE 94 Cb -0.13 -0.10 0.00 0.00 -0.63 0.00 0.00 43.02 42.16 1fyu s PHE 94 CO 0.01 -0.48 -0.13 -1.64 -0.05 0.00 0.00 175.22 172.92 1fyu s MET 95 N -3.51 1.54 0.04 1.99 -1.94 -0.18 -0.65 119.30 116.60 1fyu s MET 95 Ca 0.02 -0.46 -0.02 0.00 -1.71 0.00 0.00 55.69 53.52 1fyu s MET 95 Cb 0.04 -1.33 0.01 0.00 2.01 0.00 0.00 34.83 35.55 1fyu s MET 95 CO -0.09 0.14 0.08 0.41 -0.01 0.00 0.00 175.02 175.55 1fyu n GLY 96 N 3.40 1.97 3.62 -0.03 0.00 -0.65 -1.55 105.19 111.95 1fyu n GLY 96 Ca -0.20 -1.07 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 1fyu n GLY 96 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fyu n PRO 97 N -0.06 0.91 -1.62 1.61 -0.02 -1.25 -0.73 135.00 133.84 1fyu n PRO 97 Ca -0.01 0.35 -0.30 0.00 -2.02 0.00 0.00 63.50 61.52 1fyu n PRO 97 Cb 0.07 -2.17 0.08 0.00 -0.02 0.00 0.00 33.50 31.46 1fyu n PRO 97 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1fyu s THR 98 N -1.51 3.13 -1.44 3.45 -4.23 -1.26 -3.99 115.64 109.79 1fyu s THR 98 Ca 0.75 0.37 -0.05 0.00 -1.18 0.00 0.00 61.69 61.58 1fyu s THR 98 Cb -0.42 -3.16 0.02 0.00 1.34 0.00 0.00 72.50 70.28 1fyu s THR 98 CO 0.47 -0.48 0.40 0.29 -0.54 0.00 0.00 174.62 174.77 1fyu n LYS 99 N -3.35 -3.67 -2.96 3.99 4.01 -1.26 -4.96 118.16 109.96 1fyu n LYS 99 Ca 0.07 0.76 -0.28 0.00 -0.51 0.00 0.00 58.31 58.35 1fyu n LYS 99 Cb 0.57 -5.52 -0.02 0.00 -0.51 0.00 0.00 35.03 29.55 1fyu n LYS 99 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1fyu s SER 100 N -2.52 6.39 0.29 4.39 1.04 -1.26 -5.11 113.70 116.93 1fyu s SER 100 Ca 0.24 0.88 0.10 0.00 0.48 0.00 0.00 55.95 57.66 1fyu s SER 100 Cb -0.12 -2.22 -0.05 0.00 0.10 0.00 0.00 66.02 63.74 1fyu s SER 100 CO 0.30 -0.40 -0.09 -0.54 0.98 0.00 0.00 173.24 173.49 1fyu s LYS 101 N -4.13 1.97 0.37 4.02 3.01 -1.26 -5.09 119.74 118.63 1fyu s LYS 101 Ca 0.47 -1.65 -0.28 0.00 -1.01 0.00 0.00 55.97 53.49 1fyu s LYS 101 Cb -0.10 -1.93 -0.11 0.00 -1.01 0.00 0.00 37.83 34.68 1fyu s LYS 101 CO 0.36 0.30 1.48 -1.25 0.51 0.00 0.00 175.35 176.75 1fyu s PRO 102 N -3.61 4.12 0.00 -1.68 0.04 -1.26 -5.00 135.00 127.61 1fyu s PRO 102 Ca 0.31 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.91 1fyu s PRO 102 Cb -0.04 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1fyu s PRO 102 CO 0.18 -0.52 0.00 0.00 0.04 0.00 0.00 177.00 176.69 1fyu n ALA 103 N 0.52 0.00 -1.77 8.56 0.00 -0.66 -5.01 120.51 122.15 1fyu n ALA 103 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.07 1fyu n ALA 103 Cb 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.80 1fyu n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fyu s GLN 104 N 2.15 4.31 0.00 0.00 -1.52 -0.77 -4.74 119.66 119.09 1fyu s GLN 104 Ca 0.00 1.60 0.00 0.00 -1.95 0.00 0.00 55.36 55.01 1fyu s GLN 104 Cb 0.00 -2.75 0.00 0.00 -0.22 0.00 0.00 33.01 30.04 1fyu s GLN 104 CO 0.00 -0.03 0.00 0.41 -0.25 0.00 0.00 175.29 175.42 1fyu n GLY 105 N 0.62 0.89 7.00 3.09 0.00 -1.26 -0.21 105.19 115.32 1fyu n GLY 105 Ca 0.03 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1fyu n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fyu n TYR 106 N 0.00 0.00 0.06 1.61 4.01 -1.26 -1.52 117.16 120.05 1fyu n TYR 106 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 1fyu n TYR 106 Cb 0.00 0.02 0.19 0.00 -0.31 0.00 0.00 39.34 39.23 1fyu n TYR 106 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fyu n GLY 107 N 0.00 -0.59 0.38 2.72 0.00 -1.26 -0.60 105.19 105.85 1fyu n GLY 107 Ca 0.00 0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.23 1fyu n GLY 107 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fyu n TYR 108 N -1.72 0.00 -0.97 1.61 4.01 -0.58 -4.92 117.16 114.59 1fyu n TYR 108 Ca -0.00 -0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.67 1fyu n TYR 108 Cb 0.05 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.06 1fyu n TYR 108 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1fyu n LEU 109 N -0.08 -0.27 -0.00 7.72 4.77 0.24 -1.74 117.00 127.63 1fyu n LEU 109 Ca 0.20 0.15 -0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1fyu n LEU 109 Cb 0.30 -1.51 -0.00 0.00 -2.33 0.00 0.00 43.42 39.88 1fyu n LEU 109 CO 0.17 -0.48 -0.00 0.61 -1.33 0.00 0.00 177.39 176.36 1fyu n GLY 110 N 0.05 0.48 0.00 -0.72 0.00 0.71 -4.28 105.19 101.42 1fyu n GLY 110 Ca -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1fyu n GLY 110 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fyu n ILE 111 N -3.00 0.00 -4.15 -0.61 -5.35 -0.71 -1.65 119.36 103.89 1fyu n ILE 111 Ca -0.00 -0.35 -0.13 0.00 -0.27 0.00 0.00 62.75 62.01 1fyu n ILE 111 Cb 0.00 1.20 -0.11 0.00 -1.74 0.00 0.00 39.64 38.99 1fyu n ILE 111 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1fyu s PHE 112 N -0.24 0.92 -0.30 4.28 0.08 -1.17 -4.86 117.98 116.68 1fyu s PHE 112 Ca 0.00 -0.71 0.22 0.00 0.12 0.00 0.00 56.93 56.56 1fyu s PHE 112 Cb 0.00 -0.52 -0.21 0.00 -0.57 0.00 0.00 43.02 41.73 1fyu s PHE 112 CO 0.00 -0.07 0.72 0.09 -0.10 0.00 0.00 175.22 175.86 1fyu n ASN 113 N 0.54 0.37 -3.37 1.36 3.02 -1.26 -1.85 115.26 114.08 1fyu n ASN 113 