#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1umf n ASN 2 N 0.00 5.20 -4.16 6.12 6.94 -1.26 -4.91 115.26 123.19 1umf n ASN 2 Ca 0.00 -2.82 -0.26 0.00 -0.02 0.00 0.00 54.58 51.48 1umf n ASN 2 Cb 0.00 -0.66 -0.16 0.00 -2.36 0.00 0.00 39.78 36.60 1umf n ASN 2 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1umf s THR 3 N -2.55 1.48 -0.09 5.53 2.01 -1.26 -1.01 115.64 119.76 1umf s THR 3 Ca 0.48 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.75 1umf s THR 3 Cb 0.37 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.60 1umf s THR 3 CO 0.14 0.42 -0.19 -0.22 -0.69 0.00 0.00 174.62 174.08 1umf s LEU 4 N -0.11 2.38 0.00 4.42 2.96 0.21 -4.94 118.68 123.60 1umf s LEU 4 Ca -0.01 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 53.48 1umf s LEU 4 Cb -0.10 -1.49 0.00 0.00 0.50 0.00 0.00 46.19 45.10 1umf s LEU 4 CO 0.01 0.20 0.00 0.61 -1.32 0.00 0.00 176.35 175.86 1umf n GLY 5 N 3.25 1.99 0.13 7.98 0.00 -1.26 -0.38 105.19 116.89 1umf n GLY 5 Ca -0.18 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 1umf n GLY 5 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1umf n ARG 6 N 1.85 0.53 -0.11 1.61 3.00 -1.26 -4.68 116.66 117.60 1umf n ARG 6 Ca 0.00 0.21 -0.17 0.00 -0.00 0.00 0.00 57.85 57.89 1umf n ARG 6 Cb 0.00 -1.41 -0.07 0.00 0.00 0.00 0.00 32.46 30.98 1umf n ARG 6 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1umf n PHE 7 N -4.38 0.39 -2.80 -0.14 0.99 -1.26 -4.71 117.46 105.55 1umf n PHE 7 Ca -0.22 0.17 -0.43 0.00 -0.00 0.00 0.00 57.45 56.97 1umf n PHE 7 Cb 0.58 -0.83 -0.04 0.00 -1.00 0.00 0.00 39.48 38.19 1umf n PHE 7 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1umf s LEU 8 N -7.84 4.03 -0.24 4.37 2.96 -1.26 -4.19 118.68 116.51 1umf s LEU 8 Ca -0.29 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.12 1umf s LEU 8 Cb 0.08 -2.75 0.00 0.00 0.50 0.00 0.00 46.19 44.02 1umf s LEU 8 CO 0.44 -1.34 -0.02 -0.13 -1.32 0.00 0.00 176.35 173.98 1umf s ARG 9 N 4.20 3.20 -0.29 1.98 0.52 0.92 -4.33 118.95 125.15 1umf s ARG 9 Ca 0.30 -0.75 -0.15 0.00 -0.52 0.00 0.00 55.73 54.61 1umf s ARG 9 Cb -0.13 -3.09 -0.03 0.00 0.52 0.00 0.00 34.95 32.23 1umf s ARG 9 CO 0.18 -0.29 0.40 -1.17 0.02 0.00 0.00 175.30 174.43 1umf s LEU 10 N 1.45 4.14 -0.07 2.53 2.96 0.49 -0.80 118.68 129.38 1umf s LEU 10 Ca 0.04 0.18 0.05 0.00 -0.22 0.00 0.00 54.13 54.18 1umf s LEU 10 Cb -0.15 -2.44 -0.01 0.00 0.50 0.00 0.00 46.19 44.08 1umf s LEU 10 CO -0.02 -0.25 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.64 1umf s THR 11 N 2.12 2.25 0.23 3.68 2.01 -0.29 0.64 115.64 126.28 1umf s THR 11 Ca 0.15 -0.99 0.10 0.00 0.31 0.00 0.00 61.69 61.26 1umf s THR 11 Cb -0.16 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 1umf s THR 11 CO 0.11 0.57 -0.08 0.28 -0.69 0.00 0.00 174.62 174.80 1umf s THR 12 N -0.07 3.15 -0.56 -0.82 -1.32 -0.18 -0.87 115.64 114.97 1umf s THR 12 Ca -0.06 -1.90 0.25 0.00 -1.21 0.00 0.00 61.69 58.77 1umf s THR 12 Cb -0.14 -2.63 0.28 0.00 -1.51 0.00 0.00 72.50 68.50 1umf s THR 12 CO 0.05 -0.27 1.75 -0.26 -2.21 0.00 0.00 174.62 173.68 1umf h PHE 13 N 2.40 0.00 -0.30 9.09 -1.00 -1.73 -3.47 116.94 121.92 1umf h PHE 13 Ca -0.45 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.37 1umf h PHE 13 Cb 1.23 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.78 1umf h PHE 13 CO 0.69 0.00 -0.06 0.41 -1.61 0.00 0.00 178.31 177.74 1umf n GLY 14 N 0.61 -1.47 3.59 -1.45 0.00 -1.26 -4.88 105.19 100.33 1umf n GLY 14 Ca 0.04 -1.50 -0.50 0.00 0.00 0.00 0.00 46.02 44.06 1umf n GLY 14 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1umf n GLU 15 N -1.59 1.22 -3.67 1.61 0.00 -1.26 -4.96 120.64 111.99 1umf n GLU 15 Ca -0.00 0.44 -0.10 0.00 0.00 0.00 0.00 57.16 57.50 1umf n GLU 15 Cb 0.06 -2.03 -0.04 0.00 0.00 0.00 0.00 31.44 29.43 1umf n GLU 15 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1umf s SER 16 N 0.31 -0.25 0.00 -1.84 1.04 -1.26 -5.06 113.70 106.63 1umf s SER 16 Ca 0.79 -0.38 0.05 0.00 0.48 0.00 0.00 55.95 56.89 1umf s SER 16 Cb -0.89 0.52 0.11 0.00 0.10 0.00 0.00 66.02 65.86 1umf s SER 16 CO 0.49 -0.94 0.98 0.00 0.98 0.00 0.00 173.24 174.75 1umf n HIS 17 N -0.28 0.15 -1.47 5.02 1.44 -1.26 -5.01 115.22 113.81 1umf n HIS 17 Ca -0.13 -0.35 -0.12 0.00 -2.01 0.00 0.00 57.72 55.11 1umf n HIS 17 Cb 0.63 -0.03 0.08 0.00 0.12 0.00 0.00 29.99 30.80 1umf n HIS 17 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1umf n GLY 18 N 0.08 -1.11 0.67 -1.39 0.00 -1.26 -4.98 105.19 97.20 1umf n GLY 18 Ca 0.05 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.47 1umf n GLY 18 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1umf n ASP 19 N -3.32 2.04 -4.00 1.61 5.75 -1.26 -4.87 116.55 112.50 1umf n ASP 19 Ca 0.07 -1.74 -0.21 0.00 -0.01 0.00 0.00 54.79 52.90 1umf n ASP 19 Cb 0.24 -0.10 -0.16 0.00 -1.03 0.00 0.00 41.12 40.07 1umf n ASP 19 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1umf s VAL 20 N -1.80 0.82 0.09 2.12 1.01 -1.26 -1.61 120.40 119.77 1umf s VAL 20 Ca 0.34 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 