#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ycf s GLN 3 N 0.00 2.51 0.73 -1.46 -1.52 -1.26 -4.55 119.66 114.11 1ycf s GLN 3 Ca 0.00 -0.88 -0.12 0.00 -1.95 0.00 0.00 55.36 52.42 1ycf s GLN 3 Cb 0.00 -2.51 0.03 0.00 -0.22 0.00 0.00 33.01 30.32 1ycf s GLN 3 CO 0.00 0.53 1.09 -2.14 -0.25 0.00 0.00 175.29 174.51 1ycf s PRO 4 N -2.39 2.52 -0.07 2.91 0.02 -1.26 -5.02 135.00 131.71 1ycf s PRO 4 Ca 0.26 1.16 -0.00 0.00 0.02 0.00 0.00 61.00 62.44 1ycf s PRO 4 Cb -0.11 -1.93 0.02 0.00 0.02 0.00 0.00 34.50 32.50 1ycf s PRO 4 CO 0.18 -1.44 -0.03 0.08 -0.33 0.00 0.00 177.00 175.47 1ycf s VAL 5 N -2.82 0.55 0.18 3.83 1.01 -0.89 -4.97 120.40 117.29 1ycf s VAL 5 Ca 0.62 -0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 1ycf s VAL 5 Cb -0.17 -0.63 -0.08 0.00 0.00 0.00 0.00 36.38 35.50 1ycf s VAL 5 CO 0.53 0.26 1.02 0.00 0.00 0.00 0.00 175.10 176.91 1ycf s ALA 6 N 1.51 3.33 -0.07 5.51 0.00 -1.26 0.12 121.76 130.89 1ycf s ALA 6 Ca -0.01 0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.70 1ycf s ALA 6 Cb -0.13 -3.29 -0.24 0.00 0.00 0.00 0.00 23.12 19.45 1ycf s ALA 6 CO -0.04 -0.04 0.55 -0.89 0.00 0.00 0.00 175.76 175.34 1ycf n ILE 7 N 2.14 1.67 -3.82 0.00 5.41 0.61 -4.86 119.36 120.52 1ycf n ILE 7 Ca 0.01 -0.75 -0.02 0.00 1.00 0.00 0.00 62.75 62.99 1ycf n ILE 7 Cb 0.47 -1.29 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 1ycf n ILE 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1ycf s THR 8 N -2.58 0.00 0.20 1.39 -1.32 -1.09 -5.05 115.64 107.19 1ycf s THR 8 Ca -0.11 -0.55 -0.32 0.00 -1.21 0.00 0.00 61.69 59.50 1ycf s THR 8 Cb 0.07 -2.50 -0.14 0.00 -1.51 0.00 0.00 72.50 68.43 1ycf s THR 8 CO 0.80 0.00 1.48 -0.90 -2.21 0.00 0.00 174.62 173.79 1ycf n ASP 9 N -0.88 2.87 0.00 8.08 5.75 -1.26 -1.45 116.55 129.65 1ycf n ASP 9 Ca -0.04 1.12 0.00 0.00 -0.01 0.00 0.00 54.79 55.86 1ycf n ASP 9 Cb 0.60 -1.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.27 1ycf n ASP 9 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ycf n GLY 10 N 2.66 2.33 3.21 6.12 0.00 -1.26 -4.94 105.19 113.32 1ycf n GLY 10 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1ycf n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ycf s ILE 11 N -1.88 3.27 0.05 -0.61 1.01 -0.53 0.44 121.20 122.94 1ycf s ILE 11 Ca 0.00 -1.25 0.08 0.00 0.00 0.00 0.00 60.65 59.48 1ycf s ILE 11 Cb 0.00 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.59 1ycf s ILE 11 CO 0.00 -0.10 -0.22 -0.31 0.00 0.00 0.00 174.94 174.31 1ycf s TYR 12 N 1.31 2.44 -0.29 3.97 2.02 0.57 -0.28 117.35 127.09 1ycf s TYR 12 Ca -0.04 -0.33 -0.24 0.00 -0.37 0.00 0.00 57.07 56.09 1ycf s TYR 12 Cb -0.19 -1.42 -0.00 0.00 -0.40 0.00 0.00 41.96 39.94 1ycf s TYR 12 CO 0.00 0.20 0.81 -0.46 -1.57 0.00 0.00 175.55 174.52 1ycf s TRP 13 N -0.87 3.23 -0.28 2.71 -0.00 0.31 -0.30 118.94 123.75 1ycf s TRP 13 Ca 0.13 0.92 0.11 0.00 -0.00 0.00 0.00 56.10 57.26 1ycf s TRP 13 Cb -0.10 -3.18 0.47 0.00 -0.00 0.00 0.00 33.47 30.66 1ycf s TRP 13 CO 0.04 -0.52 1.17 1.33 -0.00 0.00 0.00 176.95 178.97 1ycf n VAL 14 N 5.46 2.25 -1.91 5.86 0.24 0.08 -2.10 118.33 128.20 1ycf n VAL 14 Ca 0.04 -3.92 -0.08 0.00 -2.04 0.00 0.00 64.34 58.35 1ycf n VAL 14 Cb 0.48 -0.60 0.05 0.00 -1.47 0.00 0.00 33.84 32.30 1ycf n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ycf n GLY 15 N -0.69 -0.09 3.16 7.63 0.00 -1.23 -4.59 105.19 109.39 1ycf n GLY 15 Ca 0.36 -1.86 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 1ycf n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ycf s ALA 16 N -3.34 1.34 -0.16 4.61 0.00 -0.28 -4.80 121.76 119.12 1ycf s ALA 16 Ca 0.22 -0.78 -0.08 0.00 0.00 0.00 0.00 51.96 51.32 1ycf s ALA 16 Cb -0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1ycf s ALA 16 CO 0.15 0.30 0.11 0.08 0.00 0.00 0.00 175.76 176.40 1ycf s VAL 17 N -0.57 5.22 -0.60 0.00 1.01 -1.26 0.53 120.40 124.73 1ycf s VAL 17 Ca 0.05 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 1ycf s VAL 17 Cb -0.07 -3.32 0.16 0.00 0.00 0.00 0.00 36.38 33.15 1ycf s VAL 17 CO 0.00 0.53 0.41 -0.62 0.00 0.00 0.00 175.10 175.42 1ycf s ASP 18 N -0.26 5.19 0.09 3.32 -1.08 0.27 -4.96 116.67 119.24 1ycf s ASP 18 Ca 0.10 -2.79 -0.17 0.00 -0.52 0.00 0.00 52.55 49.17 1ycf s ASP 18 Cb -0.12 -1.84 -0.08 0.00 -1.46 0.00 0.00 42.92 39.42 1ycf s ASP 18 CO 0.01 -0.38 1.47 -0.50 0.52 0.00 0.00 175.17 176.29 1ycf h TRP 19 N 7.09 0.65 0.00 -5.34 4.06 -1.90 -1.51 115.95 119.00 1ycf h TRP 19 Ca -0.03 -0.15 0.00 0.00 2.06 0.00 0.00 58.89 60.77 1ycf h TRP 19 Cb 0.96 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.96 1ycf h TRP 19 CO 0.68 0.79 -0.32 -0.91 -3.56 0.00 0.00 178.44 175.12 1ycf h ASN 20 N 0.31 0.00 -2.37 -3.49 2.35 -1.93 -3.35 115.58 107.10 1ycf h ASN 20 Ca 0.07 -0.05 -0.56 0.00 -0.55 0.00 0.00 56.30 55.21 1ycf h ASN 20 Cb 0.61 0.00 0.04 0.00 0.05 0.00 0.00 38.32 39.02 1ycf h ASN 20 CO 0.04 0.03 1.04 0.00 -1.65 0.00 0.00 177.43 176.88 1ycf n ILE 21 N -2.54 0.31 0.25 2.81 3.06 -1.25 -4.85 119.36 117.15 1ycf n ILE 21 Ca 0.04 -0.06 0.03 0.00 -2.50 0.00 0.00 62.75 60.26 1ycf n ILE 21 Cb 0.48 -1.95 -0.04 0.00 0.54 0.00 0.00 39.64 38.67 1ycf n ILE 21 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1ycf n ARG 22 N 5.28 4.38 -3.66 9.51 5.12 -1.26 -3.01 116.66 133.02 1ycf n ARG 22 Ca 0.18 -0.01 -0.21 0.00 -1.93 0.00 0.00 57.85 55.89 1ycf n ARG 22 Cb 0.34 -0.83 -0.18 0.00 -1.16 0.00 0.00 32.46 30.63 1ycf n ARG 22 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1ycf s TYR 23 N -1.68 0.05 0.27 -1.55 2.02 -1.26 -0.84 117.35 114.35 1ycf s TYR 23 Ca 0.02 0.21 0.05 0.00 -0.37 0.00 0.00 57.07 56.97 1ycf s TYR 23 Cb 0.05 -0.49 -0.03 0.00 -0.40 0.00 0.00 41.96 41.09 1ycf s TYR 23 CO 0.25 -0.25 0.40 0.12 -1.57 0.00 0.00 175.55 174.50 1ycf s PHE 24 N 2.18 3.40 -1.12 2.71 2.19 0.18 -4.29 117.98 123.23 1ycf s PHE 24 Ca 0.04 -0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.30 1ycf s PHE 24 Cb -0.13 -1.68 0.00 0.00 -1.31 0.00 0.00 43.02 39.91 1ycf s PHE 24 CO -0.04 0.33 0.00 0.72 1.83 0.00 0.00 175.22 178.06 1ycf n HIS 25 N -1.49 -1.37 0.00 10.12 8.25 -1.26 -1.50 115.22 127.97 1ycf n HIS 25 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1ycf n HIS 25 Cb 0.57 -2.85 0.00 0.00 1.12 0.00 0.00 29.99 28.83 1ycf n HIS 25 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ycf n GLY 26 N -0.81 1.47 0.01 -1.41 0.00 -1.26 -3.68 105.19 99.51 1ycf n GLY 26 Ca -0.15 -0.84 0.11 0.00 0.00 0.00 0.00 46.02 45.14 1ycf n GLY 26 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ycf n PRO 27 N 5.81 0.09 0.01 1.61 -0.04 -1.26 -4.62 135.00 136.60 1ycf n PRO 27 Ca 0.00 -0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 1ycf n PRO 27 Cb 0.00 -1.53 -0.01 0.00 -0.04 0.00 0.00 33.50 31.92 1ycf n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ycf h ALA 28 N 2.86 -0.62 -2.55 0.55 0.00 -1.63 -3.42 119.26 114.46 1ycf h ALA 28 Ca 0.00 -0.01 -0.71 0.00 0.00 0.00 0.00 54.91 54.18 1ycf h ALA 28 Cb 0.57 0.50 -0.21 0.00 0.00 0.00 0.00 17.79 18.65 1ycf h ALA 28 CO 0.00 -0.63 -0.44 0.12 0.00 0.00 0.00 179.25 178.30 1ycf s PHE 29 N -3.36 3.24 -0.22 0.00 5.36 -0.56 -4.89 117.98 117.54 1ycf s PHE 29 Ca -0.02 -0.55 -0.29 0.00 -0.96 0.00 0.00 56.93 55.10 1ycf s PHE 29 Cb 0.01 -2.57 -0.01 0.00 -0.34 0.00 0.00 43.02 40.11 1ycf s PHE 29 CO 0.08 -0.56 1.28 -1.54 -1.46 0.00 0.00 175.22 173.02 1ycf s SER 30 N 1.68 6.83 -0.74 6.13 1.04 -1.26 0.48 113.70 127.85 1ycf s SER 30 Ca 0.05 1.49 -0.03 0.00 0.48 0.00 0.00 55.95 57.95 1ycf s SER 30 Cb -0.19 -2.54 0.19 0.00 0.10 0.00 0.00 66.02 63.58 1ycf s SER 30 CO 0.10 -0.90 0.59 0.28 0.98 0.00 0.00 173.24 174.29 1ycf s THR 31 N 3.88 4.02 0.29 2.02 -1.32 -0.02 -4.93 115.64 119.58 1ycf s THR 31 Ca 0.55 -3.35 0.04 0.00 -1.21 0.00 0.00 61.69 57.73 1ycf s THR 31 Cb -0.20 -3.56 0.29 0.00 -1.51 0.00 0.00 72.50 67.53 1ycf s THR 31 CO 0.18 -0.97 1.79 0.45 -2.21 0.00 0.00 174.62 173.86 1ycf h HIS 32 N 6.60 1.06 -0.61 9.09 3.86 -1.85 -1.46 115.15 131.83 1ycf h HIS 32 Ca 0.06 0.03 -0.26 0.00 -1.16 0.00 0.00 60.37 59.04 1ycf h HIS 32 Cb 0.89 -0.32 -0.16 0.00 1.06 0.00 0.00 27.41 28.89 1ycf h HIS 32 CO 0.73 0.28 0.22 0.54 0.86 0.00 0.00 177.93 180.56 1ycf n ARG 33 N -4.75 2.52 0.00 2.45 1.74 -1.26 -4.95 116.66 112.42 1ycf n ARG 33 Ca 0.22 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.22 1ycf n ARG 33 Cb 0.51 -2.02 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1ycf n ARG 33 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ycf n GLY 34 N -0.84 0.11 0.00 -0.13 0.00 -0.55 -1.19 105.19 102.60 1ycf n GLY 34 Ca 0.41 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1ycf n GLY 34 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ycf n THR 35 N -0.86 0.00 -4.15 2.61 -2.24 -0.57 -2.71 114.28 106.36 1ycf n THR 35 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1ycf n THR 35 Cb 0.00 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.13 1ycf n THR 35 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ycf s THR 36 N -2.81 0.31 -0.41 4.28 -4.23 -1.25 0.95 115.64 112.48 1ycf s THR 36 Ca 0.00 -1.90 0.04 0.00 -1.18 0.00 0.00 61.69 58.65 1ycf s THR 36 Cb 0.00 -1.85 0.11 0.00 1.34 0.00 0.00 72.50 72.10 1ycf s THR 36 CO 0.00 -0.68 0.14 -0.31 -0.54 0.00 0.00 174.62 173.22 1ycf s TYR 37 N -3.89 3.35 0.19 3.99 2.02 0.19 -4.29 117.35 118.91 1ycf s TYR 37 Ca 0.17 -2.96 -0.30 0.00 -0.37 0.00 0.00 57.07 53.61 1ycf s TYR 37 Cb 0.07 -2.77 -0.08 0.00 -0.40 0.00 0.00 41.96 38.79 1ycf s TYR 37 CO -0.02 -0.86 0.95 -0.80 -1.57 0.00 0.00 175.55 173.25 1ycf s ASN 38 N 0.49 7.58 0.03 2.29 0.01 -0.36 -1.13 114.94 123.85 1ycf s ASN 38 Ca 0.13 1.90 -0.04 0.00 -0.71 0.00 0.00 52.86 54.14 1ycf s ASN 38 Cb -0.22 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 38.83 1ycf s ASN 38 CO -0.06 0.06 0.05 0.00 -1.51 0.00 0.00 177.10 175.64 1ycf s ALA 39 N -0.72 0.03 -0.01 0.60 0.00 -1.26 -4.73 121.76 115.67 1ycf s ALA 39 Ca 0.43 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.83 1ycf s ALA 39 Cb -0.25 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 1ycf s ALA 39 CO 0.31 -0.26 -0.08 0.71 0.00 0.00 0.00 175.76 176.44 1ycf s TYR 40 N -2.25 0.75 -0.22 0.00 2.02 -0.92 -0.74 117.35 115.99 1ycf s TYR 40 Ca -0.08 -0.14 -0.05 0.00 -0.37 0.00 0.00 57.07 56.43 1ycf s TYR 40 Cb -0.04 -0.49 -0.02 0.00 -0.40 0.00 0.00 41.96 41.02 1ycf s TYR 40 CO -0.03 -0.02 -0.02 -1.17 -1.57 0.00 0.00 175.55 172.74 1ycf s LEU 41 N -0.15 3.05 -0.26 -1.29 2.96 0.59 -0.18 118.68 123.39 1ycf s LEU 41 Ca 0.03 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1ycf s LEU 41 Cb -0.04 -1.78 0.01 0.00 0.50 0.00 0.00 46.19 44.88 1ycf s LEU 41 CO -0.00 0.00 0.02 -0.63 -1.32 0.00 0.00 176.35 174.42 1ycf s ILE 42 N 1.37 3.64 -0.32 6.68 1.01 0.79 -0.32 121.20 134.06 1ycf s ILE 42 Ca 0.04 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.94 1ycf s ILE 42 Cb -0.14 -2.81 0.01 0.00 0.01 0.00 0.00 42.46 39.52 1ycf s ILE 42 CO -0.01 0.20 0.13 -0.69 0.00 0.00 0.00 174.94 174.57 1ycf s VAL 43 N 1.47 4.28 0.00 2.92 1.01 0.17 0.28 120.40 130.53 1ycf s VAL 43 Ca 0.03 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1ycf s VAL 43 Cb -0.16 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1ycf s VAL 43 CO -0.00 0.01 0.00 -0.67 0.00 0.00 0.00 175.10 174.44 1ycf n ASP 44 N 4.93 0.06 0.27 3.32 -0.08 -1.26 -4.75 116.55 119.03 1ycf n ASP 44 Ca -0.14 -0.19 0.18 0.00 -1.51 0.00 0.00 54.79 53.13 1ycf n ASP 44 Cb 0.48 0.00 0.86 0.00 2.34 0.00 0.00 41.12 44.80 1ycf n ASP 44 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 1ycf h ASP 45 N 0.00 0.00 -3.32 1.67 1.82 -1.93 -3.30 116.42 111.36 1ycf h ASP 45 Ca 0.00 0.00 -0.37 0.00 -0.39 0.00 0.00 57.03 56.27 1ycf h ASP 45 Cb 0.00 0.00 -0.38 0.00 0.68 0.00 0.00 39.33 39.63 1ycf h ASP 45 CO 0.00 0.00 -0.74 -0.54 -1.61 0.00 0.00 179.24 176.35 1ycf s LYS 46 N -4.30 0.04 0.03 0.28 1.02 -0.48 -5.01 119.74 111.33 1ycf s LYS 46 Ca -0.04 0.31 -0.08 0.00 0.02 0.00 0.00 55.97 56.19 1ycf s LYS 46 Cb 0.12 -0.56 -0.05 0.00 -0.52 0.00 0.00 37.83 36.81 1ycf s LYS 46 CO 0.39 -0.31 0.31 0.95 -0.92 0.00 0.00 175.35 175.77 1ycf s THR 47 N 2.02 5.24 0.09 2.17 -4.23 -1.24 -4.75 115.64 114.93 1ycf s THR 47 Ca 0.03 0.25 0.06 0.00 -1.18 0.00 0.00 61.69 60.86 1ycf s THR 47 Cb -0.12 -3.59 -0.03 0.00 1.34 0.00 0.00 72.50 70.10 1ycf s THR 47 CO -0.03 0.35 -0.17 0.00 -0.54 0.00 0.00 174.62 174.22 1ycf s ALA 48 N -1.32 1.45 -0.20 3.99 0.00 0.14 -0.53 121.76 125.28 1ycf s ALA 48 Ca 0.29 -1.11 -0.03 0.00 0.00 0.00 0.00 51.96 51.11 1ycf s ALA 48 Cb -0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 1ycf s ALA 48 CO 0.17 0.25 -0.06 -1.17 0.00 0.00 0.00 175.76 174.94 1ycf s LEU 49 N -1.83 2.83 -0.49 0.00 1.98 0.35 -0.14 118.68 121.38 1ycf s LEU 49 Ca 0.02 -0.39 -0.19 0.00 -2.89 0.00 0.00 54.13 50.67 1ycf s LEU 49 Cb -0.10 -1.71 0.05 0.00 0.66 0.00 0.00 46.19 45.09 1ycf s LEU 49 CO 0.03 0.01 0.63 -0.69 -1.89 0.00 0.00 176.35 174.44 1ycf s VAL 50 N 1.28 4.86 0.39 1.68 1.01 0.74 -0.22 120.40 130.14 1ycf s VAL 50 Ca 0.03 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1ycf s VAL 50 Cb -0.14 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1ycf s VAL 50 CO -0.03 -0.75 0.00 0.47 0.00 0.00 0.00 175.10 174.79 1ycf n ASP 51 N 6.19 -5.19 0.00 3.32 8.00 0.20 -2.16 116.55 126.92 1ycf n ASP 51 Ca -0.05 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.51 1ycf n ASP 51 Cb 0.46 -3.02 0.00 0.00 -0.02 0.00 0.00 41.12 38.54 1ycf n ASP 51 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1ycf n THR 52 N -2.85 0.00 -3.98 -3.53 -2.24 -0.96 -4.43 114.28 96.29 1ycf n THR 52 Ca -0.03 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.66 1ycf n THR 52 Cb 0.37 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.53 1ycf n THR 52 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ycf s VAL 53 N 4.70 0.08 0.10 2.28 1.01 -0.76 -4.51 120.40 123.29 1ycf s VAL 53 Ca 0.00 -1.46 -0.33 0.00 0.00 0.00 0.00 61.98 60.19 1ycf s VAL 53 Cb 0.00 -1.82 -0.12 0.00 0.00 0.00 0.00 36.38 34.44 1ycf s VAL 53 CO 0.00 -0.37 1.74 0.00 0.00 0.00 0.00 175.10 176.47 1ycf n TYR 54 N -0.17 2.44 -0.27 5.22 9.36 -1.12 -0.07 117.16 132.55 1ycf n TYR 54 Ca -0.08 0.05 -0.05 0.00 3.32 0.00 0.00 57.90 61.14 1ycf n TYR 54 Cb 0.63 -2.64 -0.04 0.00 -0.63 0.00 0.00 39.34 36.66 1ycf n TYR 54 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1ycf n GLU 55 N 4.91 -0.25 0.06 2.98 0.00 -1.26 0.73 120.64 127.81 1ycf n GLU 55 Ca 0.18 0.99 0.02 0.00 0.00 0.00 0.00 57.16 58.35 1ycf n GLU 55 Cb 0.32 -1.46 0.09 0.00 0.00 0.00 0.00 31.44 30.40 1ycf n GLU 55 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 1ycf n PRO 56 N -4.86 0.03 -0.05 5.31 -0.02 -1.26 -0.46 135.00 133.68 1ycf n PRO 56 Ca 0.03 0.33 0.03 0.00 -2.02 0.00 0.00 63.50 61.87 1ycf n PRO 56 Cb 0.20 -1.93 0.05 0.00 -0.02 0.00 0.00 33.50 31.80 1ycf n PRO 56 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ycf n PHE 57 N -1.49 0.10 -0.21 6.00 3.72 0.22 -4.76 117.46 121.04 1ycf n PHE 57 Ca -0.00 -0.60 0.14 0.00 -0.05 0.00 0.00 57.45 56.94 1ycf n PHE 57 Cb 0.36 -0.07 0.46 0.00 -0.94 0.00 0.00 39.48 39.28 1ycf n PHE 57 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1ycf h LYS 58 N 0.33 0.50 0.09 -1.08 2.10 -0.80 -1.90 116.57 115.82 1ycf h LYS 58 Ca 0.00 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1ycf h LYS 58 Cb 0.65 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 31.86 1ycf h LYS 58 CO 0.01 0.33 -0.06 0.93 -2.00 0.00 0.00 179.45 178.66 1ycf h GLU 59 N 0.51 -0.14 -0.02 0.07 3.07 -1.86 -0.90 114.58 115.32 1ycf h GLU 59 Ca 0.40 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 59.28 1ycf h GLU 59 Cb 0.82 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1ycf h GLU 59 CO -0.15 -0.09 0.02 1.49 -1.40 0.00 0.00 179.01 178.87 1ycf h GLU 60 N -0.14 0.00 0.08 2.33 4.81 -1.72 0.39 114.58 120.33 1ycf h GLU 60 Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1ycf h GLU 60 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1ycf h GLU 60 CO 0.01 0.00 -0.04 1.25 -0.73 0.00 0.00 179.01 179.50 1ycf h LEU 61 N 0.00 -0.09 -1.00 1.64 5.85 -0.99 -1.89 115.31 118.84 1ycf h LEU 61 Ca 0.01 0.00 0.27 0.00 0.84 0.00 0.00 57.88 59.01 1ycf h LEU 61 Cb 0.05 0.02 -0.13 0.00 0.37 0.00 0.00 40.66 40.97 1ycf h LEU 61 CO -0.00 -0.03 0.57 0.40 -0.34 0.00 0.00 178.44 179.03 1ycf h ILE 62 N -0.16 0.44 0.82 4.05 2.04 -1.09 0.11 117.51 123.72 1ycf h ILE 62 Ca -0.01 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 1ycf h ILE 62 Cb 0.08 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.09 1ycf h ILE 62 CO 0.02 0.09 -0.43 0.00 0.00 0.00 0.00 178.15 177.82 1ycf h ALA 63 N 1.78 -1.29 -0.65 1.87 0.00 -0.97 0.09 119.26 120.10 1ycf h ALA 63 Ca 0.67 -0.25 0.19 0.00 0.00 0.00 0.00 54.91 55.53 1ycf h ALA 63 Cb 1.39 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 19.65 1ycf h ALA 63 CO -0.53 -1.22 0.50 0.87 0.00 0.00 0.00 179.25 178.87 1ycf h LYS 64 N -1.14 0.00 0.43 0.00 1.57 -0.16 -0.73 116.57 116.54 1ycf h LYS 64 Ca -0.11 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1ycf h LYS 64 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1ycf h LYS 64 CO 0.16 0.00 -0.21 -0.07 -0.57 0.00 0.00 179.45 178.76 1ycf h LEU 65 N 0.00 -0.49 -1.97 2.94 3.38 -0.22 -3.14 115.31 115.81 1ycf h LEU 65 Ca 0.31 0.02 0.33 0.00 0.09 0.00 0.00 57.88 58.62 1ycf h LEU 65 Cb 1.30 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 42.13 1ycf h LEU 65 CO -0.00 -0.24 0.83 0.11 0.09 0.00 0.00 178.44 179.22 1ycf h LYS 66 N -0.80 0.00 0.00 1.13 1.57 0.07 1.24 116.57 119.78 1ycf h LYS 66 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1ycf h LYS 66 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1ycf h LYS 66 CO 0.10 0.00 0.00 0.94 -0.57 0.00 0.00 179.45 179.92 1ycf n GLN 67 N -4.14 0.12 -0.11 3.15 -0.06 -0.39 -3.08 117.38 112.88 1ycf n GLN 67 Ca 0.24 0.20 -0.17 0.00 -2.00 0.00 0.00 57.00 55.27 1ycf n GLN 67 Cb 1.20 -1.50 -0.10 0.00 -4.06 0.00 0.00 30.24 25.78 1ycf n GLN 67 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1ycf n ILE 68 N -1.36 1.27 -3.44 1.69 2.08 0.43 -4.95 119.36 115.09 1ycf n ILE 68 Ca 0.05 -0.46 -0.15 0.00 0.56 0.00 0.00 62.75 62.75 1ycf n ILE 68 Cb 0.12 -1.38 -0.11 0.00 -0.75 0.00 0.00 39.64 37.53 1ycf n ILE 68 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1ycf s LYS 69 N -2.44 0.26 0.00 0.38 2.47 -1.17 -5.09 119.74 114.14 1ycf s LYS 69 Ca -0.30 0.25 0.00 0.00 -1.56 0.00 0.00 55.97 54.35 1ycf s LYS 69 Cb 0.09 -0.92 0.00 0.00 -1.46 0.00 0.00 37.83 35.54 1ycf s LYS 69 CO 0.49 -0.71 0.10 -3.47 0.16 0.00 0.00 175.35 171.93 1ycf n ASP 70 N 5.33 0.00 -4.79 1.43 4.64 -1.23 -3.53 116.55 118.40 1ycf n ASP 70 Ca -0.04 0.10 -0.38 0.00 -1.38 0.00 0.00 54.79 53.08 1ycf n ASP 70 Cb 0.49 -0.01 -0.06 0.00 -1.04 0.00 0.00 41.12 40.50 1ycf n ASP 70 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1ycf s PRO 71 N -1.28 4.47 -0.17 -0.67 0.02 -1.26 -4.74 135.00 131.37 1ycf s PRO 71 Ca 0.00 1.07 -0.29 0.00 0.02 0.00 0.00 61.00 61.80 1ycf s PRO 71 Cb 0.00 -3.12 -0.02 0.00 0.02 0.00 0.00 34.50 31.38 1ycf s PRO 71 CO 0.00 0.50 1.36 0.08 -0.33 0.00 0.00 177.00 178.61 1ycf s VAL 72 N -1.29 4.11 0.00 3.83 1.01 -1.23 -4.98 120.40 121.85 1ycf s VAL 72 Ca 0.38 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1ycf s VAL 72 Cb -0.21 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1ycf s VAL 72 CO 0.24 -0.17 0.00 2.29 0.00 0.00 0.00 175.10 177.46 1ycf n LYS 73 N 6.85 0.00 -2.21 2.72 2.85 -1.26 -4.90 118.16 122.21 1ycf n LYS 73 Ca 0.15 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.40 1ycf n LYS 73 Cb 0.45 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.82 1ycf n LYS 73 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1ycf n LEU 74 N 0.00 -5.43 -0.04 -5.58 4.32 -1.26 -4.94 117.00 104.07 1ycf n LEU 74 Ca 0.00 0.94 -0.21 0.00 -0.02 0.00 0.00 56.01 56.72 1ycf n LEU 74 Cb 0.00 -2.40 -0.13 0.00 -1.62 0.00 0.00 43.42 39.27 1ycf n LEU 74 CO 0.00 -2.01 -0.54 0.44 -1.22 0.00 0.00 177.39 174.06 1ycf h ASP 75 N 1.92 0.22 -4.58 -1.43 3.32 -1.17 -3.41 116.42 111.30 1ycf h ASP 75 Ca -0.05 -0.74 -0.70 0.00 0.02 0.00 0.00 57.03 55.56 1ycf h ASP 75 Cb 0.12 -0.07 -0.30 0.00 0.22 0.00 0.00 39.33 39.30 1ycf h ASP 75 CO 0.05 1.61 -0.89 -0.31 -1.72 0.00 0.00 179.24 177.98 1ycf s TYR 76 N -2.44 2.31 -0.36 4.55 2.02 -1.08 0.66 117.35 123.01 1ycf s TYR 76 Ca -0.24 -0.43 0.03 0.00 -0.37 0.00 0.00 57.07 56.05 1ycf s TYR 76 Cb 0.05 -1.48 0.11 0.00 -0.40 0.00 0.00 41.96 40.24 1ycf s TYR 76 CO 0.69 -0.03 0.09 -1.17 -1.57 0.00 0.00 175.55 173.57 1ycf s LEU 77 N -0.66 4.00 -0.13 -1.29 1.98 0.11 -0.49 118.68 122.19 1ycf s LEU 77 Ca 0.10 -2.16 -0.29 0.00 -2.89 0.00 0.00 54.13 48.89 1ycf s LEU 77 Cb -0.10 -1.42 -0.01 0.00 0.66 0.00 0.00 46.19 45.33 1ycf s LEU 77 CO -0.01 -0.37 1.00 -0.69 -1.89 0.00 0.00 176.35 174.39 1ycf s VAL 78 N 0.91 4.78 -0.75 1.68 1.01 0.69 -1.54 120.40 127.17 1ycf s VAL 78 Ca 0.12 2.00 0.02 0.00 0.00 0.00 0.00 61.98 64.12 1ycf s VAL 78 Cb -0.20 -4.30 0.18 0.00 0.00 0.00 0.00 36.38 32.07 1ycf s VAL 78 CO -0.11 -0.02 0.57 -0.69 0.00 0.00 0.00 175.10 174.85 1ycf s VAL 79 N 2.22 3.44 0.46 2.92 1.01 -0.57 0.61 120.40 130.49 1ycf s VAL 79 Ca 0.47 -3.97 0.11 0.00 0.00 0.00 0.00 61.98 58.59 1ycf s VAL 79 Cb -0.18 -3.21 0.27 0.00 0.00 0.00 0.00 36.38 33.26 1ycf s VAL 79 CO 0.15 -1.01 2.09 0.78 0.00 0.00 0.00 175.10 177.12 1ycf h ASN 80 N 5.82 0.27 -4.75 3.32 2.35 -1.86 -3.42 115.58 117.31 1ycf h ASN 80 Ca 0.12 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 1ycf h ASN 80 Cb 0.80 -0.07 -0.21 0.00 0.05 0.00 0.00 38.32 38.89 1ycf h ASN 80 CO 0.76 0.19 -0.27 -2.28 -1.65 0.00 0.00 177.43 174.18 1ycf s HIS 81 N -5.31 -0.23 -0.67 1.19 2.46 -1.26 -2.41 115.29 109.05 1ycf s HIS 81 Ca -0.07 0.42 0.09 0.00 0.47 0.00 0.00 55.06 55.98 1ycf s HIS 81 Cb 0.17 0.11 0.26 0.00 -0.13 0.00 0.00 32.58 33.00 1ycf s HIS 81 CO 0.71 -0.35 1.22 0.25 -2.47 0.00 0.00 174.74 174.09 1ycf n THR 82 N 1.61 1.12 -0.32 0.89 -2.24 -1.26 -4.51 114.28 109.57 1ycf n THR 82 Ca -0.20 -1.09 0.00 0.00 -2.27 0.00 0.00 64.05 60.49 1ycf n THR 82 Cb 0.56 0.43 0.05 0.00 -2.10 0.00 0.00 70.33 69.27 1ycf n THR 82 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ycf n GLU 83 N 0.20 -0.18 0.00 -0.78 1.02 -1.26 -4.51 120.64 115.13 1ycf n GLU 83 Ca 0.10 1.30 0.00 0.00 -0.02 0.00 0.00 57.16 58.54 1ycf n GLU 83 Cb 0.43 -1.93 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1ycf n GLU 83 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ycf n SER 84 N -5.26 0.00 0.00 1.62 2.88 -1.26 -4.85 113.62 106.75 1ycf n SER 84 Ca 0.09 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.76 1ycf n SER 84 Cb 0.35 0.00 0.70 0.00 -0.75 0.00 0.00 64.21 64.51 1ycf n SER 84 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1ycf n ASP 85 N 0.00 0.00 0.00 -3.46 5.75 -1.26 -2.10 116.55 115.48 1ycf n ASP 85 Ca 0.00 -0.59 0.00 0.00 -0.01 0.00 0.00 54.79 54.19 1ycf n ASP 85 Cb 0.00 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 1ycf n ASP 85 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1ycf n HIS 86 N -1.07 0.00 -1.01 2.11 8.25 -1.26 -2.78 115.22 119.46 1ycf n HIS 86 Ca 0.17 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.67 1ycf n HIS 86 Cb 0.11 0.00 0.32 0.00 1.12 0.00 0.00 29.99 31.54 1ycf n HIS 86 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ycf n ALA 87 N -2.04 3.71 0.00 -1.41 0.00 -1.24 -1.83 120.51 117.70 1ycf n ALA 87 Ca 0.00 -2.24 -0.10 0.00 0.00 0.00 0.00 53.44 51.10 1ycf n ALA 87 Cb 0.30 -0.97 0.04 0.00 0.00 0.00 0.00 19.45 18.82 1ycf n ALA 87 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ycf h GLY 88 N 2.69 0.62 -1.83 0.00 0.00 -1.21 -2.84 103.07 100.49 1ycf h GLY 88 Ca 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1ycf h GLY 88 CO 0.43 0.67 0.00 0.00 0.00 0.00 0.00 176.54 177.65 1ycf n ALA 89 N -2.53 2.95 0.20 3.60 0.00 0.90 -4.29 120.51 121.35 1ycf n ALA 89 Ca -0.04 -0.67 -0.14 0.00 0.00 0.00 0.00 53.44 52.59 1ycf n ALA 89 Cb 0.63 -1.04 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 1ycf n ALA 89 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1ycf h PHE 90 N 1.47 -0.47 -0.61 0.00 3.57 -1.78 -2.34 116.94 116.79 1ycf h PHE 90 Ca 0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1ycf h PHE 90 Cb 0.97 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 1ycf h PHE 90 CO 0.38 -0.18 0.28 -1.00 -2.23 0.00 0.00 178.31 175.56 1ycf h PRO 91 N -0.73 0.89 -0.74 6.41 0.13 -1.83 -0.78 132.00 135.34 1ycf h PRO 91 Ca -0.05 -0.14 0.15 0.00 -0.87 0.00 0.00 66.00 65.09 1ycf h PRO 91 Cb 0.51 -0.16 -0.10 0.00 0.13 0.00 0.00 31.00 31.38 1ycf h PRO 91 CO 0.09 0.72 0.26 0.00 -0.23 0.00 0.00 178.00 178.84 1ycf h ALA 92 N 1.12 1.02 -0.08 -0.56 0.00 -1.84 -0.71 119.26 118.22 1ycf h ALA 92 Ca 0.21 0.13 -0.14 0.00 0.00 0.00 0.00 54.91 55.11 1ycf h ALA 92 Cb 0.14 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ycf h ALA 92 CO -0.02 -0.26 -0.57 0.82 0.00 0.00 0.00 179.25 179.22 1ycf h ILE 93 N 0.38 1.37 0.00 0.00 1.08 -0.99 -2.70 117.51 116.66 1ycf h ILE 93 Ca 0.41 -1.90 0.00 0.00 -0.39 0.00 0.00 64.86 62.98 1ycf h ILE 93 Cb 0.65 1.95 0.00 0.00 -3.07 0.00 0.00 36.82 36.35 1ycf h ILE 93 CO -0.43 0.56 0.00 0.24 -0.69 0.00 0.00 178.15 177.83 1ycf h MET 94 N 0.18 0.00 0.00 2.37 2.86 0.24 -1.34 114.93 119.24 1ycf h MET 94 Ca -0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1ycf h MET 94 Cb 1.06 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 1ycf h MET 94 CO 0.09 0.00 -1.06 1.49 1.06 0.00 0.00 176.91 178.49 1ycf h GLU 95 N 0.00 0.00 0.03 1.72 4.57 -1.14 -2.16 114.58 117.60 1ycf h GLU 95 Ca 0.00 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 57.95 1ycf h GLU 95 Cb 0.74 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.31 1ycf h GLU 95 CO 0.00 0.19 -1.08 1.25 -1.18 0.00 0.00 179.01 178.19 1ycf h LEU 96 N 0.00 0.10 -6.09 1.64 7.12 -1.14 -3.38 115.31 113.56 1ycf h LEU 96 Ca -0.07 -0.11 -0.54 0.00 0.13 0.00 0.00 57.88 57.28 1ycf h LEU 96 Cb 1.31 -0.03 -0.37 0.00 -0.53 0.00 0.00 40.66 41.05 1ycf h LEU 96 CO 0.03 1.09 -1.00 0.00 -0.13 0.00 0.00 178.44 178.43 1ycf h PRO 98 N 4.81 0.48 -1.48 0.00 0.11 -1.58 -2.55 132.00 131.80 1ycf h PRO 98 Ca 0.16 -0.03 -0.71 0.00 0.11 0.00 0.00 66.00 65.53 1ycf h PRO 98 Cb 0.91 -0.11 -0.30 0.00 0.11 0.00 0.00 31.00 31.61 1ycf h PRO 98 CO 0.39 0.32 0.77 -3.47 -0.21 0.00 0.00 178.00 175.80 1ycf n ASP 99 N -4.79 7.29 -4.82 -2.05 4.64 -1.26 -4.77 116.55 110.79 1ycf n ASP 99 Ca 0.27 -3.81 -0.38 0.00 -1.38 0.00 0.00 54.79 49.49 1ycf n ASP 99 Cb 0.82 -0.95 -0.06 0.00 -1.04 0.00 0.00 41.12 39.89 1ycf n ASP 99 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1ycf s ALA 100 N -3.91 3.64 -0.26 -1.67 0.00 -0.96 -4.92 121.76 113.67 1ycf s ALA 100 Ca 0.57 -0.12 -0.23 0.00 0.00 0.00 0.00 51.96 52.18 1ycf s ALA 100 Cb 0.47 -2.50 -0.01 0.00 0.00 0.00 0.00 23.12 21.07 1ycf s ALA 100 CO -0.21 0.41 0.75 -1.58 0.00 0.00 0.00 175.76 175.13 1ycf s HIS 101 N -0.93 3.28 -0.19 0.00 2.46 0.21 -4.34 115.29 115.78 1ycf s HIS 101 Ca 0.26 0.96 -0.25 0.00 0.47 0.00 0.00 55.06 56.50 1ycf s HIS 101 Cb -0.18 -3.01 -0.01 0.00 -0.13 0.00 0.00 32.58 29.25 1ycf s HIS 101 CO 0.15 -0.41 0.82 0.08 -2.47 0.00 0.00 174.74 172.91 1ycf s VAL 102 N 2.75 4.87 -0.27 0.89 1.01 -0.28 0.04 120.40 129.42 1ycf s VAL 102 Ca 0.31 1.60 -0.08 0.00 0.00 0.00 0.00 61.98 63.81 1ycf s VAL 102 Cb -0.15 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1ycf s VAL 102 CO 0.09 0.00 0.09 -0.76 0.00 0.00 0.00 175.10 174.52 1ycf s LEU 103 N 2.33 3.68 0.36 3.92 1.43 -0.59 -1.72 118.68 128.09 1ycf s LEU 103 Ca 0.37 -0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 52.95 1ycf s LEU 103 Cb -0.16 -1.94 0.05 0.00 0.03 0.00 0.00 46.19 44.17 1ycf s LEU 103 CO 0.11 -0.10 0.78 0.00 0.23 0.00 0.00 176.35 177.37 1ycf s THR 105 N -2.60 3.65 0.11 0.00 -4.23 -1.26 0.44 115.64 111.74 1ycf s THR 105 Ca 0.15 0.22 -0.21 0.00 -1.18 0.00 0.00 61.69 60.66 1ycf s THR 105 Cb -0.05 -3.49 -0.10 0.00 1.34 0.00 0.00 72.50 70.21 1ycf s THR 105 CO 0.11 -0.56 1.74 1.56 -0.54 0.00 0.00 174.62 176.93 1ycf h GLN 106 N -0.36 0.07 -0.80 3.99 1.08 -1.94 0.28 115.11 117.43 1ycf h GLN 106 Ca -0.45 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 56.73 1ycf h GLN 106 Cb 1.25 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.63 1ycf h GLN 106 CO 0.62 0.05 0.46 0.00 -0.95 0.00 0.00 178.83 179.01 1ycf h ARG 107 N 0.07 1.10 -0.44 1.46 3.08 -1.91 -1.33 114.38 116.41 1ycf h ARG 107 Ca 0.05 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1ycf h ARG 107 Cb 0.03 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1ycf h ARG 107 CO -0.06 0.79 0.25 0.00 -1.07 0.00 0.00 179.97 179.89 1ycf h ALA 108 N 1.25 0.56 -0.47 0.04 0.00 -1.71 -1.57 119.26 117.36 1ycf h ALA 108 Ca 0.29 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1ycf h ALA 108 Cb -0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.54 1ycf h ALA 108 CO -0.05 0.07 0.10 0.35 0.00 0.00 0.00 179.25 179.71 1ycf h PHE 109 N 0.58 0.16 -0.66 0.00 3.57 -0.45 0.48 116.94 120.61 1ycf h PHE 109 Ca 0.16 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.71 1ycf h PHE 109 Cb 0.03 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 1ycf h PHE 109 CO -0.03 0.01 0.41 -0.44 -2.23 0.00 0.00 178.31 176.03 1ycf h ASP 110 N 0.23 0.66 -0.51 0.41 3.32 -0.70 -1.94 116.42 117.89 1ycf h ASP 110 Ca 0.23 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1ycf h ASP 110 Cb 0.30 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1ycf h ASP 110 CO -0.30 0.46 0.24 -1.28 -1.72 0.00 0.00 179.24 176.64 1ycf h SER 111 N 0.80 0.67 -0.39 6.45 0.87 -0.49 -2.24 113.55 119.21 1ycf h SER 111 Ca 0.27 -0.13 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 1ycf h SER 111 Cb 0.03 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.78 1ycf h SER 111 CO -0.11 0.61 0.17 -0.07 -0.53 0.00 0.00 176.83 176.91 1ycf h LEU 112 N 0.68 0.23 -2.25 2.23 4.07 -0.58 0.23 115.31 119.93 1ycf h LEU 112 Ca 0.18 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 1ycf h LEU 112 Cb 0.12 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 41.85 1ycf h LEU 112 CO -0.02 0.17 -0.05 0.11 -1.08 0.00 0.00 178.44 177.57 1ycf h LYS 113 N 0.36 0.00 0.08 1.13 1.57 -1.05 -0.81 116.57 117.85 1ycf h LYS 113 Ca 0.17 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.65 1ycf h LYS 113 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1ycf h LYS 113 CO -0.15 0.05 -1.62 0.00 -0.57 0.00 0.00 179.45 177.16 1ycf h ALA 114 N 1.95 0.32 0.00 3.86 0.00 -0.60 -3.09 119.26 121.70 1ycf h ALA 114 Ca -0.00 -1.26 -0.02 0.00 0.00 0.00 0.00 54.91 53.62 1ycf h ALA 114 Cb 0.21 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1ycf h ALA 114 CO 0.01 1.00 -0.11 0.45 0.00 0.00 0.00 179.25 180.59 1ycf h HIS 115 N -0.37 0.00 0.00 0.00 3.86 -0.49 -3.42 115.15 114.72 1ycf h HIS 115 Ca -0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.84 1ycf h HIS 115 Cb 1.73 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.20 1ycf h HIS 115 CO 0.10 0.11 -0.16 0.66 0.86 0.00 0.00 177.93 179.50 1ycf n TYR 116 N -3.17 -0.92 -1.14 2.45 4.01 -0.32 -5.08 117.16 112.98 1ycf n TYR 116 Ca 0.02 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 1ycf n TYR 116 Cb 0.47 0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.79 1ycf n TYR 116 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1ycf n SER 117 N -3.25 -0.79 0.00 7.72 3.41 -1.17 -4.54 113.62 115.00 1ycf n SER 117 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ycf n SER 117 Cb 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 1ycf n SER 117 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ycf n HIS 118 N -0.07 0.00 -3.73 7.33 8.25 -1.26 -4.82 115.22 120.92 1ycf n HIS 118 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 1ycf n HIS 118 Cb 0.00 -1.20 -0.17 0.00 1.12 0.00 0.00 29.99 29.74 1ycf n HIS 118 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1ycf s ILE 119 N -0.49 0.42 -0.01 1.59 1.01 -1.26 -5.13 121.20 117.34 1ycf s ILE 119 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 60.65 60.08 1ycf s ILE 119 Cb 0.00 -0.88 -0.05 0.00 0.01 0.00 0.00 42.46 41.53 1ycf s ILE 119 CO 0.00 -0.13 0.54 -1.81 0.00 0.00 0.00 174.94 173.55 1ycf s ASP 120 N 1.91 6.92 -0.18 3.58 1.01 -1.26 -5.05 116.67 123.59 1ycf s ASP 120 Ca 0.01 1.09 -0.19 0.00 0.71 0.00 0.00 52.55 54.16 1ycf s ASP 120 Cb -0.16 -2.33 0.05 0.00 1.01 0.00 0.00 42.92 41.49 1ycf s ASP 120 CO -0.08 0.14 0.54 0.72 0.21 0.00 0.00 175.17 176.71 1ycf s PHE 121 N -0.33 -0.57 0.01 4.23 -0.71 -1.26 -5.00 117.98 114.34 1ycf s PHE 121 Ca 0.29 1.35 -0.30 0.00 -1.04 0.00 0.00 56.93 57.23 1ycf s PHE 121 Cb -0.18 0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 41.81 1ycf s PHE 121 CO 0.16 -0.31 1.07 -0.80 -1.34 0.00 0.00 175.22 174.00 1ycf s ASN 122 N 0.08 7.23 0.05 1.98 0.02 -1.26 -4.96 114.94 118.09 1ycf s ASN 122 Ca -0.02 1.78 0.00 0.00 -1.02 0.00 0.00 52.86 53.61 1ycf s ASN 122 Cb -0.04 -2.57 -0.00 0.00 0.02 0.00 0.00 41.25 38.66 1ycf s ASN 122 CO 0.02 -0.37 0.00 0.00 0.02 0.00 0.00 177.10 176.77 1ycf n TYR 123 N 4.11 0.10 -3.11 2.20 0.18 -1.26 -1.12 117.16 118.26 1ycf n TYR 123 Ca 0.08 -0.28 0.04 0.00 1.88 0.00 0.00 57.90 59.62 1ycf n TYR 123 Cb 0.49 -0.03 -0.00 0.00 -0.38 0.00 0.00 39.34 39.42 1ycf n TYR 123 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 1ycf s THR 124 N -1.33 -0.52 0.20 -3.48 -1.32 -0.70 -4.82 115.64 103.67 1ycf s THR 124 Ca 0.01 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.16 1ycf s THR 124 Cb 0.00 -0.42 -0.12 0.00 -1.51 0.00 0.00 72.50 70.44 1ycf s THR 124 CO 0.00 0.00 1.68 -0.38 -2.21 0.00 0.00 174.62 173.71 1ycf n ILE 125 N 4.98 0.06 -4.17 5.08 -0.00 -1.26 -3.26 119.36 120.80 1ycf n ILE 125 Ca 0.08 -0.02 -0.30 0.00 -0.00 0.00 0.00 62.75 62.52 1ycf n ILE 125 Cb 0.57 -1.87 -0.09 0.00 -0.00 0.00 0.00 39.64 38.26 1ycf n ILE 125 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1ycf s VAL 126 N 1.03 3.74 0.16 1.39 1.01 0.17 -4.93 120.40 122.98 1ycf s VAL 126 Ca 0.75 -1.14 0.07 0.00 0.00 0.00 0.00 61.98 61.66 1ycf s VAL 126 Cb -0.55 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1ycf s VAL 126 CO 0.35 0.09 -0.15 -0.54 0.00 0.00 0.00 175.10 174.85 1ycf s LYS 127 N -2.34 1.19 0.13 2.72 3.01 -1.26 -4.48 119.74 118.71 1ycf s LYS 127 Ca 0.24 -1.41 -0.32 0.00 -1.01 0.00 0.00 55.97 53.47 1ycf s LYS 127 Cb -0.11 -1.06 -0.11 0.00 -1.01 0.00 0.00 37.83 35.53 1ycf s LYS 127 CO 0.17 0.19 1.79 -2.37 0.51 0.00 0.00 175.35 175.64 1ycf n THR 128 N 0.12 0.27 0.00 2.17 5.66 -1.26 -1.64 114.28 119.60 1ycf n THR 128 Ca -0.12 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 1ycf n THR 128 Cb 0.58 -2.02 0.00 0.00 -1.55 0.00 0.00 70.33 67.34 1ycf n THR 128 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ycf n GLY 129 N 4.11 1.44 3.76 1.09 0.00 0.22 -4.93 105.19 110.88 1ycf n GLY 129 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1ycf n GLY 129 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ycf s THR 130 N -1.75 2.82 -0.04 2.61 -4.23 -0.65 -4.79 115.64 109.61 1ycf s THR 130 Ca 0.00 0.60 -0.02 0.00 -1.18 0.00 0.00 61.69 61.09 1ycf s THR 130 Cb 0.00 -3.29 0.03 0.00 1.34 0.00 0.00 72.50 70.58 1ycf s THR 130 CO 0.00 -0.03 0.07 -0.55 -0.54 0.00 0.00 174.62 173.57 1ycf s SER 131 N -1.32 0.93 -0.11 3.99 0.15 -1.26 -2.14 113.70 113.95 1ycf s SER 131 Ca 0.67 0.10 -0.09 0.00 0.70 0.00 0.00 55.95 57.34 1ycf s SER 131 Cb -0.31 -0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 63.87 1ycf s SER 131 CO 0.37 -0.23 0.19 -0.69 1.20 0.00 0.00 173.24 174.08 1ycf s VAL 132 N 2.01 5.42 -0.14 4.45 1.01 -0.49 -4.94 120.40 127.72 1ycf s VAL 132 Ca 0.03 0.32 -0.12 0.00 0.00 0.00 0.00 61.98 62.21 1ycf s VAL 132 Cb -0.12 -3.47 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1ycf s VAL 132 CO -0.03 0.59 0.25 -0.55 0.00 0.00 0.00 175.10 175.36 1ycf s SER 133 N -0.87 6.44 -0.14 3.32 0.15 -1.26 -0.75 113.70 120.59 1ycf s SER 133 Ca 0.16 0.52 0.17 0.00 0.70 0.00 0.00 55.95 57.50 1ycf s SER 133 Cb -0.13 -2.16 -0.24 0.00 -1.71 0.00 0.00 66.02 61.79 1ycf s SER 133 CO 0.05 0.20 0.15 0.18 1.20 0.00 0.00 173.24 175.02 1ycf n LEU 134 N 3.00 0.00 0.00 3.45 4.77 -0.23 -4.99 117.00 123.00 1ycf n LEU 134 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1ycf n LEU 134 Cb 0.53 0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.95 1ycf n LEU 134 CO 0.37 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 1ycf n GLY 135 N 1.79 -0.18 0.31 -0.72 0.00 -1.26 -1.38 105.19 103.75 1ycf n GLY 135 Ca -0.23 -0.02 0.21 0.00 0.00 0.00 0.00 46.02 45.98 1ycf n GLY 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ycf h LYS 136 N 0.00 0.00 -4.85 1.61 1.57 -1.97 -3.43 116.57 109.50 1ycf h LYS 136 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1ycf h LYS 136 Cb 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.16 1ycf h LYS 136 CO 0.00 0.00 -0.66 1.03 -0.57 0.00 0.00 179.45 179.25 1ycf s ARG 137 N -3.97 1.15 0.09 3.15 0.52 -1.26 -4.99 118.95 113.64 1ycf s ARG 137 Ca -0.03 -1.56 0.02 0.00 -0.52 0.00 0.00 55.73 53.64 1ycf s ARG 137 Cb 0.11 -0.33 -0.04 0.00 0.52 0.00 0.00 34.95 35.22 1ycf s ARG 137 CO 0.43 -0.12 -0.07 -1.54 0.02 0.00 0.00 175.30 174.02 1ycf s SER 138 N -3.20 1.06 -0.26 0.23 1.04 -1.26 -1.07 113.70 110.24 1ycf s SER 138 Ca 0.25 -0.93 -0.01 0.00 0.48 0.00 0.00 55.95 55.74 1ycf s SER 138 Cb 0.06 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.30 1ycf s SER 138 CO 0.05 -0.43 -0.06 -0.76 0.98 0.00 0.00 173.24 173.02 1ycf s LEU 139 N -2.80 3.29 0.12 2.42 1.43 0.07 -3.97 118.68 119.24 1ycf s LEU 139 Ca 0.08 -0.98 0.04 0.00 -1.03 0.00 0.00 54.13 52.23 1ycf s LEU 139 Cb 0.03 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 1ycf s LEU 139 CO -0.04 -0.15 0.13 0.28 0.23 0.00 0.00 176.35 176.79 1ycf s THR 140 N 1.29 4.64 -0.03 5.49 -1.32 0.14 -1.39 115.64 124.45 1ycf s THR 140 Ca -0.01 -0.85 0.07 0.00 -1.21 0.00 0.00 61.69 59.69 1ycf s THR 140 Cb -0.17 -3.30 -0.02 0.00 -1.51 0.00 0.00 72.50 67.50 1ycf s THR 140 CO -0.04 0.02 -0.24 -0.36 -2.21 0.00 0.00 174.62 171.79 1ycf s PHE 141 N -1.56 2.40 -0.22 9.09 0.08 -0.91 0.58 117.98 127.45 1ycf s PHE 141 Ca 0.31 -0.43 0.02 0.00 0.12 0.00 0.00 56.93 56.95 1ycf s PHE 141 Cb -0.11 -1.53 0.04 0.00 -0.57 0.00 0.00 43.02 40.85 1ycf s PHE 141 CO 0.23 -0.03 -0.14 0.42 -0.10 0.00 0.00 175.22 175.61 1ycf s ILE 142 N -0.57 2.05 0.40 0.64 1.01 -0.56 -0.61 121.20 123.55 1ycf s ILE 142 Ca 0.09 -1.29 -0.26 0.00 0.00 0.00 0.00 60.65 59.19 1ycf s ILE 142 Cb -0.11 -2.04 -0.09 0.00 0.01 0.00 0.00 42.46 40.24 1ycf s ILE 142 CO -0.00 0.21 1.23 -1.61 0.00 0.00 0.00 174.94 174.77 1ycf s GLU 143 N 1.22 4.02 -0.38 2.79 2.02 -1.26 -0.37 118.70 126.73 1ycf s GLU 143 Ca -0.03 2.00 0.10 0.00 0.02 0.00 0.00 54.97 57.06 1ycf s GLU 143 Cb -0.17 -2.73 0.31 0.00 0.10 0.00 0.00 34.13 31.64 1ycf s GLU 143 CO -0.08 -0.40 0.66 0.00 0.02 0.00 0.00 175.26 175.45 1ycf n ALA 144 N 0.12 2.06 -1.71 5.21 0.00 -1.01 -4.82 120.51 120.36 1ycf n ALA 144 Ca 0.04 -3.33 -0.43 0.00 0.00 0.00 0.00 53.44 49.72 1ycf n ALA 144 Cb 0.45 -0.89 -0.01 0.00 0.00 0.00 0.00 19.45 19.00 1ycf n ALA 144 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ycf n PRO 145 N 0.76 2.28 -0.70 0.00 -0.02 -1.25 -1.87 135.00 134.21 1ycf n PRO 145 Ca 0.23 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1ycf n PRO 145 Cb 0.61 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1ycf n PRO 145 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1ycf n MET 146 N 1.01 -1.35 -1.94 -0.52 2.81 -0.45 -4.77 117.12 111.92 1ycf n MET 146 Ca 0.06 0.28 -0.42 0.00 -1.81 0.00 0.00 57.70 55.81 1ycf n MET 146 Cb 0.36 -4.39 -0.00 0.00 -0.71 0.00 0.00 33.22 28.48 1ycf n MET 146 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1ycf n LEU 147 N 0.00 7.08 0.00 4.03 7.94 -0.78 -4.16 117.00 131.11 1ycf n LEU 147 Ca 0.00 -4.42 0.00 0.00 -1.11 0.00 0.00 56.01 50.48 1ycf n LEU 147 Cb 0.28 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 42.68 1ycf n LEU 147 CO 0.00 1.39 0.00 1.57 -1.11 0.00 0.00 177.39 179.24 1ycf n HIS 148 N 4.65 0.00 -4.10 1.96 -0.00 -1.26 -4.84 115.22 111.63 1ycf n HIS 148 Ca 0.51 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.56 1ycf n HIS 148 Cb 0.35 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.11 1ycf n HIS 148 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1ycf s TRP 149 N 0.00 0.79 0.19 1.57 0.52 -1.26 -5.04 118.94 115.71 1ycf s TRP 149 Ca 0.00 -0.58 -0.17 0.00 0.02 0.00 0.00 56.10 55.37 1ycf s TRP 149 Cb 0.00 -0.46 0.17 0.00 -1.15 0.00 0.00 33.47 32.02 1ycf s TRP 149 CO 0.00 -0.08 1.61 -1.35 0.02 0.00 0.00 176.95 177.16 1ycf h PRO 150 N 4.14 -0.09 0.00 4.98 0.11 -1.90 0.49 132.00 139.73 1ycf h PRO 150 Ca -0.36 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1ycf h PRO 150 Cb 1.19 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ycf h PRO 150 CO 0.46 -0.06 0.00 0.38 -0.21 0.00 0.00 178.00 178.57 1ycf h ASP 151 N -0.10 0.00 -3.07 -2.05 2.03 -1.91 -3.36 116.42 107.97 1ycf h ASP 151 Ca 0.25 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.99 1ycf h ASP 151 Cb 0.49 0.00 0.18 0.00 -0.83 0.00 0.00 39.33 39.18 1ycf h ASP 151 CO -0.62 0.00 -0.46 -1.20 -1.03 0.00 0.00 179.24 175.93 1ycf n SER 152 N -2.43 -1.35 -3.59 4.15 7.64 0.04 -4.55 113.62 113.52 1ycf n SER 152 Ca 0.01 0.62 -0.04 0.00 1.01 0.00 0.00 58.87 60.48 1ycf n SER 152 Cb 0.21 -1.18 -0.02 0.00 -1.01 0.00 0.00 64.21 62.22 1ycf n SER 152 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ycf