Ca -0.16 -0.13 -0.03 0.00 -0.03 0.00 0.00 54.58 54.22 1fyu n ASN 113 Cb 0.58 1.42 0.02 0.00 -0.61 0.00 0.00 39.78 41.19 1fyu n ASN 113 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1fyu s ASN 114 N -4.31 0.00 0.00 6.41 6.03 -1.26 -4.84 114.94 116.98 1fyu s ASN 114 Ca -0.03 -0.67 0.12 0.00 -1.03 0.00 0.00 52.86 51.25 1fyu s ASN 114 Cb 0.14 0.50 0.53 0.00 -3.03 0.00 0.00 41.25 39.39 1fyu s ASN 114 CO 0.87 -0.99 1.37 -1.54 -2.03 0.00 0.00 177.10 174.77 1fyu n SER 115 N -1.22 0.70 -4.76 3.54 3.41 -1.26 -4.61 113.62 109.42 1fyu n SER 115 Ca -0.03 -1.77 -0.41 0.00 -0.26 0.00 0.00 58.87 56.40 1fyu n SER 115 Cb 0.59 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 1fyu n SER 115 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1fyu s LYS 116 N -1.86 4.41 -0.46 4.33 2.20 -1.26 -4.51 119.74 122.59 1fyu s LYS 116 Ca 0.19 2.13 -0.23 0.00 -0.36 0.00 0.00 55.97 57.71 1fyu s LYS 116 Cb 0.10 -3.10 0.03 0.00 -1.51 0.00 0.00 37.83 33.34 1fyu s LYS 116 CO 0.15 -0.12 0.78 -1.14 -0.36 0.00 0.00 175.35 174.65 1fyu s GLN 117 N -1.57 3.37 -0.05 4.03 0.74 -1.26 -4.57 119.66 120.35 1fyu s GLN 117 Ca 0.49 -0.17 -0.00 0.00 0.05 0.00 0.00 55.36 55.72 1fyu s GLN 117 Cb -0.38 -3.96 0.03 0.00 1.10 0.00 0.00 33.01 29.80 1fyu s GLN 117 CO 0.49 -1.14 -0.00 0.34 -0.55 0.00 0.00 175.29 174.43 1fyu s ASP 118 N 2.20 0.94 0.61 6.67 -1.08 -1.00 -5.02 116.67 119.99 1fyu s ASP 118 Ca 0.29 -0.05 0.34 0.00 -0.52 0.00 0.00 52.55 52.60 1fyu s ASP 118 Cb -0.13 -0.32 1.98 0.00 -1.46 0.00 0.00 42.92 42.99 1fyu s ASP 118 CO 0.22 -0.13 2.28 0.78 0.52 0.00 0.00 175.17 178.83 1fyu h ASN 119 N 7.67 0.00 0.51 -0.34 -0.26 -1.95 -1.64 115.58 119.57 1fyu h ASN 119 Ca -0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.42 1fyu h ASN 119 Cb 1.13 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.39 1fyu h ASN 119 CO 0.38 0.01 0.00 -1.54 -1.06 0.00 0.00 177.43 175.22 1fyu n SER 120 N -3.59 0.00 0.06 5.81 3.41 -1.26 -2.38 113.62 115.67 1fyu n SER 120 Ca -0.03 0.40 -0.05 0.00 -0.26 0.00 0.00 58.87 58.93 1fyu n SER 120 Cb 0.09 -0.45 0.13 0.00 -0.26 0.00 0.00 64.21 63.72 1fyu n SER 120 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1fyu h TYR 121 N 0.00 0.41 -6.70 7.33 0.05 -1.62 -3.47 116.97 112.98 1fyu h TYR 121 Ca 0.00 -0.14 -0.54 0.00 0.05 0.00 0.00 58.73 58.10 1fyu h TYR 121 Cb 0.25 -0.08 -0.08 0.00 1.01 0.00 0.00 36.73 37.83 1fyu h TYR 121 CO 0.00 0.79 -0.93 1.04 -1.05 0.00 0.00 178.16 178.00 1fyu n GLN 122 N -3.94 -2.04 -4.35 4.88 6.02 -1.00 -4.68 117.38 112.26 1fyu n GLN 122 Ca -0.02 0.28 -0.20 0.00 -0.01 0.00 0.00 57.00 57.04 1fyu n GLN 122 Cb 0.57 -3.98 -0.16 0.00 1.02 0.00 0.00 30.24 27.69 1fyu n GLN 122 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1fyu s THR 123 N -4.00 0.74 -0.08 5.09 2.01 -1.26 -3.75 115.64 114.38 1fyu s THR 123 Ca 0.10 -0.32 0.04 0.00 0.31 0.00 0.00 61.69 61.82 1fyu s THR 123 Cb -0.05 -0.67 0.00 0.00 0.01 0.00 0.00 72.50 71.79 1fyu s THR 123 CO 0.93 0.24 -0.21 -0.22 -0.69 0.00 0.00 174.62 174.67 1fyu s LEU 124 N 0.32 1.97 0.03 4.42 2.96 -0.60 -0.07 118.68 127.71 1fyu s LEU 124 Ca -0.05 -0.48 -0.11 0.00 -0.22 0.00 0.00 54.13 53.28 1fyu s LEU 124 Cb -0.10 -1.23 0.01 0.00 0.50 0.00 0.00 46.19 45.37 1fyu s LEU 124 CO 0.01 0.14 0.23 -0.83 -1.32 0.00 0.00 176.35 174.57 1fyu s GLY 125 N 0.33 -0.02 -0.26 7.98 0.00 0.39 -1.01 107.32 114.72 1fyu s GLY 125 Ca -0.15 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.48 1fyu s GLY 125 CO 0.07 -0.30 -0.09 0.14 0.00 0.00 0.00 173.10 172.91 1fyu s VAL 126 N -2.23 2.10 0.22 1.40 1.01 -0.36 0.72 120.40 123.26 1fyu s VAL 126 Ca -0.08 -1.63 0.04 0.00 0.00 0.00 0.00 61.98 60.31 1fyu s VAL 126 Cb -0.02 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 1fyu s VAL 126 CO -0.02 -0.07 0.35 -1.83 0.00 0.00 0.00 175.10 173.53 1fyu s GLU 127 N 1.13 3.45 -0.51 2.72 -1.05 0.00 -1.78 118.70 122.66 1fyu s GLU 127 Ca -0.07 -0.67 0.03 0.00 -0.15 0.00 0.00 54.97 54.11 1fyu s GLU 127 Cb -0.20 -2.90 0.15 0.00 -0.44 0.00 0.00 34.13 30.75 1fyu s GLU 127 CO -0.05 0.44 0.34 -0.06 0.95 0.00 0.00 175.26 176.87 1fyu s PHE 128 N -1.92 2.17 -0.14 4.83 0.40 -0.03 -1.78 117.98 121.51 1fyu s PHE 128 Ca 0.35 -2.65 -0.26 0.00 -0.60 0.00 0.00 56.93 53.77 1fyu s PHE 128 Cb -0.10 -1.84 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 1fyu s PHE 128 CO 0.29 -0.73 0.85 0.34 0.70 0.00 0.00 175.22 176.67 1fyu s ASP 129 N -0.23 7.02 0.00 1.36 -1.08 -0.55 -1.90 116.67 121.29 1fyu s ASP 129 Ca 0.24 1.25 0.13 0.00 -0.52 0.00 0.00 52.55 53.65 1fyu s ASP 129 Cb -0.11 -2.47 0.04 0.00 -1.46 0.00 0.00 42.92 38.92 1fyu s ASP 129 CO -0.10 -0.37 0.82 0.35 0.52 0.00 0.00 175.17 176.39 1fyu n THR 130 N 4.56 0.00 -4.41 1.71 -2.24 -0.25 -0.93 114.28 112.72 1fyu n THR 130 Ca 0.04 -0.42 -0.21 0.00 -2.27 0.00 0.00 64.05 61.19 1fyu n THR 130 Cb 0.49 1.21 -0.16 0.00 -2.10 0.00 0.00 70.33 69.77 1fyu n THR 130 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1fyu s PHE 131 N -1.40 1.05 -0.64 4.78 2.19 -1.20 -4.68 117.98 118.07 1fyu s PHE 131 Ca 0.13 -0.30 -0.23 0.00 0.33 0.00 0.00 56.93 56.86 1fyu s PHE 131 Cb 0.11 -0.77 0.06 0.00 -1.31 0.00 0.00 43.02 41.10 1fyu s PHE 131 CO 0.26 -0.16 0.98 0.45 1.83 0.00 0.00 175.22 178.58 1fyu s SER 132 N 0.42 6.21 0.87 6.13 0.15 -1.26 -4.99 113.70 121.23 1fyu s SER 132 Ca -0.07 -0.82 -0.10 0.00 0.70 0.00 0.00 55.95 55.66 1fyu s SER 132 Cb -0.11 -2.43 0.17 0.00 -1.71 0.00 0.00 66.02 61.94 1fyu s SER 132 CO 0.01 -1.42 1.19 0.20 1.20 0.00 0.00 173.24 174.43 1fyu s ASN 133 N 3.49 3.61 0.43 5.45 -0.87 -1.26 -4.89 114.94 120.90 1fyu s ASN 133 Ca 0.25 0.01 0.14 0.00 -1.57 0.00 0.00 52.86 51.69 1fyu s ASN 133 Cb -0.15 -0.19 1.04 0.00 -0.02 0.00 0.00 41.25 41.92 1fyu s ASN 133 CO 0.12 -2.39 1.96 -0.65 -2.57 0.00 0.00 177.10 173.58 1fyu h PRO 134 N -1.20 0.40 -0.01 -0.60 0.11 -1.98 -1.31 132.00 127.41 1fyu h PRO 134 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1fyu h PRO 134 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1fyu h PRO 134 CO 0.39 0.26 -0.05 -2.67 -0.21 0.00 0.00 178.00 175.72 1fyu n TRP 135 N -4.47 0.00 -3.38 0.65 2.14 -1.26 -4.92 117.44 106.21 1fyu n TRP 135 Ca 0.11 0.00 -0.23 0.00 2.07 0.00 0.00 57.50 59.45 1fyu n TRP 135 Cb 0.42 -0.04 -0.01 0.00 -0.81 0.00 0.00 31.31 30.86 1fyu n TRP 135 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1fyu s ASP 136 N -2.14 6.21 0.92 -0.67 1.01 -0.50 -4.76 116.67 116.75 1fyu s ASP 136 Ca 0.37 0.36 -0.13 0.00 0.71 0.00 0.00 52.55 53.86 1fyu s ASP 136 Cb 0.21 -1.90 0.15 0.00 1.01 0.00 0.00 42.92 42.38 1fyu s ASP 136 CO 0.39 -0.34 1.15 -2.16 0.21 0.00 0.00 175.17 174.41 1fyu s PRO 137 N -4.32 1.05 0.34 8.23 0.04 -1.26 -4.79 135.00 134.29 1fyu s PRO 137 Ca 0.41 0.21 0.07 0.00 0.04 0.00 0.00 61.00 61.74 1fyu s PRO 137 Cb -0.10 -1.84 0.61 0.00 0.04 0.00 0.00 34.50 33.22 1fyu s PRO 137 CO 0.35 -2.25 1.82 -1.35 0.04 0.00 0.00 177.00 175.61 1fyu h PRO 138 N -1.53 0.29 -6.58 0.56 0.11 -1.98 -3.45 132.00 119.41 1fyu h PRO 138 Ca -0.49 -0.09 -0.52 0.00 0.11 0.00 0.00 66.00 65.01 1fyu h PRO 138 Cb 1.32 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1fyu h PRO 138 CO 0.59 0.51 0.39 -0.65 -0.21 0.00 0.00 178.00 178.63 1fyu s GLN 139 N -4.51 4.67 -0.01 1.05 1.11 -1.26 -4.87 119.66 115.83 1fyu s GLN 139 Ca -0.05 1.51 -0.08 0.00 0.01 0.00 0.00 55.36 56.75 1fyu s GLN 139 Cb 0.14 -3.36 0.01 0.00 -1.01 0.00 0.00 33.01 28.80 1fyu s GLN 139 CO 0.75 0.18 0.16 0.14 0.01 0.00 0.00 175.29 176.53 1fyu s VAL 140 N -0.02 0.06 0.87 1.09 -7.23 -1.26 -4.36 120.40 109.54 1fyu s VAL 140 Ca 0.48 -0.52 -0.12 0.00 -1.81 0.00 0.00 61.98 60.01 1fyu s VAL 140 Cb -0.25 -0.41 0.11 0.00 0.56 0.00 0.00 36.38 36.40 1fyu s VAL 140 CO 0.31 -0.28 1.12 -2.16 -0.31 0.00 0.00 175.10 173.78 1fyu s PRO 141 N -1.04 1.49 0.00 4.82 0.04 -1.25 -4.94 135.00 134.12 1fyu s PRO 141 Ca -0.11 0.41 -0.15 0.00 0.04 0.00 0.00 61.00 61.19 1fyu s PRO 141 Cb -0.06 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.63 1fyu s PRO 141 CO 0.01 -1.98 0.32 -3.38 0.04 0.00 0.00 177.00 172.01 1fyu s HIS 142 N -3.24 -0.17 0.07 0.56 -3.43 -0.11 -2.33 115.29 106.64 1fyu s HIS 142 Ca 0.63 0.20 -0.13 0.00 -0.80 0.00 0.00 55.06 54.95 1fyu s HIS 142 Cb -0.15 0.10 -0.06 0.00 -1.43 0.00 0.00 32.58 31.05 1fyu s HIS 142 CO 0.54 -0.43 0.46 0.42 -2.00 0.00 0.00 174.74 173.72 1fyu s ILE 143 N -1.69 4.98 -0.04 -5.38 1.01 0.68 -1.49 121.20 119.27 1fyu s ILE 143 Ca -0.11 0.74 -0.09 0.00 0.00 0.00 0.00 60.65 61.19 1fyu s ILE 143 Cb -0.04 -3.71 0.01 0.00 0.01 0.00 0.00 42.46 38.73 1fyu s ILE 143 CO 0.02 0.38 0.20 -0.83 0.00 0.00 0.00 174.94 174.71 1fyu s GLY 144 N -1.50 -0.08 -0.32 6.18 0.00 -0.73 -0.44 107.32 110.43 1fyu s GLY 144 Ca 0.31 0.27 -0.11 0.00 0.00 0.00 0.00 44.72 45.20 1fyu s GLY 144 CO 0.17 0.15 0.18 -0.42 0.00 0.00 0.00 173.10 173.18 1fyu s ILE 145 N -0.70 4.82 -0.31 0.90 1.01 -0.69 -0.82 121.20 125.42 1fyu s ILE 145 Ca -0.08 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1fyu s ILE 145 Cb -0.04 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.95 1fyu s ILE 145 CO 0.01 0.05 0.18 -1.81 0.00 0.00 0.00 174.94 173.37 1fyu s ASP 146 N 1.65 5.72 -0.39 3.58 1.01 0.22 -1.71 116.67 126.76 1fyu s ASP 146 Ca 0.05 -0.41 0.01 0.00 0.71 0.00 0.00 52.55 52.91 1fyu s ASP 146 Cb -0.17 -2.05 0.11 0.00 1.01 0.00 0.00 42.92 41.82 1fyu s ASP 146 CO 0.08 -0.18 0.14 -0.69 0.21 0.00 0.00 175.17 174.73 1fyu s VAL 147 N 1.66 2.78 -1.98 -1.27 1.01 -1.26 -0.47 120.40 120.89 1fyu s VAL 147 Ca 0.05 -2.30 0.00 0.00 0.00 0.00 0.00 61.98 59.74 1fyu s VAL 147 Cb -0.17 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1fyu s VAL 147 CO 0.08 -0.66 0.00 0.59 0.00 0.00 0.00 175.10 175.11 1fyu n ASN 148 N 4.31 -5.52 -3.58 3.32 3.02 0.90 -4.90 115.26 112.81 1fyu n ASN 148 Ca 0.02 0.29 -0.09 0.00 -0.03 0.00 0.00 54.58 54.77 1fyu n ASN 148 Cb 0.41 -4.76 -0.05 0.00 -0.61 0.00 0.00 39.78 34.77 1fyu n ASN 148 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1fyu s SER 149 N -2.44 -0.32 0.28 6.41 0.15 -1.26 -2.37 113.70 114.16 1fyu s SER 149 Ca 0.00 0.33 0.26 0.00 0.70 0.00 0.00 55.95 