62.03 1umf s VAL 20 Cb 0.19 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.80 1umf s VAL 20 CO 0.29 0.26 -0.18 -0.51 0.00 0.00 0.00 175.10 174.96 1umf s ILE 21 N 0.32 1.49 0.27 2.22 1.10 -0.44 -4.98 121.20 121.17 1umf s ILE 21 Ca -0.05 -1.47 -0.09 0.00 -0.51 0.00 0.00 60.65 58.52 1umf s ILE 21 Cb -0.10 -1.39 -0.01 0.00 0.15 0.00 0.00 42.46 41.11 1umf s ILE 21 CO 0.01 -0.13 0.45 -0.83 -2.11 0.00 0.00 174.94 172.32 1umf s GLY 22 N -1.88 0.83 0.19 1.50 0.00 -1.26 0.27 107.32 106.97 1umf s GLY 22 Ca 0.04 -1.10 -0.23 0.00 0.00 0.00 0.00 44.72 43.42 1umf s GLY 22 CO 0.04 -0.79 0.96 -0.32 0.00 0.00 0.00 173.10 172.99 1umf s GLY 23 N -3.08 -0.07 -0.09 0.20 0.00 -0.78 -1.93 107.32 101.57 1umf s GLY 23 Ca 0.26 -0.11 -0.07 0.00 0.00 0.00 0.00 44.72 44.80 1umf s GLY 23 CO 0.12 0.64 0.23 0.54 0.00 0.00 0.00 173.10 174.62 1umf s VAL 24 N -2.92 -0.01 -0.27 1.40 0.11 -0.05 -1.51 120.40 117.16 1umf s VAL 24 Ca 0.15 0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 59.19 1umf s VAL 24 Cb -0.02 -0.34 0.00 0.00 -1.53 0.00 0.00 36.38 34.49 1umf s VAL 24 CO 0.04 0.02 0.04 -0.22 -3.33 0.00 0.00 175.10 171.65 1umf s LEU 25 N 0.45 3.54 -0.04 2.54 2.96 -0.61 -1.14 118.68 126.39 1umf s LEU 25 Ca -0.03 -0.58 -0.00 0.00 -0.22 0.00 0.00 54.13 53.30 1umf s LEU 25 Cb -0.04 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1umf s LEU 25 CO -0.02 -0.13 0.02 -0.62 -1.32 0.00 0.00 176.35 174.28 1umf s ASP 26 N 1.50 5.31 0.00 3.68 2.15 0.02 -1.54 116.67 127.79 1umf s ASP 26 Ca 0.04 0.09 0.00 0.00 0.43 0.00 0.00 52.55 53.11 1umf s ASP 26 Cb -0.16 -1.47 0.00 0.00 -0.30 0.00 0.00 42.92 40.99 1umf s ASP 26 CO 0.01 0.32 0.00 0.61 -0.17 0.00 0.00 175.17 175.94 1umf n GLY 27 N 1.64 0.98 3.71 2.66 0.00 -1.26 -0.06 105.19 112.87 1umf n GLY 27 Ca -0.16 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1umf n GLY 27 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1umf s MET 28 N -0.80 4.47 0.64 1.61 -1.94 -1.26 -4.67 119.30 117.35 1umf s MET 28 Ca 0.00 1.69 -0.17 0.00 -1.71 0.00 0.00 55.69 55.51 1umf s MET 28 Cb 0.00 -3.36 -0.01 0.00 2.01 0.00 0.00 34.83 33.47 1umf s MET 28 CO 0.00 -0.19 1.18 -2.14 -0.01 0.00 0.00 175.02 173.86 1umf s PRO 29 N 0.92 2.72 0.70 2.03 0.02 -1.26 -4.09 135.00 136.04 1umf s PRO 29 Ca 0.56 1.69 -0.11 0.00 0.02 0.00 0.00 61.00 63.16 1umf s PRO 29 Cb -0.28 -1.91 0.01 0.00 0.02 0.00 0.00 34.50 32.34 1umf s PRO 29 CO 0.29 -1.37 1.07 -1.54 -0.33 0.00 0.00 177.00 175.13 1umf s SER 30 N -1.96 5.49 0.00 2.53 1.04 -1.26 -4.28 113.70 115.25 1umf s SER 30 Ca 0.74 1.33 0.00 0.00 0.48 0.00 0.00 55.95 58.50 1umf s SER 30 Cb -0.27 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.64 1umf s SER 30 CO 0.38 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.87 1umf n GLY 31 N -2.58 0.49 3.68 7.32 0.00 -0.31 -4.94 105.19 108.85 1umf n GLY 31 Ca 0.07 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 1umf n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1umf s ILE 32 N -2.00 5.37 0.03 -0.61 1.01 -1.26 -4.87 121.20 118.87 1umf s ILE 32 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 1umf s ILE 32 Cb 0.00 -3.49 -0.07 0.00 0.01 0.00 0.00 42.46 38.91 1umf s ILE 32 CO 0.00 0.37 1.53 -0.75 0.00 0.00 0.00 174.94 176.09 1umf s LYS 33 N 0.87 4.24 -0.15 2.79 2.20 -1.26 -1.16 119.74 127.27 1umf s LYS 33 Ca 0.08 2.15 -0.29 0.00 -0.36 0.00 0.00 55.97 57.54 1umf s LYS 33 Cb -0.13 -3.60 -0.02 0.00 -1.51 0.00 0.00 37.83 32.57 1umf s LYS 33 CO 0.03 -0.66 1.33 0.42 -0.36 0.00 0.00 175.35 176.11 1umf s ILE 34 N 2.58 4.15 -1.12 5.43 -1.09 0.13 -4.94 121.20 126.34 1umf s ILE 34 Ca 0.69 1.39 -0.15 0.00 -2.23 0.00 0.00 60.65 60.35 1umf s ILE 34 Cb -0.35 -3.91 0.17 0.00 -1.58 0.00 0.00 42.46 36.79 1umf s ILE 34 CO 0.29 -0.13 1.32 -0.62 -1.23 0.00 0.00 174.94 174.57 1umf s ASP 35 N 2.26 6.98 0.56 3.58 -1.08 -1.26 -4.84 116.67 122.87 1umf s ASP 35 Ca 0.58 -2.81 0.25 0.00 -0.52 0.00 0.00 52.55 50.05 1umf s ASP 35 Cb -0.24 -2.38 1.54 0.00 -1.46 0.00 0.00 42.92 40.39 1umf s ASP 35 CO 0.17 -0.78 2.11 1.88 0.52 0.00 0.00 175.17 179.08 1umf h TYR 36 N 7.52 0.00 -0.13 -5.34 0.05 -1.98 -0.75 116.97 116.34 1umf h TYR 36 Ca 0.26 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.92 1umf h TYR 36 Cb 0.91 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.66 1umf h TYR 36 CO 1.09 0.00 -0.39 0.00 -1.05 0.00 0.00 178.16 177.81 1umf h ALA 37 N 1.84 0.22 -0.38 3.88 0.00 -1.99 -2.32 119.26 120.52 1umf h ALA 37 Ca 0.09 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 1umf h ALA 37 Cb 0.42 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1umf h ALA 37 CO -0.00 0.32 0.06 1.25 0.00 0.00 0.00 179.25 180.87 1umf h LEU 38 N 0.10 0.60 -0.21 0.00 5.85 -1.71 0.25 115.31 120.20 1umf h LEU 38 Ca -0.01 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.48 1umf h LEU 38 Cb 1.01 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 1umf h LEU 38 CO 0.08 0.71 -0.03 0.25 -0.34 0.00 0.00 178.44 179.12 1umf h LEU 39 N 0.47 -0.13 -0.69 2.25 5.85 -1.21 -0.03 115.31 121.82 1umf h LEU 39 Ca 