s MET 153 N -2.50 0.39 0.15 1.43 0.23 -1.01 -2.41 119.30 115.59 1ycf s MET 153 Ca 0.65 -0.16 0.07 0.00 -1.03 0.00 0.00 55.69 55.23 1ycf s MET 153 Cb -0.38 0.17 -0.04 0.00 -1.53 0.00 0.00 34.83 33.05 1ycf s MET 153 CO 0.58 -0.17 -0.04 -0.06 -2.03 0.00 0.00 175.02 173.29 1ycf s PHE 154 N -2.51 2.79 -0.07 3.16 0.08 0.50 -4.66 117.98 117.27 1ycf s PHE 154 Ca 0.10 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 57.02 1ycf s PHE 154 Cb -0.00 -1.38 -0.03 0.00 -0.57 0.00 0.00 43.02 41.04 1ycf s PHE 154 CO -0.05 0.49 -0.12 0.99 -0.10 0.00 0.00 175.22 176.44 1ycf s THR 155 N -1.57 3.26 -0.06 0.64 2.01 -0.37 -1.50 115.64 118.04 1ycf s THR 155 Ca 0.25 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1ycf s THR 155 Cb -0.10 -2.31 0.01 0.00 0.01 0.00 0.00 72.50 70.11 1ycf s THR 155 CO 0.17 0.58 -0.15 -0.47 -0.69 0.00 0.00 174.62 174.06 1ycf s TYR 156 N -0.53 1.62 -0.76 4.92 5.04 0.20 -0.54 117.35 127.29 1ycf s TYR 156 Ca 0.07 -0.57 -0.09 0.00 -2.44 0.00 0.00 57.07 54.04 1ycf s TYR 156 Cb -0.12 -1.15 0.20 0.00 0.35 0.00 0.00 41.96 41.24 1ycf s TYR 156 CO 0.02 -0.26 0.65 0.08 -1.34 0.00 0.00 175.55 174.70 1ycf s VAL 157 N 0.46 4.87 0.19 3.14 1.01 -0.12 0.26 120.40 130.21 1ycf s VAL 157 Ca -0.12 -2.74 -0.16 0.00 0.00 0.00 0.00 61.98 58.96 1ycf s VAL 157 Cb -0.15 -4.05 0.16 0.00 0.00 0.00 0.00 36.38 32.34 1ycf s VAL 157 CO 0.04 -0.98 1.64 1.55 0.00 0.00 0.00 175.10 177.35 1ycf h PRO 158 N 7.40 -0.02 -1.15 2.72 0.13 -1.84 0.09 132.00 139.33 1ycf h PRO 158 Ca 0.07 0.00 0.32 0.00 -0.87 0.00 0.00 66.00 65.52 1ycf h PRO 158 Cb 0.99 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.06 1ycf h PRO 158 CO 0.74 -0.01 0.79 0.93 -0.23 0.00 0.00 178.00 180.22 1ycf h GLU 159 N -0.02 0.16 -0.10 0.86 3.07 -1.93 -1.06 114.58 115.56 1ycf h GLU 159 Ca 0.25 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1ycf h GLU 159 Cb 0.40 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1ycf h GLU 159 CO -0.54 0.10 0.00 0.39 -1.40 0.00 0.00 179.01 177.56 1ycf n GLU 160 N -4.39 1.26 -3.78 2.33 -0.58 -0.54 -4.99 120.64 109.94 1ycf n GLU 160 Ca 0.26 -1.33 -0.29 0.00 -0.42 0.00 0.00 57.16 55.39 1ycf n GLU 160 Cb 1.12 -1.15 0.03 0.00 -0.57 0.00 0.00 31.44 30.87 1ycf n GLU 160 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ycf n ALA 161 N 0.30 -1.25 -3.11 0.62 0.00 -0.09 -4.70 120.51 112.28 1ycf n ALA 161 Ca 0.06 0.23 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 1ycf n ALA 161 Cb 0.26 -4.53 -0.13 0.00 0.00 0.00 0.00 19.45 15.05 1ycf n ALA 161 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ycf s LEU 162 N -7.21 3.34 -0.19 0.00 1.98 -1.02 -1.00 118.68 114.58 1ycf s LEU 162 Ca 0.62 -0.21 -0.05 0.00 -2.89 0.00 0.00 54.13 51.60 1ycf s LEU 162 Cb -0.31 -1.87 -0.03 0.00 0.66 0.00 0.00 46.19 44.65 1ycf s LEU 162 CO 0.77 0.01 -0.00 -0.22 -1.89 0.00 0.00 176.35 175.02 1ycf s LEU 163 N 1.33 3.31 -0.74 -0.68 2.96 -0.68 -0.94 118.68 123.24 1ycf s LEU 163 Ca 0.05 -0.16 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 1ycf s LEU 163 Cb -0.15 -1.83 0.18 0.00 0.50 0.00 0.00 46.19 44.90 1ycf s LEU 163 CO 0.02 0.10 0.57 -0.76 -1.32 0.00 0.00 176.35 174.96 1ycf s LEU 164 N 0.81 5.24 0.00 -0.68 1.43 0.29 -0.91 118.68 124.86 1ycf s LEU 164 Ca 0.00 -3.36 0.25 0.00 -1.03 0.00 0.00 54.13 49.99 1ycf s LEU 164 Cb -0.14 -1.83 1.16 0.00 0.03 0.00 0.00 46.19 45.41 1ycf s LEU 164 CO 0.02 -0.24 1.78 -0.81 0.23 0.00 0.00 176.35 177.33 1ycf n PRO 165 N 2.78 1.39 0.00 1.29 -0.04 -1.26 -1.23 135.00 137.93 1ycf n PRO 165 Ca 0.15 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 1ycf n PRO 165 Cb 0.37 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1ycf n PRO 165 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ycf n ASN 166 N -0.25 0.00 -0.20 3.54 5.15 -1.26 -3.34 115.26 118.90 1ycf n ASN 166 Ca 0.18 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 54.14 1ycf n ASN 166 Cb 0.23 0.00 0.09 0.00 -0.53 0.00 0.00 39.78 39.57 1ycf n ASN 166 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1ycf h ASP 167 N 0.00 0.39 -2.74 1.20 3.32 -1.94 0.19 116.42 116.84 1ycf h ASP 167 Ca 0.00 0.05 -0.59 0.00 0.02 0.00 0.00 57.03 56.50 1ycf h ASP 167 Cb 0.00 -0.02 0.11 0.00 0.22 0.00 0.00 39.33 39.64 1ycf h ASP 167 CO 0.00 0.25 0.22 0.00 -1.72 0.00 0.00 179.24 177.99 1ycf n ALA 168 N -2.38 0.18 -1.00 3.45 0.00 -1.21 -1.39 120.51 118.16 1ycf n ALA 168 Ca 0.07 0.36 -0.00 0.00 0.00 0.00 0.00 53.44 53.88 1ycf n ALA 168 Cb 0.20 -2.08 -0.00 0.00 0.00 0.00 0.00 19.45 17.56 1ycf n ALA 168 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ycf n PHE 169 N 0.16 0.00 -2.99 0.00 3.72 -1.26 -4.66 117.46 112.43 1ycf n PHE 169 Ca 0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.28 1ycf n PHE 169 Cb 0.34 -1.13 0.02 0.00 -0.94 0.00 0.00 39.48 37.77 1ycf n PHE 169 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1ycf s GLY 170 N -2.00 1.71 0.01 1.37 0.00 -0.48 -4.74 107.32 103.19 1ycf s GLY 170 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.40 1ycf s GLY 170 CO 0.00 -1.13 -0.02 1.20 0.00 0.00 0.00 173.10 173.14 1ycf s GLN 171 N -4.50 0.19 -0.97 2.90 1.11 -0.95 -4.71 119.66 112.72 1ycf s GLN 171 Ca 0.51 -0.25 -0.20 0.00 0.01 0.00 0.00 55.36 55.43 1ycf s GLN 171 Cb -0.10 -0.06 0.10 0.00 -1.01 0.00 0.00 33.01 31.95 1ycf s GLN 171 CO 0.36 0.01 1.26 -1.01 0.01 0.00 0.00 175.29 175.91 1ycf s HIS 172 N -0.51 2.92 -0.12 0.91 3.76 -1.26 -2.37 115.29 118.60 1ycf s HIS 172 Ca -0.05 -1.22 -0.12 0.00 -0.15 0.00 0.00 55.06 53.52 1ycf s HIS 172 Cb -0.04 -4.44 0.03 0.00 1.11 0.00 0.00 32.58 29.25 1ycf s HIS 172 CO -0.00 -1.65 0.35 -1.50 -0.85 0.00 0.00 174.74 171.08 1ycf s ILE 173 N 3.49 0.00 -0.22 0.60 2.07 -1.10 -4.65 121.20 121.40 1ycf s ILE 173 Ca 0.38 -0.03 -0.09 0.00 -1.41 0.00 0.00 60.65 59.50 1ycf s ILE 173 Cb -0.03 -0.50 -0.04 0.00 0.13 0.00 0.00 42.46 42.02 1ycf s ILE 173 CO -0.09 -0.02 0.11 0.00 -1.91 0.00 0.00 174.94 173.04 1ycf s ALA 174 N 0.09 3.49 0.09 1.50 0.00 -0.33 -3.91 121.76 122.69 1ycf s ALA 174 Ca -0.01 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 50.99 1ycf s ALA 174 Cb -0.03 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.95 1ycf s ALA 174 CO 0.01 -0.09 0.23 0.95 0.00 0.00 0.00 175.76 176.86 1ycf s THR 175 N 0.87 0.13 -0.14 0.00 -4.23 -1.26 -4.95 115.64 106.05 1ycf s THR 175 Ca 0.06 -1.04 0.17 0.00 -1.18 0.00 0.00 61.69 59.70 1ycf s THR 175 Cb -0.13 -1.28 -0.07 0.00 1.34 0.00 0.00 72.50 72.36 1ycf s THR 175 CO 0.03 -0.57 1.02 0.77 -0.54 0.00 0.00 174.62 175.32 1ycf h SER 176 N 2.71 0.00 -4.35 3.99 4.64 -2.00 -3.46 113.55 115.09 1ycf h SER 176 Ca -0.34 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.48 1ycf h SER 176 Cb 1.21 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.39 1ycf h SER 176 CO 0.54 0.51 0.38 -0.69 -0.87 0.00 0.00 176.83 176.70 1ycf s VAL 177 N -2.97 3.86 0.00 0.95 1.01 -1.26 -5.03 120.40 116.96 1ycf s VAL 177 Ca -0.01 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.58 1ycf s VAL 177 Cb 0.08 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1ycf s VAL 177 CO 0.79 -0.79 0.00 0.54 0.00 0.00 0.00 175.10 175.64 1ycf n ARG 178 N -3.12 1.51 -4.66 2.72 5.12 -1.26 -4.97 116.66 112.01 1ycf n ARG 178 Ca 0.07 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.69 1ycf n ARG 178 Cb 0.55 -0.90 -0.13 0.00 -1.16 0.00 0.00 32.46 30.82 1ycf n ARG 178 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1ycf s PHE 179 N -1.63 2.52 0.61 -1.55 0.40 -1.26 -0.68 117.98 116.38 1ycf s PHE 179 Ca 0.00 -0.28 0.26 0.00 -0.60 0.00 0.00 56.93 56.31 1ycf s PHE 179 Cb 0.00 -1.44 1.22 0.00 0.51 0.00 0.00 43.02 43.31 1ycf s PHE 179 CO 0.00 0.25 1.65 0.38 0.70 0.00 0.00 175.22 178.20 1ycf h ASP 180 N 4.49 0.00 -0.01 1.36 -0.00 -1.47 0.57 116.42 121.36 1ycf h ASP 180 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.55 1ycf h ASP 180 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.48 1ycf h ASP 180 CO 0.47 0.00 0.00 -0.90 -0.00 0.00 0.00 179.24 178.81 1ycf n ASP 181 N -3.38 0.23 -0.40 4.15 5.75 -1.26 -3.18 116.55 118.47 1ycf n ASP 181 Ca 0.11 -1.26 0.07 0.00 -0.01 0.00 0.00 54.79 53.71 1ycf n ASP 181 Cb 0.94 -0.01 0.18 0.00 -1.03 0.00 0.00 41.12 41.20 1ycf n ASP 181 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ycf n GLN 182 N -0.73 1.53 -3.93 0.11 6.02 0.20 -5.02 117.38 115.55 1ycf n GLN 182 Ca 0.19 -2.93 -0.09 0.00 -0.01 0.00 0.00 57.00 54.17 1ycf n GLN 182 Cb 0.13 -1.59 -0.08 0.00 1.02 0.00 0.00 30.24 29.72 1ycf n GLN 182 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ycf s VAL 183 N -3.04 0.14 0.06 5.09 1.01 -1.19 -4.95 120.40 117.51 1ycf s VAL 183 Ca 0.36 -1.37 -0.31 0.00 0.00 0.00 0.00 61.98 60.66 1ycf s VAL 183 Cb 0.33 -1.49 -0.07 0.00 0.00 0.00 0.00 36.38 35.14 1ycf s VAL 183 CO -0.01 -0.65 1.53 -0.62 0.00 0.00 0.00 175.10 175.35 1ycf s ASP 184 N -2.90 6.71 0.12 3.32 -1.08 -1.26 -4.91 116.67 116.68 1ycf s ASP 184 Ca 0.08 2.35 -0.28 0.00 -0.52 0.00 0.00 52.55 54.19 1ycf s ASP 184 Cb 0.05 -2.57 -0.07 0.00 -1.46 0.00 0.00 42.92 38.88 1ycf s ASP 184 CO -0.08 -0.80 1.62 0.00 0.52 0.00 0.00 175.17 176.43 1ycf h ALA 185 N 7.85 -0.49 -0.07 3.66 0.00 -1.99 -0.56 119.26 127.66 1ycf h ALA 185 Ca -0.41 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.51 1ycf h ALA 185 Cb 1.19 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 19.47 1ycf h ALA 185 CO 0.91 -0.84 -0.19 0.78 0.00 0.00 0.00 179.25 179.91 1ycf h GLY 186 N -0.50 -0.21 0.90 0.00 0.00 -2.00 -2.14 103.07 99.13 1ycf h GLY 186 Ca 0.05 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 1ycf h GLY 186 CO -0.22 -0.17 0.04 1.41 0.00 0.00 0.00 176.54 177.60 1ycf h LEU 187 N -0.27 0.12 -1.27 3.11 4.07 -1.92 -2.16 115.31 116.99 1ycf h LEU 187 Ca 0.08 -0.12 -0.01 0.00 0.08 0.00 0.00 57.88 57.91 1ycf h LEU 187 Cb 0.38 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.06 1ycf h LEU 187 CO -0.23 0.21 0.35 -0.29 -1.08 0.00 0.00 178.44 177.40 1ycf h ILE 188 N 0.02 1.18 -0.20 1.22 6.09 -1.06 -1.30 117.51 123.48 1ycf h ILE 188 Ca 0.03 -0.45 -0.13 0.00 -1.37 0.00 0.00 64.86 62.95 1ycf h ILE 188 Cb 0.12 0.34 -0.01 0.00 0.47 0.00 0.00 36.82 37.73 1ycf h ILE 188 CO -0.00 0.20 -0.42 -0.03 -3.07 0.00 0.00 178.15 174.82 1ycf h MET 189 N 0.86 0.47 -0.09 2.19 4.05 -1.32 -1.99 114.93 119.10 1ycf h MET 189 Ca 0.22 -0.24 -0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1ycf h MET 189 Cb 0.01 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1ycf h MET 189 CO -0.04 0.81 0.05 0.22 0.23 0.00 0.00 176.91 178.18 1ycf h ASP 190 N 0.38 0.12 -0.50 1.39 3.58 -0.61 -0.56 116.42 120.23 1ycf h ASP 190 Ca 0.03 -0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.37 1ycf h ASP 190 Cb 0.90 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.90 1ycf h ASP 190 CO 0.08 0.20 0.33 -0.33 -2.88 0.00 0.00 179.24 176.64 1ycf h GLU 191 N 0.03 0.65 -0.34 0.28 4.39 -1.15 0.41 114.58 118.86 1ycf h GLU 191 Ca 0.03 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 1ycf h GLU 191 Cb 0.11 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1ycf h GLU 191 CO -0.00 0.43 -0.12 0.00 -1.16 0.00 0.00 179.01 178.15 1ycf h ALA 192 N 1.69 1.16 -0.11 3.43 0.00 -0.86 -1.07 119.26 123.51 1ycf h ALA 192 Ca 0.18 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 54.58 1ycf h ALA 192 Cb -0.07 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ycf h ALA 192 CO -0.04 0.53 -0.81 0.00 0.00 0.00 0.00 179.25 178.93 1ycf h ALA 193 N 1.33 0.35 -0.18 0.00 0.00 0.55 -2.00 119.26 119.32 1ycf h ALA 193 Ca 0.10 -0.62 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 1ycf h ALA 193 Cb 0.53 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1ycf h ALA 193 CO 0.03 0.71 -0.15 -0.22 0.00 0.00 0.00 179.25 179.62 1ycf h LYS 194 N 0.45 0.30 0.18 0.00 3.64 -0.73 -1.74 116.57 118.66 1ycf h LYS 194 Ca -0.06 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.23 1ycf h LYS 194 Cb 1.43 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 1ycf h LYS 194 CO 0.16 0.45 -0.09 -0.92 -2.27 0.00 0.00 179.45 176.79 1ycf h TYR 195 N 0.28 -0.22 0.16 1.91 3.20 -1.06 -2.92 116.97 118.32 1ycf h TYR 195 Ca 0.05 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1ycf h TYR 195 Cb 0.44 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 1ycf h TYR 195 CO 0.01 0.14 -0.18 -0.92 -1.64 0.00 0.00 178.16 175.57 1ycf h TYR 196 N -0.63 -0.49 -0.99 -3.82 3.20 -1.20 -1.91 116.97 111.13 1ycf h TYR 196 Ca -0.02 0.00 0.34 0.00 3.14 0.00 0.00 58.73 62.19 1ycf h TYR 196 Cb 0.46 0.19 -0.16 0.00 1.54 0.00 0.00 36.73 38.77 1ycf h TYR 196 CO 0.04 -0.23 0.51 0.00 -1.64 0.00 0.00 178.16 176.84 1ycf h ALA 197 N -1.44 1.92 0.00 1.82 0.00 -1.45 0.47 119.26 120.58 1ycf h ALA 197 Ca -0.02 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ycf h ALA 197 Cb 0.30 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ycf h ALA 197 CO -0.03 -0.67 -0.53 0.09 0.00 0.00 0.00 179.25 178.11 1ycf n ASN 198 N -5.15 0.72 0.00 0.00 3.02 -1.10 -4.16 115.26 108.59 1ycf n ASN 198 Ca 0.32 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 1ycf n ASN 198 Cb 1.03 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 40.21 1ycf n ASN 198 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1ycf n ILE 199 N -2.14 0.00 0.30 2.41 5.41 0.10 -4.87 119.36 120.56 1ycf n ILE 199 Ca 0.04 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.90 1ycf n ILE 199 Cb 0.44 -0.60 -0.06 0.00 -0.71 0.00 0.00 39.64 38.71 1ycf n ILE 199 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1ycf n LEU 200 N -2.43 0.48 -0.31 1.39 4.77 0.14 -4.57 117.00 116.46 1ycf n LEU 200 Ca 0.00 0.03 0.02 0.00 -0.03 0.00 0.00 56.01 56.03 1ycf n LEU 200 Cb 0.40 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.52 1ycf n LEU 200 CO 0.00 -0.01 0.53 0.80 -1.33 0.00 0.00 177.39 177.38 1ycf n MET 201 N -2.19 -0.13 0.24 3.23 1.56 -0.96 