57.23 1fyu s SER 149 Cb 0.00 0.26 0.78 0.00 -1.71 0.00 0.00 66.02 65.35 1fyu s SER 149 CO 0.00 -0.31 1.75 -0.29 1.20 0.00 0.00 173.24 175.59 1fyu h ILE 150 N 2.45 0.00 -2.20 6.45 6.09 -1.81 -3.39 117.51 125.09 1fyu h ILE 150 Ca -0.17 -0.54 -0.62 0.00 -1.37 0.00 0.00 64.86 62.16 1fyu h ILE 150 Cb 1.17 1.50 -0.13 0.00 0.47 0.00 0.00 36.82 39.83 1fyu h ILE 150 CO 0.30 0.00 0.92 -0.60 -3.07 0.00 0.00 178.15 175.69 1fyu s ARG 151 N -3.18 3.36 0.46 2.19 3.52 -1.26 -4.97 118.95 119.07 1fyu s ARG 151 Ca 0.09 -1.05 -0.22 0.00 -0.13 0.00 0.00 55.73 54.42 1fyu s ARG 151 Cb 0.10 -4.65 -0.10 0.00 -1.56 0.00 0.00 34.95 28.74 1fyu s ARG 151 CO 0.58 -1.95 0.78 0.43 -0.81 0.00 0.00 175.30 174.33 1fyu n SER 152 N 7.93 0.16 0.10 -2.12 7.64 -1.26 -4.80 113.62 121.27 1fyu n SER 152 Ca 0.13 0.93 0.12 0.00 1.01 0.00 0.00 58.87 61.05 1fyu n SER 152 Cb 0.48 -1.25 0.10 0.00 -1.01 0.00 0.00 64.21 62.53 1fyu n SER 152 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1fyu h ILE 153 N 0.99 0.00 -3.00 0.44 3.07 -1.69 -3.46 117.51 113.86 1fyu h ILE 153 Ca -0.44 -0.77 -0.15 0.00 1.55 0.00 0.00 64.86 65.05 1fyu h ILE 153 Cb 1.37 1.37 -0.26 0.00 -0.27 0.00 0.00 36.82 39.04 1fyu h ILE 153 CO 0.53 0.00 -0.38 -0.75 -1.05 0.00 0.00 178.15 176.50 1fyu s LYS 154 N -3.26 0.34 0.02 0.16 2.47 -1.25 -5.02 119.74 113.19 1fyu s LYS 154 Ca 0.03 0.44 0.03 0.00 -1.56 0.00 0.00 55.97 54.91 1fyu s LYS 154 Cb 0.11 0.14 -0.02 0.00 -1.46 0.00 0.00 37.83 36.60 1fyu s LYS 154 CO 0.74 -0.06 -0.09 0.99 0.16 0.00 0.00 175.35 177.10 1fyu s THR 155 N 0.30 0.64 -0.16 3.43 2.01 -1.26 -1.69 115.64 118.92 1fyu s THR 155 Ca -0.01 -0.71 -0.04 0.00 0.31 0.00 0.00 61.69 61.23 1fyu s THR 155 Cb -0.03 -0.61 0.06 0.00 0.01 0.00 0.00 72.50 71.93 1fyu s THR 155 CO -0.01 -0.07 0.11 -1.58 -0.69 0.00 0.00 174.62 172.37 1fyu s GLN 156 N -0.87 0.06 0.54 4.92 2.00 0.41 -4.97 119.66 121.75 1fyu s GLN 156 Ca -0.02 0.04 -0.20 0.00 -2.00 0.00 0.00 55.36 53.17 1fyu s GLN 156 Cb -0.06 -1.53 -0.05 0.00 0.80 0.00 0.00 33.01 32.16 1fyu s GLN 156 CO 0.00 -0.61 1.21 -2.14 -0.50 0.00 0.00 175.29 173.25 1fyu s PRO 157 N 2.17 3.26 0.05 1.67 0.02 -1.26 -0.23 135.00 140.68 1fyu s PRO 157 Ca 0.03 1.84 -0.11 0.00 0.02 0.00 0.00 61.00 62.79 1fyu s PRO 157 Cb -0.15 -2.12 0.01 0.00 0.02 0.00 0.00 34.50 32.26 1fyu s PRO 157 CO -0.09 -0.98 0.24 -0.59 -0.33 0.00 0.00 177.00 175.25 1fyu s PHE 158 N -1.56 0.01 -0.20 6.54 -0.12 -0.99 -4.85 117.98 116.81 1fyu s PHE 158 Ca 0.72 -0.23 -0.14 0.00 -0.05 0.00 0.00 56.93 57.22 1fyu s PHE 158 Cb -0.30 0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 1fyu s PHE 158 CO 0.35 -0.48 0.33 -1.14 -0.05 0.00 0.00 175.22 174.23 1fyu s GLN 159 N -2.79 4.17 0.14 1.99 0.74 -1.26 -3.84 119.66 118.80 1fyu s GLN 159 Ca -0.03 0.09 -0.30 0.00 0.05 0.00 0.00 55.36 55.16 1fyu s GLN 159 Cb -0.00 -3.52 -0.07 0.00 1.10 0.00 0.00 33.01 30.52 1fyu s GLN 159 CO -0.05 0.02 1.17 -1.17 -0.55 0.00 0.00 175.29 174.71 1fyu s LEU 160 N 1.13 4.43 -1.04 3.68 2.96 -1.26 -4.96 118.68 123.62 1fyu s LEU 160 Ca 0.16 2.11 -0.09 0.00 -0.22 0.00 0.00 54.13 56.09 1fyu s LEU 160 Cb -0.14 -3.60 0.26 0.00 0.50 0.00 0.00 46.19 43.21 1fyu s LEU 160 CO 0.07 -0.36 1.01 -0.62 -1.32 0.00 0.00 176.35 175.12 1fyu s ASP 161 N 0.40 7.06 -0.31 3.68 -1.08 -1.26 -5.00 116.67 120.16 1fyu s ASP 161 Ca 0.54 -3.45 -0.34 0.00 -0.52 0.00 0.00 52.55 48.78 1fyu s ASP 161 Cb -0.31 -2.17 -0.15 0.00 -1.46 0.00 0.00 42.92 38.84 1fyu s ASP 161 CO 0.33 -0.32 1.12 -3.20 0.52 0.00 0.00 175.17 173.62 1fyu n ASN 162 N 2.88 0.75 0.00 -0.34 2.85 -1.26 -0.61 115.26 119.53 1fyu n ASN 162 Ca 0.22 0.87 0.00 0.00 -0.11 0.00 0.00 54.58 55.56 1fyu n ASN 162 Cb 0.40 -0.65 0.00 0.00 1.24 0.00 0.00 39.78 40.77 1fyu n ASN 162 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1fyu n GLY 163 N 2.66 2.32 3.92 8.20 0.00 -0.09 -4.98 105.19 117.22 1fyu n GLY 163 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 1fyu n GLY 163 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fyu s GLN 164 N -0.01 3.56 0.12 1.61 -1.52 0.22 -4.79 119.66 118.86 1fyu s GLN 164 Ca 0.00 -0.04 -0.30 0.00 -1.95 0.00 0.00 55.36 53.07 1fyu s GLN 164 Cb 0.00 -2.57 -0.06 0.00 -0.22 0.00 0.00 33.01 30.16 1fyu s GLN 164 CO 0.00 0.07 1.06 0.08 -0.25 0.00 0.00 175.29 176.25 1fyu s VAL 165 N -2.35 4.17 0.04 1.09 1.01 -1.26 -4.31 120.40 118.79 1fyu s VAL 165 Ca 0.44 1.77 0.08 0.00 0.00 0.00 0.00 61.98 64.27 1fyu s VAL 165 Cb -0.10 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1fyu s VAL 165 CO 0.36 0.25 -0.23 0.00 0.00 0.00 0.00 175.10 175.48 1fyu s ALA 166 N 0.14 2.40 -0.13 5.51 0.00 0.60 -4.19 121.76 126.08 1fyu s ALA 166 Ca 0.50 -1.24 -0.04 0.00 0.00 0.00 0.00 51.96 51.19 1fyu s ALA 166 Cb -0.27 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 1fyu s ALA 166 CO 0.32 0.55 -0.01 -0.80 0.00 0.00 0.00 175.76 175.82 1fyu s ASN 167 N -1.31 5.11 -0.01 0.00 0.01 0.87 -2.07 114.94 117.54 1fyu s ASN 167 Ca 0.13 0.01 0.07 0.00 -0.71 0.00 0.00 52.86 52.37 1fyu s ASN 167 Cb -0.10 -1.68 -0.02 0.00 0.41 0.00 