0.11 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1umf h LEU 39 Cb 0.37 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1umf h LEU 39 CO 0.01 -0.04 0.23 -0.08 -0.34 0.00 0.00 178.44 178.22 1umf h GLU 40 N 0.03 1.06 -0.18 1.25 4.81 -1.27 -2.57 114.58 117.70 1umf h GLU 40 Ca 0.10 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1umf h GLU 40 Cb 0.14 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1umf h GLU 40 CO -0.19 0.91 -0.21 -0.97 -0.73 0.00 0.00 179.01 177.82 1umf h ASN 41 N 1.00 0.31 -0.42 1.04 -1.24 -0.47 -2.76 115.58 113.04 1umf h ASN 41 Ca 0.22 -0.09 -0.06 0.00 0.71 0.00 0.00 56.30 57.08 1umf h ASN 41 Cb 0.28 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.23 1umf h ASN 41 CO -0.01 0.54 0.02 -0.33 -1.29 0.00 0.00 177.43 176.35 1umf h GLU 42 N 0.29 0.72 0.00 6.67 4.39 -0.68 -2.20 114.58 123.78 1umf h GLU 42 Ca 0.05 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.50 1umf h GLU 42 Cb 0.53 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1umf h GLU 42 CO 0.04 0.79 -0.13 0.52 -1.16 0.00 0.00 179.01 179.07 1umf h MET 43 N 0.56 0.00 0.07 2.33 2.86 -1.26 -2.07 114.93 117.42 1umf h MET 43 Ca 0.12 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1umf h MET 43 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1umf h MET 43 CO 0.02 0.13 -0.04 -0.22 1.06 0.00 0.00 176.91 177.86 1umf h LYS 44 N 0.00 -0.09 -1.00 1.72 3.64 -1.19 -3.23 116.57 116.41 1umf h LYS 44 Ca -0.00 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.51 1umf h LYS 44 Cb 0.33 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.08 1umf h LYS 44 CO 0.02 0.46 0.63 0.00 -2.27 0.00 0.00 179.45 178.29 1umf h ARG 45 N -0.77 0.92 -0.68 1.90 3.08 -1.15 -1.12 114.38 116.56 1umf h ARG 45 Ca -0.01 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.09 1umf h ARG 45 Cb 0.60 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 1umf h ARG 45 CO 0.02 0.61 0.45 -0.09 -1.07 0.00 0.00 179.97 179.89 1umf h ARG 46 N 0.95 0.48 -2.37 0.04 2.43 -1.43 -2.93 114.38 111.55 1umf h ARG 46 Ca 0.50 -0.03 -0.59 0.00 -0.81 0.00 0.00 59.98 59.05 1umf h ARG 46 Cb 0.54 -0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 29.86 1umf h ARG 46 CO -0.27 0.32 1.56 1.04 -1.51 0.00 0.00 179.97 181.10 1umf n GLN 47 N -4.48 3.47 0.00 0.20 6.02 -0.42 -4.81 117.38 117.36 1umf n GLN 47 Ca 0.12 -2.70 0.00 0.00 -0.01 0.00 0.00 57.00 54.41 1umf n GLN 47 Cb 0.40 -2.41 0.00 0.00 1.02 0.00 0.00 30.24 29.24 1umf n GLN 47 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1umf n GLY 48 N 1.67 0.44 3.74 1.08 0.00 -1.10 -4.44 105.19 106.58 1umf n GLY 48 Ca 0.57 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.33 1umf n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 49 N 0.00 -0.52 0.00 -0.02 0.00 -1.25 -4.84 105.19 98.57 1umf n GLY 49 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1umf n GLY 49 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1umf n ARG 50 N -4.83 2.24 0.00 1.61 1.85 -1.26 -4.70 116.66 111.57 1umf n ARG 50 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 1umf n ARG 50 Cb 0.55 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.96 1umf n ARG 50 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1umf n ASN 51 N 0.00 0.00 -2.88 2.89 3.02 -1.26 -4.89 115.26 112.14 1umf n ASN 51 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1umf n ASN 51 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 1umf n ASN 51 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1umf n VAL 52 N 0.00 0.25 -3.94 2.41 0.31 -1.26 -4.97 118.33 111.13 1umf n VAL 52 Ca 0.00 -0.06 -0.09 0.00 -0.01 0.00 0.00 64.34 64.18 1umf n VAL 52 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1umf n VAL 52 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 1umf s PHE 53 N -0.12 0.22 0.24 3.52 -0.12 -1.26 -5.14 117.98 115.32 1umf s PHE 53 Ca 0.55 -0.63 0.11 0.00 -0.05 0.00 0.00 56.93 56.90 1umf s PHE 53 Cb -0.77 0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 41.97 1umf s PHE 53 CO 0.37 -1.14 -0.19 0.42 -0.05 0.00 0.00 175.22 174.62 1umf s ILE 54 N -3.73 2.23 -0.49 -4.49 1.01 -1.26 -5.06 121.20 109.41 1umf s ILE 54 Ca 0.19 -2.28 -0.45 0.00 0.00 0.00 0.00 60.65 58.11 1umf s ILE 54 Cb -0.03 -2.18 -0.19 0.00 0.01 0.00 0.00 42.46 40.07 1umf s ILE 54 CO 0.10 -0.41 1.93 0.35 0.00 0.00 0.00 174.94 176.91 1umf n THR 55 N -0.39 0.02 0.00 2.92 -2.24 -1.26 -4.73 114.28 108.60 1umf n THR 55 Ca -0.07 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1umf n THR 55 Cb 0.59 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1umf n THR 55 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1umf n PRO 56 N 6.20 0.00 0.06 -0.78 -0.02 -1.26 -2.29 135.00 136.91 1umf n PRO 56 Ca 0.45 0.23 -0.03 0.00 -2.02 0.00 0.00 63.50 62.13 1umf n PRO 56 Cb -0.03 -1.56 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 1umf n PRO 56 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1umf h ARG 57 N 0.00 -0.17 -0.69 -0.52 3.08 -1.85 -1.00 114.38 113.24 1umf h ARG 57 