0.11 117.12 118.98 1ycf n MET 201 Ca -0.00 1.31 0.16 0.00 -0.27 0.00 0.00 57.70 58.90 1ycf n MET 201 Cb 0.50 -1.95 0.84 0.00 2.15 0.00 0.00 33.22 34.76 1ycf n MET 201 CO 0.00 0.00 0.00 -1.00 -0.73 0.00 0.00 175.97 174.24 1ycf h PRO 202 N 0.00 0.00 -0.46 2.12 0.13 -1.62 -2.68 132.00 129.49 1ycf h PRO 202 Ca 0.35 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.28 1ycf h PRO 202 Cb 0.56 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.57 1ycf h PRO 202 CO -0.85 0.00 0.06 1.19 -0.23 0.00 0.00 178.00 178.17 1ycf n PHE 203 N -2.66 1.44 -0.30 1.56 3.72 0.30 -4.73 117.46 116.80 1ycf n PHE 203 Ca -0.01 -1.50 0.07 0.00 -0.05 0.00 0.00 57.45 55.95 1ycf n PHE 203 Cb 0.09 -0.54 0.23 0.00 -0.94 0.00 0.00 39.48 38.32 1ycf n PHE 203 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1ycf h SER 204 N 1.22 0.58 -0.43 4.37 0.02 -1.42 -0.34 113.55 117.54 1ycf h SER 204 Ca 0.25 0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 61.23 1ycf h SER 204 Cb 1.85 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 64.36 1ycf h SER 204 CO 0.49 0.25 0.04 0.78 -1.14 0.00 0.00 176.83 177.26 1ycf h ASN 205 N 0.66 0.71 -0.67 3.07 2.35 -1.85 -1.63 115.58 118.23 1ycf h ASN 205 Ca 0.47 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 1ycf h ASN 205 Cb 0.64 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.79 1ycf h ASN 205 CO -0.35 0.81 0.32 -0.07 -1.65 0.00 0.00 177.43 176.50 1ycf h LEU 206 N 0.58 0.89 -0.51 1.61 3.38 -1.70 -1.75 115.31 117.81 1ycf h LEU 206 Ca 0.13 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ycf h LEU 206 Cb 0.42 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1ycf h LEU 206 CO 0.01 0.76 0.32 0.40 0.09 0.00 0.00 178.44 180.02 1ycf h ILE 207 N 0.98 1.15 -0.32 1.22 1.08 -0.68 -0.99 117.51 119.95 1ycf h ILE 207 Ca 0.24 -0.31 -0.03 0.00 -0.39 0.00 0.00 64.86 64.37 1ycf h ILE 207 Cb 0.11 0.44 -0.01 0.00 -3.07 0.00 0.00 36.82 34.29 1ycf h ILE 207 CO -0.03 0.15 0.08 0.74 -0.69 0.00 0.00 178.15 178.40 1ycf h THR 208 N 0.69 1.22 0.34 -0.27 2.02 -0.81 -0.49 112.91 115.59 1ycf h THR 208 Ca 0.18 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.65 1ycf h THR 208 Cb -0.03 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1ycf h THR 208 CO -0.04 0.24 -0.43 0.11 0.37 0.00 0.00 175.52 175.77 1ycf h LYS 209 N 0.35 -0.78 -0.69 6.66 1.57 -1.10 -1.40 116.57 121.19 1ycf h LYS 209 Ca 0.10 0.05 0.11 0.00 -1.87 0.00 0.00 60.65 59.05 1ycf h LYS 209 Cb 0.28 0.18 -0.08 0.00 0.08 0.00 0.00 32.23 32.69 1ycf h LYS 209 CO -0.00 -0.52 0.28 -0.22 -0.57 0.00 0.00 179.45 178.42 1ycf h LYS 210 N -0.81 0.45 -0.88 3.15 1.63 -1.07 0.72 116.57 119.76 1ycf h LYS 210 Ca -0.02 -0.03 0.04 0.00 -0.85 0.00 0.00 60.65 59.79 1ycf h LYS 210 Cb 0.75 -0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 32.22 1ycf h LYS 210 CO -0.12 0.30 0.57 -0.07 -3.45 0.00 0.00 179.45 176.68 1ycf h LEU 211 N 0.46 0.94 -0.06 5.20 3.38 -0.78 -1.47 115.31 122.98 1ycf h LEU 211 Ca 0.36 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 1ycf h LEU 211 Cb 0.47 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1ycf h LEU 211 CO -0.34 0.64 0.00 0.44 0.09 0.00 0.00 178.44 179.28 1ycf h ASP 212 N 1.10 0.10 -0.72 -0.43 3.32 0.09 -1.43 116.42 118.46 1ycf h ASP 212 Ca 0.35 -0.29 0.15 0.00 0.02 0.00 0.00 57.03 57.27 1ycf h ASP 212 Cb 0.02 -0.03 -0.11 0.00 0.22 0.00 0.00 39.33 39.44 1ycf h ASP 212 CO -0.12 0.37 0.17 -0.08 -1.72 0.00 0.00 179.24 177.86 1ycf h GLU 213 N -0.16 0.26 -0.78 3.56 4.81 -0.61 0.45 114.58 122.10 1ycf h GLU 213 Ca 0.02 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1ycf h GLU 213 Cb 0.31 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.60 1ycf h GLU 213 CO 0.00 0.17 0.32 0.82 -0.73 0.00 0.00 179.01 179.59 1ycf h ILE 214 N 0.27 1.26 -0.11 2.32 2.04 -1.09 -2.77 117.51 119.43 1ycf h ILE 214 Ca 0.40 -0.80 -0.13 0.00 1.00 0.00 0.00 64.86 65.33 1ycf h ILE 214 Cb 0.67 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1ycf h ILE 214 CO -0.50 0.33 -0.49 -0.61 0.00 0.00 0.00 178.15 176.88 1ycf h GLN 215 N 1.13 0.29 0.62 2.37 4.15 0.40 -2.83 115.11 121.25 1ycf h GLN 215 Ca 0.26 -0.17 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 1ycf h GLN 215 Cb 0.20 0.01 0.01 0.00 0.21 0.00 0.00 27.48 27.91 1ycf h GLN 215 CO -0.02 0.72 -0.30 0.87 -1.93 0.00 0.00 178.83 178.17 1ycf h LYS 216 N 0.24 -0.80 -0.54 1.69 1.57 0.01 -1.84 116.57 116.89 1ycf h LYS 216 Ca 0.01 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1ycf h LYS 216 Cb 0.96 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1ycf h LYS 216 CO 0.08 -0.53 0.00 0.44 -0.57 0.00 0.00 179.45 178.87 1ycf n ILE 217 N -5.44 0.00 -3.52 1.86 -5.35 -1.12 -4.89 119.36 100.91 1ycf n ILE 217 Ca -0.13 0.00 -0.20 0.00 -0.27 0.00 0.00 62.75 62.15 1ycf n ILE 217 Cb 0.34 -0.31 0.00 0.00 -1.74 0.00 0.00 39.64 37.94 1ycf n ILE 217 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1ycf n ASN 218 N -0.03 -2.73 -4.69 7.28 3.02 -0.69 -4.87 115.26 112.55 1ycf n ASN 218 Ca 0.00 -0.66 -0.42 0.00 -0.03 0.00 0.00 54.58 53.46 1ycf n ASN 218 Cb 0.14 -0.95 -0.03 0.00 -0.61 0.00 0.00 39.78 38.32 1ycf n ASN 218 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ycf s LEU 219 N -4.73 4.26 -0.63 3.41 1.43 -1.08 -4.98 118.68 116.36 1ycf s LEU 219 Ca 0.10 1.53 -0.28 0.00 -1.03 0.00 0.00 54.13 54.45 1ycf s LEU 219 Cb -0.06 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.65 1ycf s LEU 219 CO 0.56 -0.42 1.28 0.00 0.23 0.00 0.00 176.35 178.00 1ycf s ALA 220 N 1.89 2.85 -0.60 4.21 0.00 -1.26 -4.96 121.76 123.89 1ycf s ALA 220 Ca 0.48 -0.98 -0.14 0.00 0.00 0.00 0.00 51.96 51.32 1ycf s ALA 220 Cb -0.18 -4.14 0.15 0.00 0.00 0.00 0.00 23.12 18.95 1ycf s ALA 220 CO 0.19 -2.97 0.54 0.42 0.00 0.00 0.00 175.76 173.94 1ycf s ILE 221 N 5.55 5.11 -0.02 0.00 1.01 -1.26 -4.38 121.20 127.20 1ycf s ILE 221 Ca 0.43 -1.82 0.12 0.00 0.00 0.00 0.00 60.65 59.38 1ycf s ILE 221 Cb -0.08 -4.26 -0.17 0.00 0.01 0.00 0.00 42.46 37.96 1ycf s ILE 221 CO 0.22 -0.89 0.99 0.11 0.00 0.00 0.00 174.94 175.36 1ycf h LYS 222 N 8.51 0.00 -2.53 2.79 1.57 -1.35 -3.46 116.57 122.10 1ycf h LYS 222 Ca -0.18 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 1ycf h LYS 222 Cb 1.08 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.18 1ycf h LYS 222 CO 0.94 0.61 -0.08 0.95 -0.57 0.00 0.00 179.45 181.30 1ycf s THR 223 N -2.75 0.02 -0.11 -0.16 -4.23 -1.06 -4.68 115.64 102.67 1ycf s THR 223 Ca -0.01 -0.15 0.03 0.00 -1.18 0.00 0.00 61.69 60.37 1ycf s THR 223 Cb 0.09 -0.76 0.01 0.00 1.34 0.00 0.00 72.50 73.17 1ycf s THR 223 CO 0.81 -0.08 -0.22 -0.63 -0.54 0.00 0.00 174.62 173.96 1ycf s ILE 224 N -0.65 1.95 -0.45 2.99 1.01 -0.55 -1.69 121.20 123.81 1ycf s ILE 224 Ca -0.07 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 59.68 1ycf s ILE 224 Cb -0.03 -1.71 0.12 0.00 0.01 0.00 0.00 42.46 40.85 1ycf s ILE 224 CO 0.04 0.53 0.18 0.00 0.00 0.00 0.00 174.94 175.70 1ycf s ALA 225 N 0.60 3.04 0.82 9.38 0.00 -0.09 -1.15 121.76 134.36 1ycf s ALA 225 Ca -0.13 -2.94 -0.12 0.00 0.00 0.00 0.00 51.96 48.78 1ycf s ALA 225 Cb -0.17 -2.06 0.08 0.00 0.00 0.00 0.00 23.12 20.98 1ycf s ALA 225 CO 0.03 -1.90 1.11 -1.25 0.00 0.00 0.00 175.76 173.75 1ycf s PRO 226 N 0.20 1.88 0.00 0.00 0.04 -1.26 -4.13 135.00 131.72 1ycf s PRO 226 Ca 0.15 0.53 0.27 0.00 0.04 0.00 0.00 61.00 61.99 1ycf s PRO 226 Cb -0.23 -1.90 1.49 0.00 0.04 0.00 0.00 34.50 33.90 1ycf s PRO 226 CO -0.03 -1.74 1.97 -1.13 0.04 0.00 0.00 177.00 176.11 1ycf n SER 227 N -3.50 0.27 -3.75 6.66 3.41 0.66 -4.69 113.62 112.68 1ycf n SER 227 Ca 0.07 -1.23 -0.15 0.00 -0.26 0.00 0.00 58.87 57.30 1ycf n SER 227 Cb 0.57 -0.01 -0.15 0.00 -0.26 0.00 0.00 64.21 64.36 1ycf n SER 227 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1ycf s HIS 228 N -1.99 -0.05 0.00 7.33 3.76 -1.26 -1.23 115.29 121.85 1ycf s HIS 228 Ca 0.40 0.29 0.00 0.00 -0.15 0.00 0.00 55.06 55.59 1ycf s HIS 228 Cb 0.19 -0.19 0.00 0.00 1.11 0.00 0.00 32.58 33.68 1ycf s HIS 228 CO 0.31 -0.13 0.00 0.41 -0.85 0.00 0.00 174.74 174.48 1ycf n GLY 229 N 4.29 -0.66 3.76 -2.22 0.00 -1.00 -2.24 105.19 107.11 1ycf n GLY 229 Ca -0.25 -1.14 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 1ycf n GLY 229 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ycf s ILE 230 N 0.00 2.32 -0.30 -0.61 1.09 -1.26 -4.89 121.20 117.56 1ycf s ILE 230 Ca 0.00 0.25 -0.15 0.00 -1.10 0.00 0.00 60.65 59.65 1ycf s ILE 230 Cb 0.00 -3.13 -0.03 0.00 -1.06 0.00 0.00 42.46 38.24 1ycf s ILE 230 CO 0.00 0.00 0.38 -0.63 -0.10 0.00 0.00 174.94 174.59 1ycf s ILE 231 N -1.34 5.16 -0.87 2.92 1.01 0.14 -4.57 121.20 123.64 1ycf s ILE 231 Ca 0.68 0.39 -0.25 0.00 0.00 0.00 0.00 60.65 61.47 1ycf s ILE 231 Cb -0.38 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.32 1ycf s ILE 231 CO 0.46 0.05 1.77 0.26 0.00 0.00 0.00 174.94 177.48 1ycf s TRP 232 N 2.08 1.98 -0.25 3.97 0.52 -0.30 -1.17 118.94 125.77 1ycf s TRP 232 Ca 0.14 0.26 -0.09 0.00 0.02 0.00 0.00 56.10 56.43 1ycf s TRP 232 Cb -0.16 -4.24 -0.16 0.00 -1.15 0.00 0.00 33.47 27.76 1ycf s TRP 232 CO 0.11 -1.90 -0.17 -2.13 0.02 0.00 0.00 176.95 172.88 1ycf n ARG 233 N 8.95 0.62 0.07 4.98 0.63 -1.26 -1.48 116.66 129.17 1ycf n ARG 233 Ca 0.33 0.27 -0.00 0.00 -0.92 0.00 0.00 57.85 57.53 1ycf n ARG 233 Cb 0.49 -1.56 -0.05 0.00 0.45 0.00 0.00 32.46 31.79 1ycf n ARG 233 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ycf h LYS 234 N -0.59 0.00 -0.73 -0.14 1.79 -1.86 -3.44 116.57 111.60 1ycf h LYS 234 Ca -0.59 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.53 1ycf h LYS 234 Cb 1.70 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 32.12 1ycf h LYS 234 CO -0.24 0.43 -0.71 -3.47 -1.08 0.00 0.00 179.45 174.37 1ycf n ASP 235 N -3.05 -1.79 0.00 0.86 2.03 -1.26 -4.93 116.55 108.41 1ycf n ASP 235 Ca -0.05 -3.09 0.08 0.00 0.52 0.00 0.00 54.79 52.25 1ycf n ASP 235 Cb 0.82 0.94 0.48 0.00 -0.72 0.00 0.00 41.12 42.64 1ycf n ASP 235 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1ycf n PRO 236 N 1.55 0.45 -0.02 -0.67 -0.04 -1.26 -2.25 135.00 132.76 1ycf n PRO 236 Ca 0.13 0.03 -0.14 0.00 -0.04 0.00 0.00 63.50 63.48 1ycf n PRO 236 Cb 0.59 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 1ycf n PRO 236 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ycf h GLY 237 N 2.64 0.79 0.07 0.55 0.00 -1.91 -3.05 103.07 102.16 1ycf h GLY 237 Ca 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 47.33 46.35 1ycf h GLY 237 CO 0.00 0.92 -0.33 -0.09 0.00 0.00 0.00 176.54 177.04 1ycf h ARG 238 N 0.52 -0.36 0.00 4.80 2.43 -1.88 0.44 114.38 120.33 1ycf h ARG 238 Ca -0.02 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1ycf h ARG 238 Cb 1.28 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 1ycf h ARG 238 CO 0.14 -0.24 -0.50 -0.84 -1.51 0.00 0.00 179.97 177.01 1ycf h ILE 239 N -0.37 1.08 -0.53 1.20 -0.00 -1.76 -0.19 117.51 116.94 1ycf h ILE 239 Ca 0.11 -1.93 -0.10 0.00 -0.00 0.00 0.00 64.86 62.94 1ycf h ILE 239 Cb 0.55 2.13 -0.02 0.00 -0.00 0.00 0.00 36.82 39.49 1ycf h ILE 239 CO -0.40 0.49 -0.07 0.40 -0.00 0.00 0.00 178.15 178.57 1ycf h ILE 240 N 0.00 1.27 -0.10 0.16 2.04 -1.29 0.63 117.51 120.22 1ycf h ILE 240 Ca -0.01 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.61 1ycf h ILE 240 Cb 1.09 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1ycf h ILE 240 CO 0.07 0.43 -0.06 -0.33 0.00 0.00 0.00 178.15 178.25 1ycf h GLU 241 N 0.86 0.22 -0.21 2.37 5.08 -0.81 -1.41 114.58 120.67 1ycf h GLU 241 Ca 0.14 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1ycf h GLU 241 Cb 0.63 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.81 1ycf h GLU 241 CO 0.04 0.60 -0.18 0.00 -1.00 0.00 0.00 179.01 178.46 1ycf h ALA 242 N 0.62 -0.05 -0.84 3.43 0.00 -0.83 0.43 119.26 122.03 1ycf h ALA 242 Ca 0.02 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1ycf h ALA 242 Cb 0.54 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 1ycf h ALA 242 CO 0.02 -0.61 0.53 1.88 0.00 0.00 0.00 179.25 181.06 1ycf h TYR 243 N -0.19 0.98 0.11 0.00 -1.99 0.29 0.25 116.97 116.41 1ycf h TYR 243 Ca 0.13 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.89 1ycf h TYR 243 Cb 0.38 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.78 1ycf h TYR 243 CO -0.33 0.53 -0.10 0.00 -0.00 0.00 0.00 178.16 178.25 1ycf h ALA 244 N 1.37 -0.21 0.42 3.88 0.00 -0.01 0.11 119.26 124.82 1ycf h ALA 244 Ca 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1ycf h ALA 244 Cb 0.10 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1ycf h ALA 244 CO -0.15 -0.63 -0.40 0.00 0.00 0.00 0.00 179.25 178.07 1ycf h ARG 245 N -0.23 -0.80 -0.96 0.00 3.08 0.54 -1.16 114.38 114.85 1ycf h ARG 245 Ca 0.00 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.22 1ycf h ARG 245 Cb 0.22 0.18 -0.07 0.00 0.08 0.00 0.00 29.97 30.38 1ycf h ARG 245 CO -0.03 -0.54 0.61 -1.49 -1.07 0.00 0.00 179.97 177.46 1ycf h TRP 246 N -0.83 1.06 -0.23 3.04 6.55 -0.39 -2.01 115.95 123.13 1ycf h TRP 246 Ca -0.04 0.03 -0.17 0.00 0.95 0.00 0.00 58.89 59.66 1ycf h TRP 246 Cb 0.74 -0.34 -0.00 0.00 -0.86 0.00 0.00 29.16 28.69 1ycf h TRP 246 CO -0.21 0.46 -0.54 0.00 -1.05 0.00 0.00 178.44 177.09 1ycf h ALA 247 N 1.54 0.62 -0.07 1.49 0.00 -0.57 -3.17 119.26 119.10 1ycf h ALA 247 Ca 0.46 -0.51 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1ycf h ALA 247 Cb 0.44 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1ycf h ALA 247 CO -0.22 0.69 -0.21 1.49 0.00 0.00 0.00 179.25 181.00 1ycf h GLU 248 N 0.52 -0.28 0.00 0.00 4.81 -0.48 -3.42 114.58 115.72 1ycf h GLU 248 Ca 0.01 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ycf h GLU 248 Cb 1.11 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1ycf h GLU 248 CO 0.11 -0.19 0.00 0.41 -0.73 0.00 0.00 179.01 178.61 1ycf n GLY 249 N -1.34 0.76 0.26 1.92 0.00 -0.99 -4.96 105.19 100.83 1ycf n GLY 249 Ca -0.04 -0.29 0.08 0.00 0.00 0.00 0.00 46.02 45.77 1ycf n GLY 249 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ycf h GLN 250 N 1.00 0.00 0.00 1.61 4.15 -1.89 -3.44 115.11 116.54 1ycf h GLN 250 Ca 0.00 0.00 0.17 0.00 0.77 0.00 0.00 58.65 59.59 1ycf h GLN 250 Cb 0.00 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.65 1ycf h GLN 250 CO 0.00 0.03 -0.23 0.41 -1.93 0.00 0.00 178.83 177.11 1ycf n GLY 251 N -1.43 -1.48 3.46 2.39 0.00 -1.26 -4.95 105.19 101.93 1ycf n GLY 251 Ca -0.03 -1.11 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 1ycf n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ycf s LYS 252 N -1.02 1.64 -1.23 1.61 1.02 0.91 -4.99 119.74 117.69 1ycf s LYS 252 Ca 0.00 -1.84 -0.20 0.00 0.02 0.00 0.00 55.97 53.94 1ycf s LYS 252 Cb 0.00 -1.28 -0.02 0.00 -0.52 0.00 0.00 37.83 36.01 1ycf s LYS 252 CO 0.00 0.04 1.86 0.00 -0.92 0.00 0.00 175.35 176.33 1ycf n ALA 253 N -0.66 2.75 -3.42 5.17 0.00 -1.26 -3.29 120.51 119.80 1ycf n ALA 253 Ca -0.05 -3.42 -0.16 0.00 0.00 0.00 0.00 53.44 49.82 1ycf n ALA 253 Cb 0.64 -3.54 -0.07 0.00 0.00 0.00 0.00 19.45 16.47 1ycf n ALA 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1ycf s LYS 254 N 5.34 0.85 0.10 0.00 2.20 -1.26 -2.63 119.74 124.33 1ycf s LYS 254 Ca 0.61 0.22 0.06 0.00 -0.36 0.00 0.00 55.97 56.50 1ycf s LYS 254 Cb 0.03 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.71 1ycf s LYS 254 CO 0.10 -0.23 -0.14 0.00 -0.36 0.00 0.00 175.35 174.73 1ycf s ALA 255 N -0.92 1.38 -0.13 3.13 0.00 0.32 -0.47 121.76 125.08 1ycf s ALA 255 Ca -0.09 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 50.69 1ycf s ALA 255 Cb -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1ycf s ALA 255 CO 0.06 0.12 -0.19 0.08 0.00 0.00 0.00 175.76 175.83 1ycf s VAL 256 N -1.89 1.83 -0.24 0.00 1.01 -0.23 -1.64 120.40 119.26 1ycf s VAL 256 Ca 0.05 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 1ycf s VAL 256 Cb -0.06 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.68 1ycf s VAL 256 CO 0.03 0.51 -0.04 -0.63 0.00 0.00 0.00 175.10 174.96 1ycf s ILE 257 N 0.92 3.20 -0.04 2.22 1.01 -0.11 -1.54 121.20 126.87 1ycf s ILE 257 Ca -0.06 -0.71 0.07 0.00 0.00 0.00 0.00 60.65 59.94 1ycf s ILE 257 Cb -0.15 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 1ycf s ILE 257 CO -0.03 0.32 -0.24 0.00 0.00 0.00 0.00 174.94 174.99 1ycf s ALA 258 N 1.42 2.03 0.07 9.38 0.00 -0.63 -0.57 121.76 133.47 1ycf s ALA 258 Ca 0.04 -1.02 -0.06 0.00 0.00 0.00 0.00 51.96 50.91 1ycf s ALA 258 Cb -0.15 -0.57 0.02 0.00 0.00 0.00 0.00 23.12 22.42 1ycf s ALA 258 CO -0.04 0.45 0.30 2.48 0.00 0.00 0.00 175.76 178.95 1ycf n TYR 259 N 2.71 -0.90 -3.52 0.00 0.18 -0.36 -1.55 117.16 113.71 1ycf n TYR 259 Ca -0.17 -0.41 -0.09 0.00 1.88 0.00 0.00 57.90 59.11 1ycf n TYR 259 Cb 0.52 0.20 -0.03 0.00 -0.38 0.00 0.00 39.34 39.65 1ycf n TYR 259 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1ycf s ASP 260 N -1.72 -0.37 0.15 9.48 -1.08 -1.08 -0.75 116.67 121.29 1ycf s ASP 260 Ca 0.07 0.13 -0.06 0.00 -0.52 0.00 0.00 52.55 52.17 1ycf s ASP 260 Cb -0.01 0.36 -0.02 0.00 -1.46 0.00 0.00 42.92 41.79 1ycf s ASP 260 CO 0.02 -0.54 0.20 0.42 0.52 0.00 0.00 175.17 175.79 1ycf s THR 261 N -2.51 0.08 -0.23 1.71 -4.23 -1.26 -4.11 115.64 105.09 1ycf s THR 261 Ca 0.03 -1.57 -0.02 0.00 -1.18 0.00 0.00 61.69 58.94 1ycf s THR 261 Cb -0.01 -1.92 -0.14 0.00 1.34 0.00 0.00 72.50 71.78 1ycf s THR 261 CO -0.05 -0.36 -0.23 0.23 -0.54 0.00 0.00 174.62 173.67 1ycf n MET 262 N -0.17 0.56 -0.21 3.99 0.00 -1.26 -4.74 117.12 115.29 1ycf n MET 262 Ca -0.07 0.16 0.05 0.00 0.00 0.00 0.00 57.70 57.84 1ycf n MET 262 Cb 0.63 -1.44 0.07 0.00 0.00 0.00 0.00 33.22 32.49 1ycf n MET 262 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 1ycf n TRP 263 N -3.41 0.00 0.00 2.03 7.02 -1.26 -5.05 117.44 116.78 1ycf n TRP 263 Ca -0.43 -0.57 0.00 0.00 -1.02 0.00 0.00 57.50 55.49 1ycf n TRP 263 Cb 0.91 -0.10 0.00 0.00 -2.42 0.00 0.00 31.31 29.70 1ycf n TRP 263 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1ycf n LEU 264 N -0.80 0.00 0.00 -0.99 4.77 -1.26 -4.92 117.00 113.80 1ycf n LEU 264 Ca 0.08 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1ycf n LEU 264 Cb 0.62 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.67 1ycf n LEU 264 CO 0.01 0.00 0.81 0.28 -1.33 0.00 0.00 177.39 177.16 1ycf h SER 265 N 0.00 -0.23 -0.51 -1.43 0.02 -1.97 0.98 113.55 110.42 1ycf h SER 265 Ca 0.00 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1ycf h SER 265 Cb 0.00 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1ycf h SER 265 CO 0.00 -0.10 0.30 0.74 -1.14 0.00 0.00 176.83 176.63 1ycf h THR 266 N -0.08 1.15 -0.11 -2.27 2.02 -1.91 -1.04 112.91 110.68 1ycf h THR 266 Ca 0.07 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.79 1ycf h THR 266 Cb 0.18 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1ycf h THR 266 CO -0.16 0.16 -0.36 -0.08 0.37 0.00 0.00 175.52 175.46 1ycf h GLU 267 N 0.72 0.23 -0.16 6.66 4.81 -1.62 -0.48 114.58 124.74 1ycf h GLU 267 Ca 0.19 -0.10 -0.18 0.00 -0.13 0.00 0.00 59.36 59.14 1ycf h GLU 267 Cb -0.01 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1ycf h GLU 267 CO -0.03 0.57 -0.65 0.87 -0.73 0.00 0.00 179.01 179.04 1ycf h LYS 268 N 0.20 0.59 -0.23 1.92 1.57 0.37 -2.34 116.57 118.65 1ycf h LYS 268 Ca 0.02 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.36 1ycf h LYS 268 Cb 0.74 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 1ycf h LYS 268 CO 0.06 1.04 0.06 0.52 -0.57 0.00 0.00 179.45 180.56 1ycf h MET 269 N 0.43 0.36 -0.94 3.15 2.86 -0.90 -1.85 114.93 118.05 1ycf h MET 269 Ca -0.01 -0.08 0.13 0.00 -2.06 0.00 0.00 59.70 57.67 1ycf h MET 269 Cb 1.22 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.76 1ycf h MET 269 CO 0.12 0.46 0.60 0.00 1.06 0.00 0.00 176.91 179.15 1ycf h ALA 270 N 0.88 1.67 -0.19 6.32 0.00 -1.01 -0.05 119.26 126.88 1ycf h ALA 270 Ca 0.07 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1ycf h ALA 270 Cb 0.26 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ycf h ALA 270 CO -0.00 0.09 -0.19 1.25 0.00 0.00 0.00 179.25 180.40 1ycf h HIS 271 N 0.85 0.56 0.27 0.00 6.17 -1.15 -1.61 115.15 120.23 1ycf h HIS 271 Ca 0.47 -0.17 0.01 0.00 0.71 0.00 0.00 60.37 61.39 1ycf h HIS 271 Cb 0.58 -0.12 -0.03 0.00 2.52 0.00 0.00 27.41 30.36 1ycf h HIS 271 CO -0.00 0.83 -0.43 0.00 0.71 0.00 0.00 177.93 179.04 1ycf h ALA 272 N 0.64 -0.85 -0.66 5.26 0.00 -0.46 0.17 119.26 123.36 1ycf h ALA 272 Ca 0.03 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1ycf h ALA 272 Cb 0.73 0.66 -0.10 0.00 0.00 0.00 0.00 17.79 19.09 1ycf h ALA 272 CO 0.05 -1.03 0.11 -0.07 0.00 0.00 0.00 179.25 178.31 1ycf h LEU 273 N -0.76 -0.06 -0.92 0.00 3.38 -1.06 0.11 115.31 115.99 1ycf h LEU 273 Ca -0.01 0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1ycf h LEU 273 Cb 0.73 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.62 1ycf h LEU 273 CO -0.15 -0.04 0.60 -0.03 0.09 0.00 0.00 178.44 178.91 1ycf h MET 274 N 0.23 1.17 -0.87 1.13 4.05 -0.34 -1.90 114.93 118.39 1ycf h MET 274 Ca 0.35 -0.07 0.01 0.00 -0.28 0.00 0.00 59.70 59.71 1ycf h MET 274 Cb 0.57 -0.26 -0.04 0.00 -0.80 0.00 0.00 31.60 31.06 1ycf h MET 274 CO -0.48 0.77 0.56 -0.44 0.23 0.00 0.00 176.91 177.56 1ycf h ASP 275 N 1.20 1.01 -0.43 1.39 3.32 0.13 -0.53 116.42 122.51 1ycf h ASP 275 Ca 0.35 -0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.24 1ycf h ASP 275 Cb -0.07 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 1ycf h ASP 275 CO -0.10 0.75 -0.23 1.23 -1.72 0.00 0.00 179.24 179.17 1ycf h GLY 276 N 1.19 1.00 0.86 2.75 0.00 -1.00 -1.73 103.07 106.14 1ycf h GLY 276 Ca 0.32 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1ycf h GLY 276 CO -0.07 0.83 -0.09 1.41 0.00 0.00 0.00 176.54 178.62 1ycf h LEU 277 N 0.75 -0.22 -0.89 3.11 3.38 -1.04 -0.91 115.31 119.49 1ycf h LEU 277 Ca 0.09 -0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1ycf h LEU 277 Cb 0.80 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.54 1ycf h LEU 277 CO 0.07 -0.03 0.55 0.58 0.09 0.00 0.00 178.44 179.70 1ycf h VAL 278 N -0.40 1.03 -0.31 1.22 2.07 -1.11 -1.78 116.25 116.97 1ycf h VAL 278 Ca -0.03 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1ycf h VAL 278 Cb 0.31 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1ycf h VAL 278 CO 0.04 0.18 0.18 0.00 0.02 0.00 0.00 177.57 177.99 1ycf h ALA 279 N 1.42 0.40 0.00 1.67 0.00 -1.14 -2.23 119.26 119.39 1ycf h ALA 279 Ca 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1ycf h ALA 279 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ycf h ALA 279 CO -0.18 -0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.40 1ycf n GLY 280 N -0.99 -0.42 0.00 0.00 0.00 -0.36 -4.83 105.19 98.59 1ycf n GLY 280 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1ycf n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ycf n GLY 281 N -0.26 0.63 3.88 -0.02 0.00 -0.84 -4.68 105.19 103.90 1ycf n GLY 281 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1ycf n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ycf s GLU 283 N -2.27 4.57 0.03 0.00 2.12 -1.08 -3.65 118.70 118.42 1ycf s GLU 283 Ca 0.36 1.17 0.08 0.00 0.36 0.00 0.00 54.97 56.94 1ycf s GLU 283 Cb -0.13 -3.23 -0.02 0.00 0.26 0.00 0.00 34.13 31.01 1ycf s GLU 283 CO 0.21 0.55 -0.22 0.08 -0.54 0.00 0.00 175.26 175.34 1ycf s VAL 284 N -1.19 1.78 -0.22 3.70 1.01 -1.26 -0.52 120.40 123.71 1ycf s VAL 284 Ca 0.37 -1.17 0.01 0.00 0.00 0.00 0.00 61.98 61.20 1ycf s VAL 284 Cb -0.23 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.67 1ycf s VAL 284 CO 0.26 0.31 -0.15 -0.54 0.00 0.00 0.00 175.10 174.98 1ycf s LYS 285 N -1.01 2.71 -0.18 2.72 -0.14 -0.65 -4.99 119.74 118.20 1ycf s LYS 285 Ca 0.09 -1.03 -0.11 0.00 -1.36 0.00 0.00 55.97 53.56 1ycf s LYS 285 Cb -0.09 -2.72 -0.05 0.00 -1.68 0.00 0.00 37.83 33.29 1ycf s LYS 285 CO 0.01 -0.36 0.18 -1.17 -0.76 0.00 0.00 175.35 173.26 1ycf s LEU 286 N 1.23 4.24 -0.18 3.17 0.20 -1.26 -0.94 118.68 125.13 1ycf s LEU 286 Ca -0.00 0.34 -0.02 0.00 0.69 0.00 0.00 54.13 55.14 1ycf s LEU 286 Cb -0.16 -2.18 0.05 0.00 -0.43 0.00 0.00 46.19 43.47 1ycf s LEU 286 CO -0.09 0.18 0.01 -0.36 -0.29 0.00 0.00 176.35 175.79 1ycf s PHE 287 N 0.27 1.29 -0.70 5.38 0.08 0.27 -4.99 117.98 119.58 1ycf s PHE 287 Ca 0.11 -0.95 -0.25 0.00 0.12 0.00 0.00 56.93 55.96 1ycf s PHE 287 Cb -0.12 -1.13 0.05 0.00 -0.57 0.00 0.00 43.02 41.25 1ycf s PHE 287 CO 0.00 -0.61 1.13 0.21 -0.10 0.00 0.00 175.22 175.85 1ycf s LYS 288 N 1.77 3.15 0.38 0.44 2.20 -1.26 -1.22 119.74 125.20 1ycf s LYS 288 Ca -0.01 -0.53 0.20 0.00 -0.36 0.00 0.00 55.97 55.27 1ycf s LYS 288 Cb -0.17 -4.21 1.20 0.00 -1.51 0.00 0.00 37.83 33.15 1ycf s LYS 288 CO -0.07 -1.99 1.66 -0.07 -0.36 0.00 0.00 175.35 174.52 1ycf h LEU 289 N 12.21 0.42 -1.00 5.43 3.38 -1.30 0.70 115.31 135.15 1ycf h LEU 289 Ca -0.28 0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1ycf h LEU 289 Cb 1.06 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ycf h LEU 289 CO 1.23 -0.14 0.00 -1.54 0.09 0.00 0.00 178.44 178.08 1ycf n SER 290 N -4.91 0.59 -0.78 -0.43 3.41 -1.26 -2.42 113.62 107.81 1ycf n SER 290 Ca 0.33 0.70 0.05 0.00 -0.26 0.00 0.00 58.87 59.69 1ycf n SER 290 Cb 1.12 -0.80 0.13 0.00 -0.26 0.00 0.00 64.21 64.39 1ycf n SER 290 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1ycf n VAL 291 N -2.21 1.32 -4.17 -3.33 0.24 0.23 -5.06 118.33 105.34 1ycf n VAL 291 Ca 0.00 -2.15 -0.14 0.00 -2.04 0.00 0.00 64.34 60.01 1ycf n VAL 291 Cb 0.13 0.19 -0.11 0.00 -1.47 0.00 0.00 33.84 32.59 1ycf n VAL 291 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1ycf s SER 292 N -2.62 1.39 -0.48 -1.34 0.01 -1.02 -4.93 113.70 104.72 1ycf s SER 292 Ca 0.33 -0.82 -0.25 0.00 1.31 0.00 0.00 55.95 56.52 1ycf s SER 292 Cb 0.33 0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.61 1ycf s SER 292 CO -0.08 -0.28 0.90 -0.62 0.41 0.00 0.00 173.24 173.57 1ycf s ASP 293 N -2.48 6.45 0.31 2.44 3.68 -1.26 -4.93 116.67 120.88 1ycf s ASP 293 Ca 0.05 -0.03 0.08 0.00 2.13 0.00 0.00 52.55 54.78 1ycf s ASP 293 Cb -0.02 -2.43 0.87 0.00 -1.45 0.00 0.00 42.92 39.89 1ycf s ASP 293 CO -0.00 -1.06 1.67 -0.09 0.13 0.00 0.00 175.17 175.81 1ycf h ARG 294 N 9.11 0.32 -0.40 4.34 2.43 -1.98 0.56 114.38 128.76 1ycf h ARG 294 Ca -0.25 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 58.86 1ycf h ARG 294 Cb 1.08 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1ycf h ARG 294 CO 1.03 0.21 0.06 -0.91 -1.51 0.00 0.00 179.97 178.84 1ycf h ASN 295 N 0.33 0.57 0.13 -3.80 2.35 -1.91 0.51 115.58 113.75 1ycf h ASN 295 Ca 0.63 -0.10 -0.24 0.00 -0.55 0.00 0.00 56.30 56.04 1ycf h ASN 295 Cb 1.32 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 39.56 1ycf h ASN 295 CO -0.60 0.60 -0.97 0.44 -1.65 0.00 0.00 177.43 175.25 1ycf h ASP 296 N 0.59 0.75 -0.20 5.81 3.32 -0.40 -0.63 116.42 125.65 1ycf h ASP 296 Ca 0.13 -0.59 0.02 0.00 0.02 0.00 0.00 57.03 56.61 1ycf h ASP 296 Cb 0.29 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1ycf h ASP 296 CO 0.00 1.39 0.06 0.58 -1.72 0.00 0.00 179.24 179.55 1ycf h VAL 297 N 0.34 0.94 -0.16 -1.35 2.07 -0.38 -1.79 116.25 115.92 1ycf h VAL 297 Ca -0.10 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 1ycf h VAL 297 Cb 1.61 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1ycf h VAL 297 CO 0.18 0.03 -0.13 0.40 0.02 0.00 0.00 177.57 178.07 1ycf h ILE 298 N 0.15 1.18 -0.43 4.57 2.04 -0.87 -2.11 117.51 122.04 1ycf h ILE 298 Ca 0.09 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 1ycf h ILE 298 Cb 0.07 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1ycf h ILE 298 CO -0.10 0.25 0.26 0.50 0.00 0.00 0.00 178.15 179.06 1ycf h LYS 299 N 0.24 0.59 -0.53 2.37 3.64 -0.30 -2.53 116.57 120.05 1ycf h LYS 299 Ca 0.05 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1ycf h LYS 299 Cb 0.38 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1ycf h LYS 299 CO 0.02 0.43 0.17 0.93 -2.27 0.00 0.00 179.45 178.74 1ycf h GLU 300 N 0.57 0.79 0.00 1.90 4.39 -0.85 -2.68 114.58 118.70 1ycf h GLU 300 Ca 0.16 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 1ycf h GLU 300 Cb -0.00 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1ycf h GLU 300 CO -0.03 0.68 -0.02 0.82 -1.16 0.00 0.00 179.01 179.30 1ycf h ILE 301 N 0.77 0.38 0.45 3.13 2.04 -0.96 -2.94 117.51 120.39 1ycf h ILE 301 Ca 0.18 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 1ycf h ILE 301 Cb 0.22 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1ycf h ILE 301 CO -0.01 0.02 -0.33 0.25 0.00 0.00 0.00 178.15 178.08 1ycf h LEU 302 N 0.00 -0.85 -0.72 1.44 5.85 -1.37 -3.10 115.31 116.56 1ycf h LEU 302 Ca -0.00 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1ycf h LEU 302 Cb 0.07 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 1ycf h LEU 302 CO 0.00 -0.48 0.47 0.44 -0.34 0.00 0.00 178.44 178.54 1ycf h ASP 303 N -0.75 0.81 -2.48 1.25 3.32 -1.74 -3.45 116.42 113.38 1ycf h ASP 303 Ca -0.06 -0.02 -0.61 0.00 0.02 0.00 0.00 57.03 56.37 1ycf h ASP 303 Cb 0.61 -0.20 0.10 0.00 0.22 0.00 0.00 39.33 40.06 1ycf h ASP 303 CO 0.03 0.58 0.29 0.00 -1.72 0.00 0.00 179.24 178.42 1ycf n ALA 304 N -2.30 0.05 -0.01 3.45 0.00 -1.11 -0.06 120.51 120.53 1ycf n ALA 304 Ca 0.07 0.41 0.04 0.00 0.00 0.00 0.00 53.44 53.95 1ycf n ALA 304 Cb 0.03 -2.09 -0.13 0.00 0.00 0.00 0.00 19.45 17.26 1ycf n ALA 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ycf n ARG 305 N 1.17 0.65 -5.29 0.00 1.74 0.38 -4.75 116.66 110.56 1ycf n ARG 305 Ca 0.11 -0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.85 1ycf n ARG 305 Cb 0.31 -1.62 -0.16 0.00 -1.02 0.00 0.00 32.46 29.97 1ycf n ARG 305 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ycf s ALA 306 N -3.12 2.15 -0.16 7.54 0.00 -1.04 -1.31 121.76 125.82 1ycf s ALA 306 Ca -0.07 -1.