0.00 41.25 39.86 1fyu s ASN 167 CO 0.03 0.25 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.95 1fyu s VAL 168 N -0.14 1.88 -0.08 1.60 1.01 -0.11 -0.61 120.40 123.96 1fyu s VAL 168 Ca 0.04 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 1fyu s VAL 168 Cb -0.13 -1.57 0.03 0.00 0.00 0.00 0.00 36.38 34.71 1fyu s VAL 168 CO 0.02 0.51 -0.03 -0.69 0.00 0.00 0.00 175.10 174.91 1fyu s VAL 169 N -0.58 0.59 -0.12 2.92 1.01 -0.56 -2.24 120.40 121.41 1fyu s VAL 169 Ca 0.09 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1fyu s VAL 169 Cb -0.09 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.61 1fyu s VAL 169 CO -0.01 0.29 -0.20 -0.63 0.00 0.00 0.00 175.10 174.55 1fyu s ILE 170 N 1.73 1.86 -0.01 2.22 1.01 -0.29 -0.37 121.20 127.35 1fyu s ILE 170 Ca 0.02 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.84 1fyu s ILE 170 Cb -0.13 -1.66 -0.01 0.00 0.01 0.00 0.00 42.46 40.68 1fyu s ILE 170 CO -0.05 0.51 -0.11 -0.75 0.00 0.00 0.00 174.94 174.55 1fyu s LYS 171 N 0.81 0.86 -0.10 2.79 2.20 0.53 -0.95 119.74 125.87 1fyu s LYS 171 Ca -0.08 -0.38 0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1fyu s LYS 171 Cb -0.16 -0.83 0.02 0.00 -1.51 0.00 0.00 37.83 35.35 1fyu s LYS 171 CO -0.00 0.23 -0.14 -0.47 -0.36 0.00 0.00 175.35 174.60 1fyu s TYR 172 N -0.24 1.81 -0.40 4.03 5.04 -0.04 -0.71 117.35 126.84 1fyu s TYR 172 Ca 0.04 -0.82 -0.10 0.00 -2.44 0.00 0.00 57.07 53.75 1fyu s TYR 172 Cb -0.04 -1.33 0.06 0.00 0.35 0.00 0.00 41.96 41.00 1fyu s TYR 172 CO -0.00 -0.44 0.24 0.34 -1.34 0.00 0.00 175.55 174.35 1fyu s ASP 173 N 0.99 5.68 0.30 4.32 -1.08 -0.60 -2.47 116.67 123.82 1fyu s ASP 173 Ca -0.07 -1.28 0.01 0.00 -0.52 0.00 0.00 52.55 50.68 1fyu s ASP 173 Cb -0.15 -2.00 0.54 0.00 -1.46 0.00 0.00 42.92 39.84 1fyu s ASP 173 CO -0.01 -0.47 1.91 0.00 0.52 0.00 0.00 175.17 177.11 1fyu h ALA 174 N 8.43 1.52 -0.02 3.66 0.00 -1.87 0.78 119.26 131.75 1fyu h ALA 174 Ca -0.24 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1fyu h ALA 174 Cb 1.09 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1fyu h ALA 174 CO 0.72 0.34 -0.39 0.77 0.00 0.00 0.00 179.25 180.69 1fyu h SER 175 N 1.02 -1.20 0.44 0.00 0.02 -1.93 -2.86 113.55 109.05 1fyu h SER 175 Ca 0.39 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 1fyu h SER 175 Cb 0.21 0.48 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1fyu h SER 175 CO -0.15 -0.44 -0.76 -1.54 -1.14 0.00 0.00 176.83 172.80 1fyu n SER 176 N -5.44 0.63 -1.57 3.07 3.41 -1.12 -4.95 113.62 107.65 1fyu n SER 176 Ca -0.05 -0.31 -0.14 0.00 -0.26 0.00 0.00 58.87 58.11 1fyu n SER 176 Cb 0.36 0.53 -0.01 0.00 -0.26 0.00 0.00 64.21 64.83 1fyu n SER 176 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fyu n LYS 177 N -1.72 -1.12 -3.59 4.33 5.02 0.27 -4.92 118.16 116.43 1fyu n LYS 177 Ca 0.04 0.72 -0.36 0.00 -2.02 0.00 0.00 58.31 56.68 1fyu n LYS 177 Cb 0.38 -4.99 -0.08 0.00 -0.02 0.00 0.00 35.03 30.32 1fyu n LYS 177 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1fyu s ILE 178 N -2.69 5.33 -0.35 -0.18 1.01 -1.06 -1.03 121.20 122.22 1fyu s ILE 178 Ca 0.00 0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.96 1fyu s ILE 178 Cb 0.00 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.92 1fyu s ILE 178 CO 0.00 0.37 0.15 -0.22 0.00 0.00 0.00 174.94 175.24 1fyu s LEU 179 N 0.72 4.45 -0.12 2.97 2.96 -0.26 -1.56 118.68 127.85 1fyu s LEU 179 Ca 0.13 -0.98 0.01 0.00 -0.22 0.00 0.00 54.13 53.07 1fyu s LEU 179 Cb -0.13 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1fyu s LEU 179 CO 0.03 -0.33 -0.17 -1.38 -1.32 0.00 0.00 176.35 173.18 1fyu s HIS 180 N 1.50 2.72 0.08 5.38 -3.43 0.11 -1.87 115.29 119.78 1fyu s HIS 180 Ca 0.01 -0.78 0.09 0.00 -0.80 0.00 0.00 55.06 53.58 1fyu s HIS 180 Cb -0.19 -1.79 -0.03 0.00 -1.43 0.00 0.00 32.58 29.14 1fyu s HIS 180 CO 0.05 -0.28 -0.24 0.00 -2.00 0.00 0.00 174.74 172.27 1fyu s ALA 181 N 0.33 2.04 0.00 -1.38 0.00 0.03 -0.35 121.76 122.43 1fyu s ALA 181 Ca -0.14 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.56 1fyu s ALA 181 Cb -0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.60 1fyu s ALA 181 CO 0.07 0.46 -0.01 0.54 0.00 0.00 0.00 175.76 176.81 1fyu s VAL 182 N -0.96 0.08 -0.07 0.00 0.11 0.50 -1.35 120.40 118.70 1fyu s VAL 182 Ca 0.10 -0.08 0.04 0.00 -2.93 0.00 0.00 61.98 59.11 1fyu s VAL 182 Cb -0.10 -0.08 -0.00 0.00 -1.53 0.00 0.00 36.38 34.67 1fyu s VAL 182 CO 0.04 -0.00 -0.21 -0.22 -3.33 0.00 0.00 175.10 171.38 1fyu s LEU 183 N -0.09 1.97 -0.02 2.54 2.96 0.29 -1.50 118.68 124.83 1fyu s LEU 183 Ca -0.00 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.48 1fyu s LEU 183 Cb -0.01 -1.21 -0.00 0.00 0.50 0.00 0.00 46.19 45.47 1fyu s LEU 183 CO -0.00 0.15 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.38 1fyu s VAL 184 N 0.25 0.93 -0.46 1.68 1.01 0.22 -0.52 120.40 123.51 1fyu s VAL 184 Ca -0.12 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 1fyu s VAL 184 Cb -0.16 -0.79 0.12 0.00 0.00 0.00 0.00 36.38 35.56 1fyu s VAL 184 CO 0.06 0.27 0.27 -0.31 0.00 