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1umf h ARG 57 Cb 0.13 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1umf h ARG 57 CO 0.00 -0.11 0.00 0.36 -1.07 0.00 0.00 179.97 179.15 1umf n LYS 58 N -2.67 2.96 0.00 0.04 2.85 -1.09 -4.27 118.16 115.98 1umf n LYS 58 Ca -0.02 -1.74 0.00 0.00 -1.05 0.00 0.00 58.31 55.50 1umf n LYS 58 Cb 0.07 -1.81 0.00 0.00 -0.65 0.00 0.00 35.03 32.64 1umf n LYS 58 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1umf n GLU 59 N 0.44 0.00 -4.41 -1.58 -0.58 -0.97 -5.05 120.64 108.49 1umf n GLU 59 Ca 0.15 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.67 1umf n GLU 59 Cb 0.70 -0.48 -0.08 0.00 -0.57 0.00 0.00 31.44 31.00 1umf n GLU 59 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1umf s ASP 60 N -5.07 2.18 0.56 1.62 1.11 -0.38 -5.01 116.67 111.69 1umf s ASP 60 Ca 0.00 -1.67 -0.18 0.00 0.18 0.00 0.00 52.55 50.88 1umf s ASP 60 Cb 0.00 0.49 -0.12 0.00 1.07 0.00 0.00 42.92 44.36 1umf s ASP 60 CO 0.00 -0.96 0.18 0.47 1.18 0.00 0.00 175.17 176.05 1umf n ASP 61 N -1.27 -2.42 -4.07 0.27 9.92 -1.26 -4.50 116.55 113.21 1umf n ASP 61 Ca -0.01 0.68 -0.18 0.00 -0.53 0.00 0.00 54.79 54.74 1umf n ASP 61 Cb 0.64 -1.01 -0.14 0.00 -0.64 0.00 0.00 41.12 39.97 1umf n ASP 61 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1umf s LYS 62 N -1.61 0.79 -0.33 -1.24 1.02 -1.26 -4.91 119.74 112.19 1umf s LYS 62 Ca 0.62 -0.55 -0.13 0.00 0.02 0.00 0.00 55.97 55.94 1umf s LYS 62 Cb -0.46 -0.75 -0.02 0.00 -0.52 0.00 0.00 37.83 36.09 1umf s LYS 62 CO 0.61 0.19 0.24 0.08 -0.92 0.00 0.00 175.35 175.55 1umf s VAL 63 N -0.61 5.29 -0.37 3.17 1.01 -1.26 -3.95 120.40 123.67 1umf s VAL 63 Ca 0.01 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.72 1umf s VAL 63 Cb -0.06 -3.70 0.04 0.00 0.00 0.00 0.00 36.38 32.66 1umf s VAL 63 CO 0.00 0.01 0.19 -0.70 0.00 0.00 0.00 175.10 174.60 1umf s GLU 64 N 1.73 2.72 -0.14 2.72 2.12 -0.60 -4.97 118.70 122.28 1umf s GLU 64 Ca 0.06 -1.17 -0.29 0.00 0.36 0.00 0.00 54.97 53.92 1umf s GLU 64 Cb -0.17 -3.66 -0.01 0.00 0.26 0.00 0.00 34.13 30.54 1umf s GLU 64 CO 0.11 -0.73 1.15 0.42 -0.54 0.00 0.00 175.26 175.67 1umf s ILE 65 N 1.49 4.44 -0.64 -3.70 1.01 -1.26 -1.24 121.20 121.30 1umf s ILE 65 Ca 0.01 1.75 0.22 0.00 0.00 0.00 0.00 60.65 62.62 1umf s ILE 65 Cb -0.20 -4.12 -0.21 0.00 0.01 0.00 0.00 42.46 37.93 1umf s ILE 65 CO 0.05 -0.09 0.85 0.35 0.00 0.00 0.00 174.94 176.10 1umf n THR 66 N 5.03 0.05 -3.74 2.92 -2.24 0.01 -4.98 114.28 111.33 1umf n THR 66 Ca 0.12 -0.20 -0.02 0.00 -2.27 0.00 0.00 64.05 61.67 1umf n THR 66 Cb 0.46 0.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.16 1umf n THR 66 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1umf s SER 67 N -3.67 -0.14 0.00 3.42 1.04 -1.22 -4.90 113.70 108.24 1umf s SER 67 Ca 0.03 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1umf s SER 67 Cb 0.15 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1umf s SER 67 CO 0.85 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1umf n GLY 68 N -0.50 0.72 2.90 7.32 0.00 -0.90 -2.97 105.19 111.76 1umf n GLY 68 Ca -0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 1umf n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1umf s VAL 69 N -2.86 0.58 -0.07 1.61 1.01 -1.26 -1.26 120.40 118.15 1umf s VAL 69 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1umf s VAL 69 Cb 0.00 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.81 1umf s VAL 69 CO 0.00 0.23 0.00 0.12 0.00 0.00 0.00 175.10 175.46 1umf s PHE 70 N 0.91 0.65 -1.42 5.22 5.36 -0.08 -4.82 117.98 123.81 1umf s PHE 70 Ca -0.11 -0.16 -0.09 0.00 -0.96 0.00 0.00 56.93 55.61 1umf s PHE 70 Cb -0.14 -0.80 0.04 0.00 -0.34 0.00 0.00 43.02 41.78 1umf s PHE 70 CO 0.00 -0.33 0.99 0.39 -1.46 0.00 0.00 175.22 174.81 1umf n GLU 71 N 5.15 -6.20 -1.88 10.12 1.02 -1.26 -1.96 120.64 125.63 1umf n GLU 71 Ca -0.07 0.69 -0.14 0.00 -0.02 0.00 0.00 57.16 57.62 1umf n GLU 71 Cb 0.50 -5.58 -0.03 0.00 -0.02 0.00 0.00 31.44 26.31 1umf n GLU 71 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1umf n ASP 72 N -2.95 -4.39 -3.99 1.62 8.00 -1.26 -5.01 116.55 108.57 1umf n ASP 72 Ca -0.06 0.14 -0.18 0.00 0.71 0.00 0.00 54.79 55.41 1umf n ASP 72 Cb 0.58 -3.36 -0.15 0.00 -0.02 0.00 0.00 41.12 38.17 1umf n ASP 72 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1umf s PHE 73 N -2.60 0.66 0.34 1.24 0.08 -0.83 -0.69 117.98 116.19 1umf s PHE 73 Ca 0.00 -0.13 -0.29 0.00 0.12 0.00 0.00 56.93 56.63 1umf s PHE 73 Cb 0.00 -0.44 -0.11 0.00 -0.57 0.00 0.00 43.02 41.90 1umf s PHE 73 CO 0.00 -0.03 1.47 -1.54 -0.10 0.00 0.00 175.22 175.02 1umf s SER 74 N -0.08 6.45 0.06 1.36 1.04 -0.31 -0.91 113.70 121.32 1umf s SER 74 Ca 0.02 2.94 0.23 0.00 0.48 0.00 0.00 55.95 59.61 1umf s SER 74 Cb -0.04 -2.66 -0.00 0.00 0.10 0.00 0.00 66.02 63.42 1umf s SER 74 CO -0.00 -0.81 0.97 0.35 0.98 0.00 0.00 173.24 174.73 1umf n THR 75 N 0.95 0.21 0.00 2.02 -2.24 -0.39 -1.16 114.28 113.68 1umf n THR 75 Ca 0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1umf n THR 75 Cb 0.39 