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 1ycf s ALA 306 Cb 0.10 -0.57 0.05 0.00 0.00 0.00 0.00 23.12 22.70 1ycf s ALA 306 CO 0.86 0.51 -0.01 0.08 0.00 0.00 0.00 175.76 177.19 1ycf s VAL 307 N -0.53 0.78 -0.09 0.00 1.01 0.21 -1.06 120.40 120.72 1ycf s VAL 307 Ca 0.08 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1ycf s VAL 307 Cb -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.21 1ycf s VAL 307 CO -0.00 0.02 -0.17 -1.48 0.00 0.00 0.00 175.10 173.47 1ycf s LEU 308 N 1.77 1.83 -0.08 3.92 2.34 -0.59 -2.28 118.68 125.58 1ycf s LEU 308 Ca 0.01 -0.42 0.04 0.00 0.06 0.00 0.00 54.13 53.81 1ycf s LEU 308 Cb -0.15 -1.10 -0.01 0.00 -0.56 0.00 0.00 46.19 44.36 1ycf s LEU 308 CO -0.07 0.08 -0.20 -0.69 -1.06 0.00 0.00 176.35 174.40 1ycf s VAL 309 N 0.62 2.47 0.05 1.48 1.01 -0.86 -1.60 120.40 123.58 1ycf s VAL 309 Ca -0.14 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.00 1ycf s VAL 309 Cb -0.16 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1ycf s VAL 309 CO 0.04 0.56 -0.16 -0.83 0.00 0.00 0.00 175.10 174.72 1ycf s GLY 310 N -0.00 0.89 -0.17 4.51 0.00 -0.60 -2.91 107.32 109.05 1ycf s GLY 310 Ca -0.07 -0.93 -0.28 0.00 0.00 0.00 0.00 44.72 43.44 1ycf s GLY 310 CO 0.05 -0.92 0.70 -0.45 0.00 0.00 0.00 173.10 172.48 1ycf s SER 311 N -1.36 -0.71 1.06 1.64 0.15 -0.72 -2.65 113.70 111.12 1ycf s SER 311 Ca 0.02 1.11 -0.11 0.00 0.70 0.00 0.00 55.95 57.68 1ycf s SER 311 Cb -0.09 1.04 0.15 0.00 -1.71 0.00 0.00 66.02 65.42 1ycf s SER 311 CO 0.02 -0.41 0.72 -2.65 1.20 0.00 0.00 173.24 172.12 1ycf n PRO 312 N 1.88 -1.42 -3.88 5.44 -0.02 -1.26 -4.02 135.00 131.72 1ycf n PRO 312 Ca -0.16 -1.13 -0.35 0.00 -2.02 0.00 0.00 63.50 59.83 1ycf n PRO 312 Cb 0.56 -0.88 -0.14 0.00 -0.02 0.00 0.00 33.50 33.03 1ycf n PRO 312 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ycf s THR 313 N -2.48 3.64 -0.07 3.45 2.01 -0.87 -4.27 115.64 117.05 1ycf s THR 313 Ca 0.43 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1ycf s THR 313 Cb -0.02 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 69.82 1ycf s THR 313 CO 0.32 0.40 -0.19 -0.51 -0.69 0.00 0.00 174.62 173.95 1ycf s ILE 314 N 1.48 1.61 -1.73 1.82 2.07 -1.08 -4.75 121.20 120.61 1ycf s ILE 314 Ca 0.06 -0.77 -0.17 0.00 -1.41 0.00 0.00 60.65 58.35 1ycf s ILE 314 Cb -0.14 -1.40 0.16 0.00 0.13 0.00 0.00 42.46 41.20 1ycf s ILE 314 CO -0.01 0.46 0.62 0.59 -1.91 0.00 0.00 174.94 174.68 1ycf n ASN 315 N 3.47 -2.13 0.00 4.50 3.02 -1.26 -0.50 115.26 122.35 1ycf n ASN 315 Ca -0.20 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 1ycf n ASN 315 Cb 0.52 -2.26 0.00 0.00 -0.61 0.00 0.00 39.78 37.43 1ycf n ASN 315 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ycf n ASN 316 N -2.64 0.00 0.00 6.41 3.02 -1.26 -4.91 115.26 115.88 1ycf n ASN 316 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1ycf n ASN 316 Cb 0.51 -0.76 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1ycf n ASN 316 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ycf n ASP 317 N 0.00 0.38 -4.85 6.41 -0.08 0.34 -4.31 116.55 114.44 1ycf n ASP 317 Ca 0.00 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.07 1ycf n ASP 317 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 1ycf n ASP 317 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1ycf s ILE 318 N 2.11 2.79 -0.08 5.18 1.01 -1.26 -2.64 121.20 128.31 1ycf s ILE 318 Ca 0.00 -1.41 -0.30 0.00 0.00 0.00 0.00 60.65 58.95 1ycf s ILE 318 Cb 0.00 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 1ycf s ILE 318 CO 0.00 -0.04 1.34 -0.22 0.00 0.00 0.00 174.94 176.02 1ycf s LEU 319 N -4.07 4.26 0.52 2.97 2.96 -1.26 -4.65 118.68 119.41 1ycf s LEU 319 Ca 0.46 1.90 0.31 0.00 -0.22 0.00 0.00 54.13 56.58 1ycf s LEU 319 Cb -0.03 -3.55 1.46 0.00 0.50 0.00 0.00 46.19 44.57 1ycf s LEU 319 CO 0.27 -0.73 1.86 -0.65 -1.32 0.00 0.00 176.35 175.77 1ycf h PRO 320 N 8.13 0.05 0.00 0.98 0.11 -1.97 0.12 132.00 139.42 1ycf h PRO 320 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1ycf h PRO 320 Cb 1.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1ycf h PRO 320 CO 0.93 0.03 0.00 0.28 -0.21 0.00 0.00 178.00 179.03 1ycf n VAL 321 N -4.28 1.00 0.32 3.15 0.31 -1.26 -2.23 118.33 115.33 1ycf n VAL 321 Ca 0.21 0.46 0.11 0.00 -0.01 0.00 0.00 64.34 65.11 1ycf n VAL 321 Cb 1.02 -1.42 -0.07 0.00 -0.91 0.00 0.00 33.84 32.47 1ycf n VAL 321 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1ycf n VAL 322 N -2.16 0.16 0.16 2.52 0.31 0.43 -4.51 118.33 115.24 1ycf n VAL 322 Ca 0.01 -0.37 -0.14 0.00 -0.01 0.00 0.00 64.34 63.83 1ycf n VAL 322 Cb 0.13 0.12 -0.06 0.00 -0.91 0.00 0.00 33.84 33.12 1ycf n VAL 322 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1ycf h SER 323 N 0.00 -0.74 -0.64 4.52 0.02 -1.52 -2.87 113.55 112.32 1ycf h SER 323 Ca 0.00 0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.13 1ycf h SER 323 Cb 0.85 0.27 -0.12 0.00 0.14 0.00 0.00 62.40 63.54 1ycf h SER 323 CO 0.00 -0.38 -0.38 -0.65 -1.14 0.00 0.00 176.83 174.28 1ycf h PRO 324 N -0.54 -0.16 -0.74 3.45 0.11 -1.79 0.89 132.00 133.22 1ycf h PRO 324 Ca 0.01 0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.17 1ycf h PRO 324 Cb 0.52 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.63 1ycf h PRO 324 CO -0.09 -0.11 0.48 1.25 -0.21 0.00 0.00 178.00 179.33 1ycf h LEU 325 N -0.16 0.75 -0.18 2.35 7.12 -1.82 0.59 115.31 123.96 1ycf h LEU 325 Ca 0.23 -0.01 -0.06 0.00 0.13 0.00 0.00 57.88 58.17 1ycf h LEU 325 Cb 0.56 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 40.52 1ycf h LEU 325 CO -0.72 0.51 -0.14 -0.07 -0.13 0.00 0.00 178.44 177.89 1ycf h LEU 326 N 0.87 0.43 -0.63 2.25 3.38 -0.68 -2.09 115.31 118.83 1ycf h LEU 326 Ca 0.30 -0.46 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 1ycf h LEU 326 Cb 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1ycf h LEU 326 CO -0.09 0.80 -0.63 0.44 0.09 0.00 0.00 178.44 179.05 1ycf h ASP 327 N 0.07 0.24 -0.59 -0.43 3.32 -0.78 -2.36 116.42 115.90 1ycf h ASP 327 Ca 0.03 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1ycf h ASP 327 Cb 0.66 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1ycf h ASP 327 CO 0.04 0.81 0.30 -0.78 -1.72 0.00 0.00 179.24 177.88 1ycf h ASP 328 N 0.15 0.76 -0.56 6.45 1.82 -0.85 -2.34 116.42 121.85 1ycf h ASP 328 Ca -0.01 -0.11 -0.09 0.00 -0.39 0.00 0.00 57.03 56.43 1ycf h ASP 328 Cb 1.14 -0.19 -0.02 0.00 0.68 0.00 0.00 39.33 40.93 1ycf h ASP 328 CO 0.10 0.66 0.02 -0.07 -1.61 0.00 0.00 179.24 178.33 1ycf h LEU 329 N 0.80 0.98 -0.09 2.28 3.38 -1.25 0.42 115.31 121.83 1ycf h LEU 329 Ca 0.21 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1ycf h LEU 329 Cb 0.09 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1ycf h LEU 329 CO -0.03 1.02 -0.13 0.58 0.09 0.00 0.00 178.44 179.97 1ycf h VAL 330 N 0.93 0.65 -0.46 1.22 2.07 -1.03 -2.17 116.25 117.46 1ycf h VAL 330 Ca 0.17 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.57 1ycf h VAL 330 Cb 0.51 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1ycf h VAL 330 CO 0.02 0.00 -0.18 1.23 0.02 0.00 0.00 177.57 178.66 1ycf h GLY 331 N -0.17 0.97 1.88 2.17 0.00 -1.23 -3.10 103.07 103.59 1ycf h GLY 331 Ca 0.08 -0.82 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1ycf h GLY 331 CO -0.19 0.75 0.00 1.04 0.00 0.00 0.00 176.54 178.14 1ycf n LEU 332 N -4.12 0.00 -4.06 3.11 4.77 0.12 -4.78 117.00 112.04 1ycf n LEU 332 Ca 0.01 0.44 -0.45 0.00 -0.03 0.00 0.00 56.01 55.97 1ycf n LEU 332 Cb 0.43 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1ycf n LEU 332 CO 0.45 -0.14 -0.17 0.54 -1.33 0.00 0.00 177.39 176.73 1ycf n ARG 333 N -1.44 -0.34 -1.35 3.23 5.12 -0.84 -1.89 116.66 119.15 1ycf n ARG 333 Ca 0.06 0.13 -0.37 0.00 -1.93 0.00 0.00 57.85 55.74 1ycf n ARG 333 Cb 0.21 -2.46 0.04 0.00 -1.16 0.00 0.00 32.46 29.09 1ycf n ARG 333 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1ycf n PRO 334 N -4.85 0.35 -4.64 5.56 -0.02 -1.26 -4.61 135.00 125.52 1ycf n PRO 334 Ca -0.13 0.14 -0.33 0.00 -2.02 0.00 0.00 63.50 61.16 1ycf n PRO 334 Cb 0.57 -1.61 -0.13 0.00 -0.02 0.00 0.00 33.50 32.31 1ycf n PRO 334 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ycf s LYS 335 N -2.15 3.20 -1.02 -0.52 2.20 -1.26 -4.73 119.74 115.46 1ycf s LYS 335 Ca 0.65 -0.60 -0.11 0.00 -0.36 0.00 0.00 55.97 55.54 1ycf s LYS 335 Cb -0.41 -2.67 -0.03 0.00 -1.51 0.00 0.00 37.83 33.21 1ycf s LYS 335 CO 0.58 0.39 0.81 -1.71 -0.36 0.00 0.00 175.35 175.06 1ycf n ASN 336 N 3.05 -6.15 -4.14 1.43 5.15 -1.26 -4.92 115.26 108.42 1ycf n ASN 336 Ca -0.18 -0.76 -0.24 0.00 -0.60 0.00 0.00 54.58 52.81 1ycf n ASN 336 Cb 0.53 -4.17 -0.15 0.00 -0.53 0.00 0.00 39.78 35.46 1ycf n ASN 336 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1ycf s LYS 337 N -4.89 1.31 0.03 1.20 -0.14 -1.26 -4.88 119.74 111.11 1ycf s LYS 337 Ca 0.36 -0.58 0.02 0.00 -1.36 0.00 0.00 55.97 54.41 1ycf s LYS 337 Cb -0.09 -1.27 -0.04 0.00 -1.68 0.00 0.00 37.83 34.75 1ycf s LYS 337 CO 0.81 0.35 0.01 0.08 -0.76 0.00 0.00 175.35 175.84 1ycf s VAL 338 N -0.39 4.19 0.31 3.17 1.01 -0.42 -1.84 120.40 126.42 1ycf s VAL 338 Ca 0.06 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.27 1ycf s VAL 338 Cb -0.06 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1ycf s VAL 338 CO -0.01 0.28 0.47 -0.83 0.00 0.00 0.00 175.10 175.01 1ycf s GLY 339 N -1.86 1.13 -0.03 4.51 0.00 -0.53 -0.62 107.32 109.92 1ycf s GLY 339 Ca 0.22 -1.29 -0.16 0.00 0.00 0.00 0.00 44.72 43.50 1ycf s GLY 339 CO 0.14 -0.87 0.34 -2.27 0.00 0.00 0.00 173.10 170.44 1ycf s LEU 340 N -3.15 0.71 0.16 0.66 2.96 -0.97 0.54 118.68 119.58 1ycf s LEU 340 Ca 0.28 0.21 0.09 0.00 -0.22 0.00 0.00 54.13 54.49 1ycf s LEU 340 Cb -0.00 1.36 -0.04 0.00 0.50 0.00 0.00 46.19 48.01 1ycf s LEU 340 CO 0.16 -0.42 -0.13 0.00 -1.32 0.00 0.00 176.35 174.64 1ycf s ALA 341 N -1.13 2.85 0.17 5.97 0.00 -1.26 -2.03 121.76 126.32 1ycf s ALA 341 Ca -0.12 -1.42 -0.24 0.00 0.00 0.00 0.00 51.96 50.18 1ycf s ALA 341 Cb -0.05 -0.71 0.06 0.00 0.00 0.00 0.00 23.12 22.43 1ycf s ALA 341 CO 0.04 0.52 0.76 -0.59 0.00 0.00 0.00 175.76 176.49 1ycf s PHE 342 N -1.50 -0.32 0.00 0.00 -0.12 -1.14 -3.29 117.98 111.61 1ycf s PHE 342 Ca 0.22 0.02 0.00 0.00 -0.05 0.00 0.00 56.93 57.13 1ycf s PHE 342 Cb -0.09 0.62 0.00 0.00 -0.63 0.00 0.00 43.02 42.91 1ycf s PHE 342 CO 0.13 -0.92 0.00 0.41 -0.05 0.00 0.00 175.22 174.80 1ycf n GLY 343 N -0.40 -0.40 3.70 1.99 0.00 -1.04 -1.75 105.19 107.29 1ycf n GLY 343 Ca -0.09 -1.14 -0.29 0.00 0.00 0.00 0.00 46.02 44.49 1ycf n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ycf s ALA 344 N -2.00 3.62 0.03 4.61 0.00 -1.26 -1.56 121.76 125.20 1ycf s ALA 344 Ca 0.00 -1.54 -0.28 0.00 0.00 0.00 0.00 51.96 50.14 1ycf s ALA 344 Cb 0.00 0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.23 1ycf s ALA 344 CO 0.00 -0.10 0.91 1.52 0.00 0.00 0.00 175.76 178.09 1ycf s TYR 345 N -2.76 -0.29 -0.19 0.00 -0.85 -0.20 -2.06 117.35 111.00 1ycf s TYR 345 Ca 0.25 0.11 0.11 0.00 -0.52 0.00 0.00 57.07 57.02 1ycf s TYR 345 Cb 0.06 0.56 -0.23 0.00 0.38 0.00 0.00 41.96 42.73 1ycf s TYR 345 CO 0.13 -0.61 0.08 0.41 -1.52 0.00 0.00 175.55 174.04 1ycf n GLY 346 N -0.30 -0.79 1.06 5.49 0.00 -1.26 0.57 105.19 109.96 1ycf n GLY 346 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1ycf n GLY 346 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1ycf n TRP 347 N -2.98 -0.25 -0.08 1.61 2.14 -1.26 -4.76 117.44 111.85 1ycf n TRP 347 Ca -0.35 0.00 -0.15 0.00 2.07 0.00 0.00 57.50 59.07 1ycf n TRP 347 Cb 1.09 0.27 -0.13 0.00 -0.81 0.00 0.00 31.31 31.73 1ycf n TRP 347 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 1ycf h GLY 348 N 0.00 0.00 0.00 -1.67 0.00 -2.01 -3.51 103.07 95.89 1ycf h GLY 348 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ycf h GLY 348 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1ycf n GLY 349 N 1.58 -1.37 0.00 4.60 