0.00 0.00 175.10 175.39 1fyu s TYR 185 N -0.11 3.54 0.25 5.22 4.12 -0.39 -0.09 117.35 129.89 1fyu s TYR 185 Ca 0.02 -2.45 -0.03 0.00 0.02 0.00 0.00 57.07 54.63 1fyu s TYR 185 Cb -0.06 -3.24 0.50 0.00 -1.52 0.00 0.00 41.96 37.64 1fyu s TYR 185 CO 0.00 -0.95 1.72 -1.35 0.02 0.00 0.00 175.55 175.00 1fyu h PRO 186 N 7.85 0.42 -0.42 -1.71 0.11 -1.86 1.13 132.00 137.51 1fyu h PRO 186 Ca -0.11 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 66.05 1fyu h PRO 186 Cb 1.03 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 31.97 1fyu h PRO 186 CO 0.71 0.28 -0.01 0.66 -0.21 0.00 0.00 178.00 179.44 1fyu h SER 187 N 0.44 -0.19 -0.00 -2.05 4.64 -1.93 -3.05 113.55 111.40 1fyu h SER 187 Ca 0.44 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 1fyu h SER 187 Cb 0.70 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1fyu h SER 187 CO -0.43 -0.06 -0.81 -1.54 -0.87 0.00 0.00 176.83 173.12 1fyu n SER 188 N -5.21 0.86 0.00 4.97 3.41 -0.94 -4.98 113.62 111.72 1fyu n SER 188 Ca 0.03 -0.93 0.00 0.00 -0.26 0.00 0.00 58.87 57.72 1fyu n SER 188 Cb 0.22 0.98 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1fyu n SER 188 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fyu n GLY 189 N 1.41 0.57 3.77 5.00 0.00 0.38 -5.00 105.19 111.32 1fyu n GLY 189 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1fyu n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fyu s ALA 190 N -2.38 3.31 -0.06 4.61 0.00 -1.16 -4.81 121.76 121.28 1fyu s ALA 190 Ca 0.00 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.19 1fyu s ALA 190 Cb 0.00 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.67 1fyu s ALA 190 CO 0.00 -0.75 -0.05 0.42 0.00 0.00 0.00 175.76 175.38 1fyu s ILE 191 N -1.24 0.64 0.01 0.00 1.01 -1.26 -1.26 121.20 119.09 1fyu s ILE 191 Ca 0.55 -0.14 0.07 0.00 0.00 0.00 0.00 60.65 61.13 1fyu s ILE 191 Cb -0.38 -0.67 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1fyu s ILE 191 CO 0.49 0.27 -0.20 -0.31 0.00 0.00 0.00 174.94 175.18 1fyu s TYR 192 N 1.19 1.82 0.04 3.97 2.02 0.32 -4.99 117.35 121.71 1fyu s TYR 192 Ca -0.06 -0.36 0.02 0.00 -0.37 0.00 0.00 57.07 56.30 1fyu s TYR 192 Cb -0.14 -1.13 -0.02 0.00 -0.40 0.00 0.00 41.96 40.27 1fyu s TYR 192 CO -0.01 0.02 -0.08 -0.08 -1.57 0.00 0.00 175.55 173.83 1fyu s THR 193 N -0.62 0.55 -0.17 -0.71 -1.32 -1.26 -0.55 115.64 111.55 1fyu s THR 193 Ca 0.08 -1.02 -0.17 0.00 -1.21 0.00 0.00 61.69 59.37 1fyu s THR 193 Cb -0.08 -0.60 0.05 0.00 -1.51 0.00 0.00 72.50 70.35 1fyu s THR 193 CO 0.00 -0.34 0.47 -0.51 -2.21 0.00 0.00 174.62 172.04 1fyu s ILE 194 N -1.28 0.00 -0.07 5.08 2.07 -0.45 -5.00 121.20 121.54 1fyu s ILE 194 Ca -0.09 -0.01 -0.12 0.00 -1.41 0.00 0.00 60.65 59.02 1fyu s ILE 194 Cb -0.09 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.85 1fyu s ILE 194 CO 0.00 -0.01 0.29 0.00 -1.91 0.00 0.00 174.94 173.32 1fyu s ALA 195 N 0.19 -0.72 0.14 1.50 0.00 -1.26 -0.79 121.76 120.82 1fyu s ALA 195 Ca -0.00 0.59 -0.15 0.00 0.00 0.00 0.00 51.96 52.39 1fyu s ALA 195 Cb -0.03 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.86 1fyu s ALA 195 CO 0.01 -0.19 0.39 -2.00 0.00 0.00 0.00 175.76 173.97 1fyu s GLU 196 N -0.47 1.12 -0.15 0.00 2.56 -0.78 -5.00 118.70 115.97 1fyu s GLU 196 Ca -0.06 -0.82 -0.20 0.00 0.00 0.00 0.00 54.97 53.89 1fyu s GLU 196 Cb -0.04 0.46 -0.03 0.00 2.00 0.00 0.00 34.13 36.51 1fyu s GLU 196 CO 0.02 -0.44 0.56 0.42 -0.56 0.00 0.00 175.26 175.26 1fyu s ILE 197 N -3.84 5.11 -0.06 -3.70 1.01 -1.26 -1.10 121.20 117.35 1fyu s ILE 197 Ca 0.06 1.08 -0.00 0.00 0.00 0.00 0.00 60.65 61.79 1fyu s ILE 197 Cb 0.02 -3.89 0.03 0.00 0.01 0.00 0.00 42.46 38.63 1fyu s ILE 197 CO -0.09 0.22 -0.01 -0.69 0.00 0.00 0.00 174.94 174.38 1fyu s VAL 198 N 1.22 0.41 -0.91 2.92 1.01 -0.20 -4.96 120.40 119.89 1fyu s VAL 198 Ca 0.28 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 62.14 1fyu s VAL 198 Cb -0.16 -0.51 0.18 0.00 0.00 0.00 0.00 36.38 35.89 1fyu s VAL 198 CO 0.11 0.24 0.97 -0.62 0.00 0.00 0.00 175.10 175.80 1fyu s ASP 199 N 1.52 6.76 0.44 3.32 3.68 -1.26 -4.67 116.67 126.47 1fyu s ASP 199 Ca -0.02 -2.50 0.26 0.00 2.13 0.00 0.00 52.55 52.42 1fyu s ASP 199 Cb -0.13 -2.30 1.28 0.00 -1.45 0.00 0.00 42.92 40.32 1fyu s ASP 199 CO -0.03 -0.77 1.74 0.58 0.13 0.00 0.00 175.17 176.82 1fyu h VAL 200 N 5.14 0.40 0.00 1.11 2.07 -1.97 -1.19 116.25 121.80 1fyu h VAL 200 Ca 0.14 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1fyu h VAL 200 Cb 1.01 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1fyu h VAL 200 CO 0.94 0.04 0.00 2.29 0.02 0.00 0.00 177.57 180.86 1fyu n LYS 201 N -4.53 0.10 -0.29 1.57 2.85 -1.26 -1.03 118.16 115.56 1fyu n LYS 201 Ca 0.28 0.19 0.08 0.00 -1.05 0.00 0.00 58.31 57.81 1fyu n LYS 201 Cb 1.10 -1.64 0.23 0.00 -0.65 0.00 0.00 35.03 34.07 1fyu n LYS 201 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1fyu n GLN 202 N -1.82 2.93 0.06 -1.58 6.02 -0.45 -4.66 117.38 117.87 1fyu n GLN 202 Ca 0.05 -2.36 0.00 0.00 -0.01 0.00 0.00 57.00 54.68 1fyu n GLN 202 Cb 0.30 