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1umf n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1umf n GLY 76 N 1.33 2.08 3.99 3.38 0.00 -1.26 -4.64 105.19 110.08 1umf n GLY 76 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1umf n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1umf s THR 77 N -2.52 2.48 0.15 2.61 -4.23 -1.26 -4.59 115.64 108.27 1umf s THR 77 Ca 0.00 -0.73 -0.34 0.00 -1.18 0.00 0.00 61.69 59.44 1umf s THR 77 Cb 0.00 -2.75 -0.15 0.00 1.34 0.00 0.00 72.50 70.94 1umf s THR 77 CO 0.00 0.00 1.36 -2.65 -0.54 0.00 0.00 174.62 172.79 1umf n PRO 78 N -2.42 1.54 -3.30 3.99 -0.02 -1.26 -4.56 135.00 128.98 1umf n PRO 78 Ca 0.11 0.55 -0.46 0.00 -2.02 0.00 0.00 63.50 61.68 1umf n PRO 78 Cb 0.60 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 1umf n PRO 78 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1umf s ILE 79 N 0.30 5.33 0.26 4.25 1.01 -0.59 -2.11 121.20 129.66 1umf s ILE 79 Ca 0.77 -1.85 -0.14 0.00 0.00 0.00 0.00 60.65 59.43 1umf s ILE 79 Cb -0.81 -4.41 -0.08 0.00 0.01 0.00 0.00 42.46 37.17 1umf s ILE 79 CO 0.47 -0.97 0.66 -0.83 0.00 0.00 0.00 174.94 174.27 1umf s GLY 80 N 3.03 2.39 -0.13 6.18 0.00 -1.16 -1.57 107.32 116.06 1umf s GLY 80 Ca 0.10 -0.04 -0.16 0.00 0.00 0.00 0.00 44.72 44.62 1umf s GLY 80 CO -0.02 0.19 0.43 -0.11 0.00 0.00 0.00 173.10 173.59 1umf s PHE 81 N -1.79 -0.44 0.12 1.90 -0.12 -0.57 -0.81 117.98 116.29 1umf s PHE 81 Ca 0.48 1.00 0.10 0.00 -0.05 0.00 0.00 56.93 58.46 1umf s PHE 81 Cb -0.12 0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.40 1umf s PHE 81 CO 0.19 -0.29 -0.22 -0.51 -0.05 0.00 0.00 175.22 174.34 1umf s LEU 82 N -0.18 2.55 -0.17 -1.99 1.43 -0.37 -1.87 118.68 118.07 1umf s LEU 82 Ca -0.04 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.41 1umf s LEU 82 Cb -0.03 -1.41 0.05 0.00 0.03 0.00 0.00 46.19 44.83 1umf s LEU 82 CO 0.02 0.18 -0.01 -0.63 0.23 0.00 0.00 176.35 176.14 1umf s ILE 83 N -1.12 0.82 0.01 -0.59 1.01 0.14 -1.55 121.20 119.92 1umf s ILE 83 Ca 0.16 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 1umf s ILE 83 Cb -0.10 -1.14 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 1umf s ILE 83 CO 0.08 -0.02 0.36 -1.00 0.00 0.00 0.00 174.94 174.37 1umf s HIS 84 N 1.74 3.65 0.00 3.97 3.76 -1.25 -1.33 115.29 125.83 1umf s HIS 84 Ca -0.00 0.83 0.00 0.00 -0.15 0.00 0.00 55.06 55.74 1umf s HIS 84 Cb -0.16 -2.18 0.00 0.00 1.11 0.00 0.00 32.58 31.35 1umf s HIS 84 CO -0.07 0.62 0.00 0.27 -0.85 0.00 0.00 174.74 174.70 1umf n ASN 85 N 1.49 0.00 -0.45 1.40 6.94 -0.63 -4.11 115.26 119.91 1umf n ASN 85 Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.43 1umf n ASN 85 Cb 0.53 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 1umf n ASN 85 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1umf n GLN 86 N 0.00 -1.18 -3.64 -3.83 6.02 -1.26 -4.84 117.38 108.65 1umf n GLN 86 Ca 0.00 0.91 -0.09 0.00 -0.01 0.00 0.00 57.00 57.81 1umf n GLN 86 Cb 0.00 -1.13 -0.07 0.00 1.02 0.00 0.00 30.24 30.06 1umf n GLN 86 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1umf s ARG 87 N -4.48 0.59 0.49 -1.09 1.04 -1.26 -5.13 118.95 109.11 1umf s ARG 87 Ca 0.00 0.77 0.00 0.00 -1.04 0.00 0.00 55.73 55.46 1umf s ARG 87 Cb 0.00 0.25 0.00 0.00 -2.04 0.00 0.00 34.95 33.16 1umf s ARG 87 CO 0.00 -0.08 0.00 0.00 -0.04 0.00 0.00 175.30 175.18 1umf n ALA 88 N 2.76 -3.03 -2.89 7.88 0.00 -1.26 -4.83 120.51 119.14 1umf n ALA 88 Ca -0.14 0.37 -0.34 0.00 0.00 0.00 0.00 53.44 53.33 1umf n ALA 88 Cb 0.56 -1.05 -0.12 0.00 0.00 0.00 0.00 19.45 18.84 1umf n ALA 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1umf s ARG 89 N -1.88 3.40 0.13 0.00 3.00 -1.26 -5.12 118.95 117.22 1umf s ARG 89 Ca 0.00 -0.56 -0.02 0.00 -1.00 0.00 0.00 55.73 54.15 1umf s ARG 89 Cb 0.00 -2.78 0.03 0.00 0.00 0.00 0.00 34.95 32.20 1umf s ARG 89 CO 0.00 0.34 0.09 -1.13 0.00 0.00 0.00 175.30 174.60 1umf n SER 90 N 3.21 -1.75 0.00 -2.12 3.41 -1.26 -5.08 113.62 110.03 1umf n SER 90 Ca -0.18 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.15 1umf n SER 90 Cb 0.53 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1umf n SER 90 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1umf n LYS 91 N -2.13 0.00 0.00 4.33 5.02 -1.26 -5.12 118.16 119.00 1umf n LYS 91 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1umf n LYS 91 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1umf n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1umf n ASP 92 N 0.00 0.00 0.00 4.39 9.92 -1.26 -4.98 116.55 124.62 1umf n ASP 92 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1umf n ASP 92 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1umf n ASP 92 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1umf n TYR 93 N -1.71 0.00 -3.34 1.24 4.02 -1.26 -4.75 117.16 111.35 1umf n TYR 93 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.92 1umf n TYR 93 Cb 0.00 -1.04 -0.05 0.00 -0.02 0.00 0.00 39.34 38.24 1umf n TYR 93 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1umf s ASP 94 N -2.26 -0.20 0.00 7.72 1.11 -1.26 -1.90 