0.00 -1.26 -5.00 105.19 103.74 1ycf n GLY 349 Ca -0.14 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1ycf n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ycf n GLY 350 N 0.00 0.60 0.07 -0.02 0.00 -1.26 -4.60 105.19 99.97 1ycf n GLY 350 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1ycf n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ycf h ALA 351 N 0.00 0.45 -0.30 4.61 0.00 -1.75 -3.33 119.26 118.94 1ycf h ALA 351 Ca 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 54.91 53.84 1ycf h ALA 351 Cb 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1ycf h ALA 351 CO 0.00 1.30 -0.05 0.37 0.00 0.00 0.00 179.25 180.87 1ycf h GLN 352 N 0.00 0.48 -0.09 0.00 5.75 -1.91 -0.08 115.11 119.26 1ycf h GLN 352 Ca -0.07 -0.11 -0.17 0.00 -0.15 0.00 0.00 58.65 58.15 1ycf h GLN 352 Cb 1.81 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 30.30 1ycf h GLN 352 CO 0.12 0.55 -0.61 1.57 -2.65 0.00 0.00 178.83 177.81 1ycf h LYS 353 N 0.45 0.57 0.31 1.69 2.10 -1.98 -0.70 116.57 119.01 1ycf h LYS 353 Ca 0.09 -0.49 -0.02 0.00 -2.00 0.00 0.00 60.65 58.24 1ycf h LYS 353 Cb 0.38 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.82 1ycf h LYS 353 CO 0.02 1.12 -0.15 0.82 -2.00 0.00 0.00 179.45 179.25 1ycf h ILE 354 N 0.18 0.71 -0.69 0.07 2.04 -1.63 1.04 117.51 119.22 1ycf h ILE 354 Ca -0.05 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.75 1ycf h ILE 354 Cb 1.26 0.81 -0.09 0.00 -0.74 0.00 0.00 36.82 38.07 1ycf h ILE 354 CO 0.12 0.04 0.25 -0.07 0.00 0.00 0.00 178.15 178.50 1ycf h LEU 355 N -0.52 0.23 -0.62 1.44 3.38 -1.07 -0.19 115.31 117.96 1ycf h LEU 355 Ca -0.04 0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 1ycf h LEU 355 Cb 0.39 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1ycf h LEU 355 CO 0.07 0.11 -0.65 -0.33 0.09 0.00 0.00 178.44 177.72 1ycf h GLU 356 N 0.41 0.15 0.11 1.13 5.08 -0.58 -1.27 114.58 119.61 1ycf h GLU 356 Ca 0.37 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1ycf h GLU 356 Cb 0.52 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1ycf h GLU 356 CO -0.37 0.75 -0.05 1.05 -1.00 0.00 0.00 179.01 179.39 1ycf h GLU 357 N 0.11 -0.14 -0.67 2.33 4.11 0.20 -2.09 114.58 118.43 1ycf h GLU 357 Ca -0.01 0.01 0.07 0.00 0.07 0.00 0.00 59.36 59.49 1ycf h GLU 357 Cb 1.17 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.39 1ycf h GLU 357 CO 0.10 0.33 0.36 0.00 0.07 0.00 0.00 179.01 179.87 1ycf h ARG 358 N -0.71 0.64 -0.34 1.06 2.47 -1.13 0.26 114.38 116.63 1ycf h ARG 358 Ca -0.01 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1ycf h ARG 358 Cb 0.54 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.70 1ycf h ARG 358 CO 0.02 0.42 0.20 -0.07 0.56 0.00 0.00 179.97 181.11 1ycf h LEU 359 N 0.66 0.40 -0.01 3.04 3.38 -1.25 -0.75 115.31 120.79 1ycf h LEU 359 Ca 0.31 -0.02 -0.24 0.00 0.09 0.00 0.00 57.88 58.02 1ycf h LEU 359 Cb 0.22 -0.10 0.02 0.00 0.09 0.00 0.00 40.66 40.89 1ycf h LEU 359 CO -0.20 0.32 -0.94 0.11 0.09 0.00 0.00 178.44 177.82 1ycf h LYS 360 N 0.47 0.65 -0.40 1.13 1.57 -0.34 -2.22 116.57 117.43 1ycf h LYS 360 Ca 0.12 -0.69 0.06 0.00 -1.87 0.00 0.00 60.65 58.28 1ycf h LYS 360 Cb -0.01 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1ycf h LYS 360 CO -0.02 1.28 0.27 0.00 -0.57 0.00 0.00 179.45 180.41 1ycf h ALA 361 N 0.39 2.02 0.00 3.86 0.00 0.38 0.56 119.26 126.46 1ycf h ALA 361 Ca -0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ycf h ALA 361 Cb 1.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1ycf h ALA 361 CO 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.34 1ycf n ALA 362 N -2.53 2.42 -1.60 0.00 0.00 -0.38 -4.84 120.51 113.57 1ycf n ALA 362 Ca 0.05 -0.15 -0.08 0.00 0.00 0.00 0.00 53.44 53.26 1ycf n ALA 362 Cb 0.27 -1.39 -0.02 0.00 0.00 0.00 0.00 19.45 18.31 1ycf n ALA 362 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ycf n LYS 363 N -0.98 -0.58 -3.18 0.00 5.02 0.20 -4.09 118.16 114.55 1ycf n LYS 363 Ca 0.18 0.61 -0.39 0.00 -2.02 0.00 0.00 58.31 56.69 1ycf n LYS 363 Cb 0.08 -4.49 -0.05 0.00 -0.02 0.00 0.00 35.03 30.55 1ycf n LYS 363 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ycf s ILE 364 N -2.33 5.11 -0.57 -0.18 1.01 -0.84 -4.75 121.20 118.65 1ycf s ILE 364 Ca 0.00 1.19 -0.27 0.00 0.00 0.00 0.00 60.65 61.58 1ycf s ILE 364 Cb 0.00 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.58 1ycf s ILE 364 CO 0.00 0.28 1.10 -0.70 0.00 0.00 0.00 174.94 175.62 1ycf s GLU 365 N 0.81 3.44 0.03 2.79 2.12 -0.77 -4.33 118.70 122.79 1ycf s GLU 365 Ca 0.31 0.05 -0.31 0.00 0.36 0.00 0.00 54.97 55.38 1ycf s GLU 365 Cb -0.16 -4.03 -0.10 0.00 0.26 0.00 0.00 34.13 30.09 1ycf s GLU 365 CO 0.14 -1.62 1.91 1.28 -0.54 0.00 0.00 175.26 176.43 1ycf n LEU 366 N 8.11 3.94 0.00 2.70 4.77 -1.26 -1.45 117.00 133.80 1ycf n LEU 366 Ca 0.06 0.94 0.08 0.00 -0.03 0.00 0.00 56.01 57.06 1ycf n LEU 366 Cb 0.48 -1.49 0.42 0.00 -2.33 0.00 0.00 43.42 40.50 1ycf n LEU 366 CO 0.69 0.12 0.72 0.00 -1.33 0.00 0.00 177.39 177.59 1ycf n ILE 367 N 5.22 0.45 -2.66 -0.08 0.13 0.19 -4.30 119.36 118.31 1ycf n ILE 367 Ca 0.20 0.11 -0.02 0.00 -1.10 0.00 0.00 62.75 61.94 1ycf n ILE 367 Cb 0.37 -0.85 0.03 0.00 -0.84 0.00 0.00 39.64 38.35 1ycf n ILE 367 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ycf s ALA 368 N -2.47 -4.86 0.00 1.51 0.00 -1.26 -5.04 121.76 109.64 1ycf s ALA 368 Ca 0.17 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1ycf s ALA 368 Cb 0.11 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1ycf s ALA 368 CO 0.23 -2.57 0.00 -1.91 0.00 0.00 0.00 175.76 171.51 1ycf n GLU 369 N 2.71 0.00 -1.81 0.00 4.07 -1.26 -3.11 120.64 121.24 1ycf n GLU 369 Ca 0.10 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.80 1ycf n GLU 369 Cb 0.66 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.01 1ycf n GLU 369 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1ycf s PRO 370 N 0.00 2.66 1.02 5.31 0.02 -1.26 -4.82 135.00 137.93 1ycf s PRO 370 Ca 0.00 1.23 -0.15 0.00 0.02 0.00 0.00 61.00 62.11 1ycf s PRO 370 Cb 0.00 -4.41 0.20 0.00 0.02 0.00 0.00 34.50 30.31 1ycf s PRO 370 CO 0.00 -2.66 1.14 0.20 -0.33 0.00 0.00 177.00 175.35 1ycf s GLY 371 N 9.11 1.60 -0.03 0.52 0.00 -1.18 -4.92 107.32 112.42 1ycf s GLY 371 Ca 0.84 -0.70 -0.36 0.00 0.00 0.00 0.00 44.72 44.50 1ycf s GLY 371 CO 0.27 -0.01 1.67 -1.05 0.00 0.00 0.00 173.10 173.98 1ycf n PRO 372 N -4.15 1.76 -4.45 2.90 -0.02 -1.21 -4.87 135.00 124.96 1ycf n PRO 372 Ca 0.09 0.64 -0.20 0.00 -2.02 0.00 0.00 63.50 62.01 1ycf n PRO 372 Cb 0.59 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 1ycf n PRO 372 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ycf s THR 373 N 2.42 1.03 0.03 3.45 2.01 -1.26 -2.51 115.64 120.81 1ycf s THR 373 Ca 0.89 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 62.17 1ycf s THR 373 Cb -0.82 -0.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.78 1ycf s THR 373 CO 0.50 0.14 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.76 1ycf s VAL 374 N -0.57 0.88 -0.21 3.82 1.01 -0.60 -5.00 120.40 119.72 1ycf s VAL 374 Ca 0.03 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 1ycf s VAL 374 Cb -0.06 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 1ycf s VAL 374 CO 0.00 -0.06 0.05 -1.58 0.00 0.00 0.00 175.10 173.50 1ycf s GLN 375 N -1.08 3.74 0.00 2.72 0.74 -1.26 -1.04 119.66 123.48 1ycf s GLN 375 Ca -0.01 -0.45 0.00 0.00 0.05 0.00 0.00 55.36 54.95 1ycf s GLN 375 Cb -0.07 -3.21 0.00 0.00 1.10 0.00 0.00 33.01 30.82 1ycf s GLN 375 CO 0.01 0.01 0.00 0.91 -0.55 0.00 0.00 175.29 175.67 1ycf n TRP 376 N 4.30 0.00 -4.08 1.67 5.03 0.19 -4.64 117.44 119.91 1ycf n TRP 376 Ca -0.17 0.00 -0.14 0.00 3.03 0.00 0.00 57.50 60.23 1ycf n TRP 376 Cb 0.52 0.00 -0.13 0.00 -1.03 0.00 0.00 31.31 30.67 1ycf n TRP 376 CO 0.00 0.00 0.00 0.08 -0.03 0.00 0.00 177.69 177.74 1ycf s VAL 377 N 0.00 0.40 0.42 -0.99 1.01 -1.26 -4.75 120.40 115.23 1ycf s VAL 377 Ca 0.00 -0.59 -0.25 0.00 0.00 0.00 0.00 61.98 61.13 1ycf s VAL 377 Cb 0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 36.38 35.89 1ycf s VAL 377 CO 0.00 -0.14 1.28 -2.84 0.00 0.00 0.00 175.10 173.40 1ycf s PRO 378 N -0.79 3.88 0.40 2.72 0.02 -1.26 -5.04 135.00 134.94 1ycf s PRO 378 Ca -0.04 2.09 0.08 0.00 0.02 0.00 0.00 61.00 63.15 1ycf s PRO 378 Cb -0.06 -2.67 -0.00 0.00 0.02 0.00 0.00 34.50 31.79 1ycf s PRO 378 CO -0.00 -0.54 0.51 1.03 -0.33 0.00 0.00 177.00 177.66 1ycf s ARG 379 N -2.35 2.80 0.37 5.54 0.52 -1.26 -4.92 118.95 119.65 1ycf s ARG 379 Ca 0.59 -1.27 0.05 0.00 -0.52 0.00 0.00 55.73 54.57 1ycf s ARG 379 Cb -0.37 -2.68 0.71 0.00 0.52 0.00 0.00 34.95 33.14 1ycf s ARG 379 CO 0.46 -0.19 1.99 0.78 0.02 0.00 0.00 175.30 178.36 1ycf h GLY 380 N 0.78 0.67 0.88 -3.53 0.00 -1.99 -0.57 103.07 99.31 1ycf h GLY 380 Ca -0.41 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 1ycf h GLY 380 CO 0.49 0.28 -0.32 0.83 0.00 0.00 0.00 176.54 177.83 1ycf h GLU 381 N 0.63 -0.77 -0.02 4.80 4.39 -1.99 -0.86 114.58 120.76 1ycf h GLU 381 Ca 0.16 0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.95 1ycf h GLU 381 Cb 0.05 0.18 -0.06 0.00 -0.10 0.00 0.00 28.75 28.82 1ycf h GLU 381 CO -0.02 -0.52 -0.39 -0.44 -1.16 0.00 0.00 179.01 176.48 1ycf h ASP 382 N -0.80 -1.18 -0.94 1.42 3.32 -1.75 -0.00 116.42 116.49 1ycf h ASP 382 Ca -0.06 0.15 0.12 0.00 0.02 0.00 0.00 57.03 57.25 1ycf h ASP 382 Cb 0.65 0.47 -0.07 0.00 0.22 0.00 0.00 39.33 40.59 1ycf h ASP 382 CO 0.07 -0.43 0.60 -0.07 -1.72 0.00 0.00 179.24 177.69 1ycf h LEU 383 N -0.53 0.82 -0.98 1.55 3.38 -1.06 0.38 115.31 118.87 1ycf h LEU 383 Ca 0.06 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1ycf h LEU 383 Cb 0.62 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1ycf h LEU 383 CO -0.31 0.45 0.39 -0.61 0.09 0.00 0.00 178.44 178.44 1ycf h GLN 384 N 0.88 1.12 0.52 1.13 5.75 0.10 -1.23 115.11 123.38 1ycf h GLN 384 Ca 0.45 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.79 1ycf h GLN 384 Cb 0.51 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 1ycf h GLN 384 CO -0.22 0.85 -0.42 -0.09 -2.65 0.00 0.00 178.83 176.30 1ycf h ARG 385 N 1.11 -0.89 -0.42 1.69 2.43 0.88 -2.06 114.38 117.11 1ycf h ARG 385 Ca 0.27 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.59 1ycf h ARG 385 Cb 0.09 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 29.76 1ycf h ARG 385 CO -0.04 -0.60 -0.23 0.00 -1.51 0.00 0.00 179.97 177.59 1ycf h TYR 387 N -0.15 -0.18 -0.86 0.00 3.20 -1.05 0.81 116.97 118.73 1ycf h TYR 387 Ca 0.20 0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.16 1ycf h TYR 387 Cb 0.47 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.85 1ycf h TYR 387 CO -0.47 -0.20 0.54 0.93 -1.64 0.00 0.00 178.16 177.32 1ycf h GLU 388 N 0.05 1.00 -0.63 1.82 5.08 -0.44 0.16 114.58 121.61 1ycf h GLU 388 Ca 0.27 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1ycf h GLU 388 Cb 0.43 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1ycf h GLU 388 CO -0.53 0.66 0.11 -0.07 -1.00 0.00 0.00 179.01 178.19 1ycf h LEU 389 N 1.03 0.96 -0.86 1.33 3.38 0.34 1.14 115.31 122.63 1ycf h LEU 389 Ca 0.36 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 1ycf h LEU 389 Cb 0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1ycf h LEU 389 CO -0.14 0.95 -0.49 1.23 0.09 0.00 0.00 178.44 180.08 1ycf h GLY 390 N 1.04 0.00 0.82 0.83 0.00 -0.55 0.71 103.07 105.92 1ycf h GLY 390 Ca 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.48 1ycf h GLY 390 CO 0.01 0.00 -0.06 -0.09 0.00 0.00 0.00 176.54 176.40 1ycf h ARG 391 N 0.00 0.43 0.01 4.80 9.65 0.85 -1.28 114.38 128.84 1ycf h ARG 391 Ca -0.00 -0.17 -0.00 0.00 -1.10 0.00 0.00 59.98 58.71 1ycf h ARG 391 Cb 0.98 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.54 1ycf h ARG 391 CO 0.06 0.67 -0.00 -0.22 2.80 0.00 0.00 179.97 183.28 1ycf h LYS 392 N 0.16 -0.01 -0.09 0.20 3.64 0.16 -2.73 116.57 117.89 1ycf h LYS 392 Ca 0.06 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1ycf h LYS 392 Cb 0.51 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 1ycf h LYS 392 CO 0.02 0.29 -0.17 0.82 -2.27 0.00 0.00 179.45 178.15 1ycf h ILE 393 N -0.31 0.57 -1.01 2.00 2.04 -0.87 -2.02 117.51 117.91 1ycf h ILE 393 Ca -0.00 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.05 1ycf h ILE 393 Cb 0.31 0.57 -0.11 0.00 -0.74 0.00 0.00 36.82 36.85 1ycf h ILE 393 CO 0.00 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.76 1ycf h ALA 394 N 0.78 1.68 -0.46 1.87 0.00 -1.23 0.70 119.26 122.60 1ycf h ALA 394 Ca 0.08 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1ycf h ALA 394 Cb 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ycf h ALA 394 CO -0.23 -0.05 0.01 0.00 0.00 0.00 0.00 179.25 178.97 1ycf h ALA 395 N 1.65 1.15 -0.14 0.00 0.00 -1.05 -2.21 119.26 118.66 1ycf h ALA 395 Ca 0.58 -0.25 -0.20 0.00 0.00 0.00 0.00 54.91 55.04 1ycf h ALA 395 Cb 0.91 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1ycf h ALA 395 CO -0.39 0.55 -0.72 -0.09 0.00 0.00 0.00 179.25 178.60 1ycf h ARG 396 N 0.70 0.65 0.00 0.00 2.43 -0.56 -1.38 114.38 116.24 1ycf h ARG 396 Ca 0.14 -0.51 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1ycf h ARG 396 Cb 0.43 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1ycf h ARG 396 CO 0.02 1.13 0.00 -0.89 -1.51 0.00 0.00 179.97 178.72 1ycf n ILE 397 N -3.91 0.00 0.00 1.20 5.41 -0.58 -4.71 119.36 116.76 1ycf n ILE 397 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.69 1ycf n ILE 397 Cb 0.71 -0.54 0.00 0.00 -0.71 0.00 0.00 39.64 39.11 1ycf n ILE 397 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ycf n ALA 398 N -0.84 0.00 -0.74 -1.39 0.00 -0.52 -4.59 120.51 112.42 1ycf n ALA 398 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1ycf n ALA 398 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1ycf n ALA 398 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03