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 30.10 1fyu n GLN 202 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1fyu n VAL 203 N 0.81 0.47 -3.41 5.09 0.31 -1.03 -5.06 118.33 115.51 1fyu n VAL 203 Ca 0.17 0.16 -0.23 0.00 -0.01 0.00 0.00 64.34 64.43 1fyu n VAL 203 Cb 0.56 -1.15 -0.01 0.00 -0.91 0.00 0.00 33.84 32.34 1fyu n VAL 203 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1fyu s LEU 204 N -6.48 3.99 0.78 7.52 1.43 -0.20 -4.32 118.68 121.40 1fyu s LEU 204 Ca 0.00 0.28 -0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1fyu s LEU 204 Cb 0.00 -3.14 0.10 0.00 0.03 0.00 0.00 46.19 43.17 1fyu s LEU 204 CO 0.00 -0.35 1.11 -2.16 0.23 0.00 0.00 176.35 175.17 1fyu s PRO 205 N -4.29 1.82 0.21 1.29 0.04 -1.26 -4.71 135.00 128.09 1fyu s PRO 205 Ca 0.41 -0.28 -0.09 0.00 0.04 0.00 0.00 61.00 61.08 1fyu s PRO 205 Cb -0.10 -2.08 0.26 0.00 0.04 0.00 0.00 34.50 32.62 1fyu s PRO 205 CO 0.35 -1.55 1.79 0.93 0.04 0.00 0.00 177.00 178.56 1fyu h GLU 206 N -0.89 0.61 -6.41 4.56 5.08 -1.96 -3.42 114.58 112.16 1fyu h GLU 206 Ca -0.44 -0.04 -0.69 0.00 -1.00 0.00 0.00 59.36 57.20 1fyu h GLU 206 Cb 1.30 -0.14 -0.22 0.00 0.50 0.00 0.00 28.75 30.19 1fyu h GLU 206 CO 0.56 0.40 -0.77 -1.58 -1.00 0.00 0.00 179.01 176.62 1fyu s TRP 207 N -6.09 2.68 0.07 4.33 0.52 -1.26 -1.43 118.94 117.76 1fyu s TRP 207 Ca -0.13 -0.18 -0.07 0.00 0.02 0.00 0.00 56.10 55.75 1fyu s TRP 207 Cb 0.16 -1.57 -0.01 0.00 -1.15 0.00 0.00 33.47 30.91 1fyu s TRP 207 CO 0.76 0.24 0.13 0.14 0.02 0.00 0.00 176.95 178.24 1fyu s VAL 208 N -0.84 0.15 -0.00 4.03 -7.23 -0.81 -4.45 120.40 111.24 1fyu s VAL 208 Ca 0.14 -1.25 -0.10 0.00 -1.81 0.00 0.00 61.98 58.96 1fyu s VAL 208 Cb -0.11 -1.24 -0.05 0.00 0.56 0.00 0.00 36.38 35.54 1fyu s VAL 208 CO 0.03 -0.69 0.31 -1.81 -0.31 0.00 0.00 175.10 172.63 1fyu s ASP 209 N -2.65 6.60 -0.06 4.85 1.01 0.09 -1.28 116.67 125.22 1fyu s ASP 209 Ca 0.02 0.71 0.04 0.00 0.71 0.00 0.00 52.55 54.03 1fyu s ASP 209 Cb 0.04 -2.15 -0.02 0.00 1.01 0.00 0.00 42.92 41.79 1fyu s ASP 209 CO -0.09 0.29 -0.17 0.68 0.21 0.00 0.00 175.17 176.09 1fyu s VAL 210 N -1.20 2.80 0.14 -1.27 -7.23 -1.26 -1.64 120.40 110.73 1fyu s VAL 210 Ca 0.25 -0.81 -0.08 0.00 -1.81 0.00 0.00 61.98 59.53 1fyu s VAL 210 Cb -0.14 -2.09 0.03 0.00 0.56 0.00 0.00 36.38 34.74 1fyu s VAL 210 CO 0.13 0.57 0.41 0.61 -0.31 0.00 0.00 175.10 176.52 1fyu n GLY 211 N 2.65 1.27 3.17 2.32 0.00 0.18 -1.40 105.19 113.37 1fyu n GLY 211 Ca -0.17 -1.08 -0.25 0.00 0.00 0.00 0.00 46.02 44.52 1fyu n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fyu s LEU 212 N 0.00 2.04 0.01 0.99 1.43 0.08 -0.85 118.68 122.38 1fyu s LEU 212 Ca 0.09 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1fyu s LEU 212 Cb -0.02 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 1fyu s LEU 212 CO 0.04 0.21 -0.02 -0.55 0.23 0.00 0.00 176.35 176.25 1fyu s SER 213 N -0.46 0.24 0.05 2.29 0.15 -0.03 -0.44 113.70 115.50 1fyu s SER 213 Ca 0.07 -0.25 -0.04 0.00 0.70 0.00 0.00 55.95 56.43 1fyu s SER 213 Cb -0.07 0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.25 1fyu s SER 213 CO -0.00 -0.12 0.06 -0.83 1.20 0.00 0.00 173.24 173.54 1fyu s GLY 214 N -0.70 0.27 -0.09 9.45 0.00 -0.39 0.43 107.32 116.30 1fyu s GLY 214 Ca -0.07 -0.83 -0.22 0.00 0.00 0.00 0.00 44.72 43.61 1fyu s GLY 214 CO -0.00 -0.96 0.52 0.00 0.00 0.00 0.00 173.10 172.66 1fyu s ALA 215 N -3.34 -1.33 0.33 3.20 0.00 -0.81 -1.85 121.76 117.96 1fyu s ALA 215 Ca 0.01 1.08 0.08 0.00 0.00 0.00 0.00 51.96 53.13 1fyu s ALA 215 Cb 0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1fyu s ALA 215 CO -0.08 -0.30 0.26 0.95 0.00 0.00 0.00 175.76 176.59 1fyu s THR 216 N -0.77 3.50 1.16 0.00 -4.23 0.32 0.45 115.64 116.07 1fyu s THR 216 Ca -0.08 -1.44 -0.13 0.00 -1.18 0.00 0.00 61.69 58.86 1fyu s THR 216 Cb -0.03 -3.16 0.26 0.00 1.34 0.00 0.00 72.50 70.91 1fyu s THR 216 CO 0.05 -0.19 0.88 0.61 -0.54 0.00 0.00 174.62 175.44 1fyu n GLY 217 N -1.32 -2.02 0.10 3.99 0.00 0.14 -3.81 105.19 102.27 1fyu n GLY 217 Ca -0.02 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.03 1fyu n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fyu n ALA 218 N -4.89 2.75 -2.28 4.61 0.00 -1.26 0.74 120.51 120.19 1fyu n ALA 218 Ca 0.03 -0.25 -0.14 0.00 0.00 0.00 0.00 53.44 53.08 1fyu n ALA 218 Cb 0.55 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.55 1fyu n ALA 218 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1fyu s GLN 219 N -2.53 1.01 -0.05 0.00 -2.07 -1.26 -4.91 119.66 109.85 1fyu s GLN 219 Ca 0.27 -1.39 -0.39 0.00 -1.82 0.00 0.00 55.36 52.03 1fyu s GLN 219 Cb 0.20 -0.58 -0.18 0.00 -1.09 0.00 0.00 33.01 31.36 1fyu s GLN 219 CO 0.49 0.07 1.33 -2.13 -1.32 0.00 0.00 175.29 173.73 1fyu n ARG 220 N -0.06 0.68 -0.90 9.60 0.63 -1.26 -1.62 116.66 123.73 1fyu n ARG 220 Ca -0.11 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 1fyu n ARG 220 Cb 0.60 -1.83 0.00 0.00 0.45 0.00 0.00 32.46 31.68 1fyu n ARG 220 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1fyu n ASP 221 N 2.73 -3.42 -3.96 6.15 