116.67 119.89 1umf s ASP 94 Ca 0.00 0.28 0.00 0.00 0.18 0.00 0.00 52.55 53.01 1umf s ASP 94 Cb 0.00 1.19 0.00 0.00 1.07 0.00 0.00 42.92 45.18 1umf s ASP 94 CO 0.00 -0.04 0.00 0.59 1.18 0.00 0.00 175.17 176.90 1umf n ASN 95 N 4.30 0.00 -4.59 0.27 3.02 -1.26 -4.63 115.26 112.37 1umf n ASN 95 Ca -0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.03 1umf n ASN 95 Cb 0.55 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.69 1umf n ASN 95 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1umf s ILE 96 N 0.00 3.36 -0.09 2.41 1.01 -1.26 -4.84 121.20 121.79 1umf s ILE 96 Ca 0.00 0.35 -0.00 0.00 0.00 0.00 0.00 60.65 61.00 1umf s ILE 96 Cb 0.00 -3.56 0.07 0.00 0.01 0.00 0.00 42.46 38.99 1umf s ILE 96 CO 0.00 -0.40 1.82 0.29 0.00 0.00 0.00 174.94 176.65 1umf n LYS 97 N 8.62 1.23 -0.70 2.79 5.02 -1.26 -4.04 118.16 129.82 1umf n LYS 97 Ca 0.24 -0.46 -0.01 0.00 -2.02 0.00 0.00 58.31 56.06 1umf n LYS 97 Cb 0.48 -1.18 0.21 0.00 -0.02 0.00 0.00 35.03 34.52 1umf n LYS 97 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1umf n ASN 98 N 0.96 2.80 -4.32 4.39 3.02 -1.26 -4.97 115.26 115.87 1umf n ASN 98 Ca 0.09 -3.58 -0.17 0.00 -0.03 0.00 0.00 54.58 50.89 1umf n ASN 98 Cb 0.55 -0.61 -0.10 0.00 -0.61 0.00 0.00 39.78 39.01 1umf n ASN 98 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 1umf s LEU 99 N -3.14 2.50 -0.35 3.41 0.05 -1.26 -0.61 118.68 119.29 1umf s LEU 99 Ca 0.44 -1.06 -0.21 0.00 0.05 0.00 0.00 54.13 53.35 1umf s LEU 99 Cb 0.39 -0.52 0.00 0.00 -2.05 0.00 0.00 46.19 44.01 1umf s LEU 99 CO 0.02 -0.28 0.65 -0.36 -0.55 0.00 0.00 176.35 175.83 1umf s PHE 100 N -3.14 3.16 0.01 3.48 0.08 -1.02 -4.92 117.98 115.63 1umf s PHE 100 Ca 0.22 0.42 -0.30 0.00 0.12 0.00 0.00 56.93 57.38 1umf s PHE 100 Cb 0.02 -3.14 -0.05 0.00 -0.57 0.00 0.00 43.02 39.28 1umf s PHE 100 CO 0.06 -0.61 1.28 1.03 -0.10 0.00 0.00 175.22 176.88 1umf s ARG 101 N 2.73 4.35 0.30 0.44 0.52 -1.26 -4.67 118.95 121.36 1umf s ARG 101 Ca 0.25 1.83 -0.27 0.00 -0.52 0.00 0.00 55.73 57.02 1umf s ARG 101 Cb -0.14 -3.47 -0.14 0.00 0.52 0.00 0.00 34.95 31.71 1umf s ARG 101 CO 0.14 -0.43 0.90 -2.30 0.02 0.00 0.00 175.30 173.63 1umf n PRO 102 N 4.78 1.09 -0.75 3.54 -0.02 -1.26 -1.06 135.00 141.32 1umf n PRO 102 Ca 0.11 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1umf n PRO 102 Cb 0.45 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1umf n PRO 102 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1umf n SER 103 N 1.27 -2.44 -4.98 2.55 7.64 -1.26 -4.71 113.62 111.69 1umf n SER 103 Ca 0.11 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.79 1umf n SER 103 Cb 0.32 -2.61 0.00 0.00 -1.01 0.00 0.00 64.21 60.92 1umf n SER 103 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1umf s HIS 104 N -1.25 3.11 -2.16 1.43 3.76 -0.23 -4.82 115.29 115.12 1umf s HIS 104 Ca 0.00 -0.12 0.17 0.00 -0.15 0.00 0.00 55.06 54.97 1umf s HIS 104 Cb 0.00 -2.13 0.70 0.00 1.11 0.00 0.00 32.58 32.26 1umf s HIS 104 CO 0.00 -0.16 1.50 0.00 -0.85 0.00 0.00 174.74 175.23 1umf n ALA 105 N -1.79 2.52 -0.29 -1.40 0.00 -1.26 -4.30 120.51 113.99 1umf n ALA 105 Ca 0.01 -0.44 0.07 0.00 0.00 0.00 0.00 53.44 53.09 1umf n ALA 105 Cb 0.58 -1.10 0.22 0.00 0.00 0.00 0.00 19.45 19.15 1umf n ALA 105 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1umf h ASP 106 N 1.66 0.51 0.07 0.00 3.32 -1.95 -0.54 116.42 119.49 1umf h ASP 106 Ca 0.00 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1umf h ASP 106 Cb 0.37 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1umf h ASP 106 CO 0.00 0.21 -0.03 0.15 -1.72 0.00 0.00 179.24 177.85 1umf h PHE 107 N 0.61 -0.09 -0.23 4.55 3.57 -1.90 -1.17 116.94 122.29 1umf h PHE 107 Ca 0.46 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.87 1umf h PHE 107 Cb 0.66 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.42 1umf h PHE 107 CO -0.10 0.05 -0.19 1.79 -2.23 0.00 0.00 178.31 177.63 1umf h THR 108 N -0.21 1.32 -0.81 4.41 1.35 -1.77 -2.39 112.91 114.81 1umf h THR 108 Ca -0.01 -1.34 0.08 0.00 -0.55 0.00 0.00 66.41 64.59 1umf h THR 108 Cb 0.17 1.68 -0.07 0.00 -1.73 0.00 0.00 68.15 68.21 1umf h THR 108 CO 0.02 0.41 0.47 1.88 -0.25 0.00 0.00 175.52 178.05 1umf h TYR 109 N 0.23 0.86 -0.41 4.73 0.05 -1.13 0.27 116.97 121.58 1umf h TYR 109 Ca 0.04 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.85 1umf h TYR 109 Cb 0.73 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 1umf h TYR 109 CO 0.07 0.39 0.27 0.35 -1.05 0.00 0.00 178.16 178.19 1umf h PHE 110 N 0.82 0.50 -0.05 4.88 3.57 -1.09 -1.72 116.94 123.85 1umf h PHE 110 Ca 0.38 0.01 -0.23 0.00 3.53 0.00 0.00 57.97 61.66 1umf h PHE 110 Cb 0.28 -0.17 0.01 0.00 2.79 0.00 0.00 35.95 38.86 1umf h PHE 110 CO -0.06 0.31 -0.89 0.45 -2.23 0.00 0.00 178.31 175.89 1umf h HIS 111 N 0.54 0.83 -0.14 0.41 3.86 -0.82 0.98 115.15 120.82 1umf h HIS 111 Ca 0.15 -0.42 -0.02 0.00 -1.16 0.00 0.00 60.37 58.93 1umf h HIS 111 Cb -0.06 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 1umf h HIS 111 CO -0.05 1.23 0.02 -0.22 0.86 0.00 0.00 177.93 179.77 