10.43 -1.26 -4.65 116.55 122.56 1fyu n ASP 221 Ca 0.21 0.00 -0.43 0.00 2.57 0.00 0.00 54.79 57.15 1fyu n ASP 221 Cb 0.12 -2.18 0.00 0.00 1.84 0.00 0.00 41.12 40.90 1fyu n ASP 221 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1fyu n ALA 222 N 1.00 5.08 -2.29 2.24 0.00 -0.64 -4.48 120.51 121.43 1fyu n ALA 222 Ca 0.00 -4.17 -0.11 0.00 0.00 0.00 0.00 53.44 49.16 1fyu n ALA 222 Cb 0.22 -3.17 -0.09 0.00 0.00 0.00 0.00 19.45 16.41 1fyu n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fyu s ALA 223 N 1.50 0.87 0.30 0.00 0.00 -1.26 0.26 121.76 123.43 1fyu s ALA 223 Ca 0.43 -1.50 -0.19 0.00 0.00 0.00 0.00 51.96 50.70 1fyu s ALA 223 Cb 0.09 1.14 0.05 0.00 0.00 0.00 0.00 23.12 24.39 1fyu s ALA 223 CO -0.01 -0.57 0.83 -1.83 0.00 0.00 0.00 175.76 174.17 1fyu s GLU 224 N -4.09 1.85 0.22 0.00 -1.05 -1.24 -4.40 118.70 109.99 1fyu s GLU 224 Ca 0.31 -1.14 -0.06 0.00 -0.15 0.00 0.00 54.97 53.93 1fyu s GLU 224 Cb 0.06 0.56 -0.06 0.00 -0.44 0.00 0.00 34.13 34.25 1fyu s GLU 224 CO 0.07 -0.86 0.49 0.99 0.95 0.00 0.00 175.26 176.90 1fyu s THR 225 N -2.83 5.05 -0.40 1.83 2.01 -0.48 -4.77 115.64 116.06 1fyu s THR 225 Ca 0.15 0.13 0.07 0.00 0.31 0.00 0.00 61.69 62.35 1fyu s THR 225 Cb -0.05 -3.67 0.23 0.00 0.01 0.00 0.00 72.50 69.03 1fyu s THR 225 CO 0.08 -0.14 0.52 1.41 -0.69 0.00 0.00 174.62 175.80 1fyu n HIS 226 N -0.39 -0.74 -3.67 4.92 -0.00 -1.26 -3.83 115.22 110.25 1fyu n HIS 226 Ca -0.02 -3.35 -0.37 0.00 -0.00 0.00 0.00 57.72 53.99 1fyu n HIS 226 Cb 0.53 -0.07 -0.06 0.00 -0.00 0.00 0.00 29.99 30.38 1fyu n HIS 226 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1fyu s ASP 227 N -0.95 6.50 -0.11 0.41 -0.00 -0.94 -1.86 116.67 119.73 1fyu s ASP 227 Ca 0.34 0.60 0.04 0.00 -0.00 0.00 0.00 52.55 53.53 1fyu s ASP 227 Cb 0.15 -2.15 0.00 0.00 -0.00 0.00 0.00 42.92 40.92 1fyu s ASP 227 CO -0.14 0.28 -0.23 -0.69 -0.00 0.00 0.00 175.17 174.39 1fyu s VAL 228 N -0.50 2.08 -0.12 -1.27 1.01 0.04 -1.05 120.40 120.59 1fyu s VAL 228 Ca 0.17 -1.01 0.20 0.00 0.00 0.00 0.00 61.98 61.34 1fyu s VAL 228 Cb -0.13 -1.80 -0.27 0.00 0.00 0.00 0.00 36.38 34.17 1fyu s VAL 228 CO 0.06 0.56 0.31 -1.22 0.00 0.00 0.00 175.10 174.81 1fyu n TYR 229 N 3.61 0.10 -3.48 5.22 4.02 0.22 -1.46 117.16 125.40 1fyu n TYR 229 Ca -0.19 0.03 -0.12 0.00 -0.01 0.00 0.00 57.90 57.61 1fyu n TYR 229 Cb 0.53 -0.81 -0.03 0.00 -0.02 0.00 0.00 39.34 39.01 1fyu n TYR 229 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1fyu s SER 230 N -5.13 -0.50 -0.28 7.72 1.04 -1.25 -4.06 113.70 111.23 1fyu s SER 230 Ca -0.08 0.01 -0.16 0.00 0.48 0.00 0.00 55.95 56.19 1fyu s SER 230 Cb 0.09 0.56 0.10 0.00 0.10 0.00 0.00 66.02 66.88 1fyu s SER 230 CO 0.86 -0.90 0.77 0.86 0.98 0.00 0.00 173.24 175.80 1fyu s TRP 231 N -3.48 -0.94 0.07 5.02 -0.00 -0.92 -2.07 118.94 116.62 1fyu s TRP 231 Ca 0.00 1.87 0.03 0.00 -0.00 0.00 0.00 56.10 58.00 1fyu s TRP 231 Cb -0.00 0.56 -0.03 0.00 -0.00 0.00 0.00 33.47 33.99 1fyu s TRP 231 CO -0.10 -0.46 -0.09 -1.54 -0.00 0.00 0.00 176.95 174.75 1fyu s SER 232 N 1.57 1.24 -0.02 5.86 1.04 0.48 -0.73 113.70 123.14 1fyu s SER 232 Ca -0.10 -0.72 -0.16 0.00 0.48 0.00 0.00 55.95 55.45 1fyu s SER 232 Cb -0.05 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.12 1fyu s SER 232 CO -0.19 -0.24 0.33 0.12 0.98 0.00 0.00 173.24 174.24 1fyu s PHE 233 N -2.08 -0.21 -0.27 5.02 5.36 -0.39 -1.50 117.98 123.91 1fyu s PHE 233 Ca 0.00 0.32 -0.24 0.00 -0.96 0.00 0.00 56.93 56.04 1fyu s PHE 233 Cb -0.05 0.12 0.07 0.00 -0.34 0.00 0.00 43.02 42.81 1fyu s PHE 233 CO -0.00 -0.41 0.71 1.14 -1.46 0.00 0.00 175.22 175.20 1fyu s GLN 234 N -1.33 0.83 -0.01 10.12 -2.07 -0.42 -1.54 119.66 125.23 1fyu s GLN 234 Ca -0.13 0.99 -0.04 0.00 -1.82 0.00 0.00 55.36 54.37 1fyu s GLN 234 Cb -0.05 0.40 -0.00 0.00 -1.09 0.00 0.00 33.01 32.27 1fyu s GLN 234 CO 0.05 -0.10 0.08 0.00 -1.32 0.00 0.00 175.29 173.99 1fyu s ALA 235 N 0.41 -0.17 -0.15 2.60 0.00 -0.88 -0.81 121.76 122.75 1fyu s ALA 235 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 51.96 51.90 1fyu s ALA 235 Cb -0.05 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.10 1fyu s ALA 235 CO 0.00 -0.12 -0.06 -1.12 0.00 0.00 0.00 175.76 174.47 1fyu s SER 236 N -0.70 2.61 -0.41 0.00 0.01 0.07 -2.47 113.70 112.81 1fyu s SER 236 Ca -0.08 -0.54 -0.12 0.00 1.31 0.00 0.00 55.95 56.52 1fyu s SER 236 Cb -0.05 -0.89 0.05 0.00 0.21 0.00 0.00 66.02 65.34 1fyu s SER 236 CO 0.00 -0.16 0.27 -0.22 0.41 0.00 0.00 173.24 173.55 1fyu s LEU 237 N 1.66 5.07 0.01 2.44 0.20 -0.69 -2.23 118.68 125.13 1fyu s LEU 237 Ca 0.02 -1.14 -0.35 0.00 0.69 0.00 0.00 54.13 53.35 1fyu s LEU 237 Cb -0.14 -2.08 -0.14 0.00 -0.43 0.00 0.00 46.19 43.40 1fyu s LEU 237 CO -0.08 -0.48 1.69 -0.81 -0.29 0.00 0.00 176.35 176.38 1fyu n PRO 238 N 5.06 1.93 -0.97 0.98 -0.04 -1.26 -1.82 135.00 138.88 1fyu n PRO 238 Ca -0.11 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 1fyu n PRO 238 Cb 0.45 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1fyu n PRO 238 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85