1umf h LYS 112 N 0.36 0.23 0.00 2.45 3.64 -0.41 -3.36 116.57 119.48 1umf h LYS 112 Ca -0.08 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1umf h LYS 112 Cb 1.52 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.32 1umf h LYS 112 CO 0.17 0.42 -1.66 0.66 -2.27 0.00 0.00 179.45 176.77 1umf n TYR 113 N -4.81 0.00 -2.26 1.91 4.01 -0.66 -5.03 117.16 110.33 1umf n TYR 113 Ca -0.05 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.53 1umf n TYR 113 Cb 0.18 -0.33 -0.01 0.00 -0.31 0.00 0.00 39.34 38.87 1umf n TYR 113 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1umf n GLY 114 N 1.69 -0.20 3.03 2.72 0.00 0.34 -5.00 105.19 107.77 1umf n GLY 114 Ca -0.03 -0.23 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 1umf n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1umf s ILE 115 N -2.78 1.72 -1.31 -0.61 1.01 -1.26 -5.04 121.20 112.94 1umf s ILE 115 Ca 0.00 -0.88 -0.18 0.00 0.00 0.00 0.00 60.65 59.59 1umf s ILE 115 Cb 0.00 -1.68 0.05 0.00 0.01 0.00 0.00 42.46 40.84 1umf s ILE 115 CO 0.00 0.34 1.86 0.54 0.00 0.00 0.00 174.94 177.68 1umf n ARG 116 N 4.69 2.97 0.00 2.79 1.74 -1.26 -4.73 116.66 122.86 1umf n ARG 116 Ca -0.17 -3.05 0.00 0.00 -0.77 0.00 0.00 57.85 53.86 1umf n ARG 116 Cb 0.48 -3.46 0.00 0.00 -1.02 0.00 0.00 32.46 28.46 1umf n ARG 116 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1umf n ASP 117 N 8.36 0.00 -2.46 0.55 -0.08 -1.26 -5.07 116.55 116.58 1umf n ASP 117 Ca 0.49 0.05 -0.00 0.00 -1.51 0.00 0.00 54.79 53.82 1umf n ASP 117 Cb 0.44 -0.11 -0.00 0.00 2.34 0.00 0.00 41.12 43.80 1umf n ASP 117 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1umf n PHE 118 N -1.30 -0.34 -3.74 -0.67 7.35 -1.26 -5.02 117.46 112.48 1umf n PHE 118 Ca 0.00 0.20 -0.24 0.00 -0.76 0.00 0.00 57.45 56.65 1umf n PHE 118 Cb 0.00 -1.21 -0.17 0.00 0.35 0.00 0.00 39.48 38.45 1umf n PHE 118 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1umf s ARG 119 N -0.04 0.52 1.02 -4.13 3.00 -1.26 -5.09 118.95 112.96 1umf s ARG 119 Ca -0.01 -0.03 -0.15 0.00 0.00 0.00 0.00 55.73 55.54 1umf s ARG 119 Cb 0.00 -1.32 0.24 0.00 0.00 0.00 0.00 34.95 33.87 1umf s ARG 119 CO 0.02 -0.43 0.54 0.41 0.00 0.00 0.00 175.30 175.85 1umf n GLY 120 N 5.14 -2.98 0.00 -3.53 0.00 -1.26 -4.44 105.19 98.12 1umf n GLY 120 Ca -0.07 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1umf n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 121 N -3.03 0.91 2.00 -0.02 0.00 -1.26 -4.50 105.19 99.29 1umf n GLY 121 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1umf n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 122 N 0.00 1.13 5.47 -0.02 0.00 -1.26 -4.88 105.19 105.62 1umf n GLY 122 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1umf n GLY 122 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1umf n ARG 123 N -2.00 0.00 0.00 1.61 1.85 -1.26 -3.30 116.66 113.55 1umf n ARG 123 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1umf n ARG 123 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1umf n ARG 123 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1umf n SER 124 N -2.30 0.00 -3.46 2.89 2.88 -1.26 -4.42 113.62 107.96 1umf n SER 124 Ca 0.00 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 1umf n SER 124 Cb 0.00 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 1umf n SER 124 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1umf n SER 125 N -2.89 -0.86 0.00 -3.46 7.64 -1.21 -3.51 113.62 109.34 1umf n SER 125 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1umf n SER 125 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1umf n SER 125 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1umf n ALA 126 N -2.90 0.00 0.30 -0.43 0.00 -1.26 -3.96 120.51 112.26 1umf n ALA 126 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1umf n ALA 126 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1umf n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1umf h ARG 127 N 0.00 -0.93 -0.98 0.00 3.08 -1.77 -1.82 114.38 111.97 1umf h ARG 127 Ca 0.00 0.06 0.12 0.00 0.07 0.00 0.00 59.98 60.24 1umf h ARG 127 Cb 0.00 0.21 -0.09 0.00 0.08 0.00 0.00 29.97 30.18 1umf h ARG 127 CO 0.00 -0.62 0.60 0.93 -1.07 0.00 0.00 179.97 179.82 1umf h GLU 128 N -0.96 0.92 -0.79 0.04 4.39 -1.68 -0.84 114.58 115.65 1umf h GLU 128 Ca -0.06 -0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.61 1umf h GLU 128 Cb 0.83 -0.21 -0.04 0.00 -0.10 0.00 0.00 28.75 29.23 1umf h GLU 128 CO -0.04 0.61 0.52 0.77 -1.16 0.00 0.00 179.01 179.71 1umf h SER 129 N 0.94 0.87 -0.23 1.42 0.02 -1.75 -0.05 113.55 114.77 1umf h SER 129 Ca 0.49 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.45 1umf h SER 129 Cb 0.50 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 1umf h SER 129 CO -0.27 0.61 0.05 0.00 -1.14 0.00 0.00 176.83 176.08 1umf h ALA 130 N 1.53 0.24 -0.63 3.77 0.00 -0.30 0.24 119.26 124.11 1umf h ALA 130 Ca 0.30 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1umf h ALA 130 Cb -0.04 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1umf h ALA 130 CO -0.08 -0.37 0.35 0.82 0.00 0.00 0.00 179.25 179.97 1umf h ILE 131 N 0.14 1.20 -0.48 0.00 1.08 -1.14 -0.62 117.51 117.69 1umf h ILE 131 Ca 0.11 -0.48 -0.02 0.00 -0.39 0.00 0.00 64.86 64.08 1umf h ILE 131 Cb 0.10 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.20 1umf h ILE 131 CO -0.14 0.21 0.22 0.03 -0.69 0.00 0.00 178.15 177.78 1umf h ARG 132 N 0.85 0.70 -0.48 2.37 3.08 -0.40 -0.79 114.38 119.71 1umf h ARG 132 Ca 0.22 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 1umf h ARG 132 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1umf h ARG 132 CO -0.04 0.60 -0.23 0.28 -1.07 0.00 0.00 179.97 179.51 1umf h VAL 133 N 0.63 1.27 -0.04 2.04 2.07 -0.32 0.08 116.25 121.99 1umf h VAL 133 Ca 0.16 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1umf h VAL 133 Cb 0.14 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1umf h VAL 133 CO -0.02 0.48 0.02 0.00 0.02 0.00 0.00 177.57 178.07 1umf h ALA 134 N 0.86 0.05 -0.67 1.67 0.00 -0.98 -2.14 119.26 118.05 1umf h ALA 134 Ca 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1umf h ALA 134 Cb 0.82 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1umf h ALA 134 CO 0.07 -0.41 0.37 0.00 0.00 0.00 0.00 179.25 179.28 1umf h ALA 135 N 0.93 0.85 -0.66 0.00 0.00 -1.07 -2.52 119.26 116.79 1umf h ALA 135 Ca 0.01 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.92 1umf h ALA 135 Cb 0.09 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1umf h ALA 135 CO -0.00 0.36 0.44 0.78 0.00 0.00 0.00 179.25 180.82 1umf h GLY 136 N 0.91 0.71 1.61 0.00 0.00 -0.69 -0.40 103.07 105.20 1umf h GLY 136 Ca 0.24 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 1umf h GLY 136 CO -0.04 0.12 0.01 0.00 0.00 0.00 0.00 176.54 176.64 1umf h ALA 137 N 1.67 1.42 -0.29 3.60 0.00 -0.93 0.25 119.26 124.98 1umf h ALA 137 Ca 0.30 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1umf h ALA 137 Cb 0.52 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1umf h ALA 137 CO -0.09 0.41 -0.31 0.74 0.00 0.00 0.00 179.25 180.00 1umf h PHE 138 N 0.48 0.86 -0.86 0.00 -1.00 -1.08 -1.95 116.94 113.39 1umf h PHE 138 Ca 0.11 -0.26 -0.02 0.00 2.81 0.00 0.00 57.97 60.60 1umf h PHE 138 Cb 0.29 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 39.63 1umf h PHE 138 CO 0.01 1.02 0.46 0.00 -1.61 0.00 0.00 178.31 178.18 1umf h ALA 139 N 0.70 1.10 -0.80 2.45 0.00 -0.80 -1.42 119.26 120.49 1umf h ALA 139 Ca 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1umf h ALA 139 Cb 0.88 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1umf h ALA 139 CO 0.08 0.62 0.45 0.87 0.00 0.00 0.00 179.25 181.27 1umf h LYS 140 N 1.20 1.09 -0.82 0.00 1.57 -0.36 -0.17 116.57 119.08 1umf h LYS 140 Ca 0.30 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1umf h LYS 140 Cb 0.05 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 1umf h LYS 140 CO -0.05 0.79 0.50 0.52 -0.57 0.00 0.00 179.45 180.64 1umf h MET 141 N 1.10 1.11 -0.12 3.15 2.86 -0.48 -0.89 114.93 121.65 1umf h MET 141 Ca 0.28 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.76 1umf h MET 141 Cb 0.00 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.43 1umf h MET 141 CO -0.05 0.77 -0.17 1.25 1.06 0.00 0.00 176.91 179.78 1umf h LEU 142 N 1.13 0.36 -1.42 1.22 6.46 -0.53 -3.23 115.31 119.30 1umf h LEU 142 Ca 0.30 -0.52 0.00 0.00 -0.12 0.00 0.00 57.88 57.54 1umf h LEU 142 Cb -0.05 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 39.75 1umf h LEU 142 CO -0.06 0.81 0.36 -0.07 -0.62 0.00 0.00 178.44 178.86 1umf h LEU 143 N -0.07 0.65 -1.53 2.25 3.38 -0.72 -2.31 115.31 116.96 1umf h LEU 143 Ca 0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1umf h LEU 143 Cb 0.73 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1umf h LEU 143 CO 0.04 0.49 0.01 -0.09 0.09 0.00 0.00 178.44 178.97 1umf h ARG 144 N 0.77 0.31 -0.02 1.13 2.43 -1.17 -0.47 114.38 117.35 1umf h ARG 144 Ca 0.20 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1umf h ARG 144 Cb -0.07 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1umf h ARG 144 CO -0.04 0.33 0.04 0.93 -1.51 0.00 0.00 179.97 179.71 1umf h GLU 145 N 0.30 0.00 -0.02 0.20 4.39 -1.44 -0.95 114.58 117.06 1umf h GLU 145 Ca 0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1umf h GLU 145 Cb 0.20 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1umf h GLU 145 CO 0.00 0.00 -0.19 0.44 -1.16 0.00 0.00 179.01 178.11 1umf n ILE 146 N -3.57 2.04 -2.34 3.13 -5.35 -0.81 -5.00 119.36 107.46 1umf n ILE 146 Ca -0.02 -2.63 -0.10 0.00 -0.27 0.00 0.00 62.75 59.72 1umf n ILE 146 Cb 0.12 -0.24 0.00 0.00 -1.74 0.00 0.00 39.64 37.78 1umf n ILE 146 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1umf n GLY 147 N -1.28 -0.00 3.48 3.28 0.00 -0.36 -4.98 105.19 105.33 1umf n GLY 147 Ca 0.18 -0.42 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1umf n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1umf s ILE 148 N -2.62 3.18 0.05 -0.61 1.01 -0.25 -0.38 121.20 121.58 1umf s ILE 148 Ca 0.05 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.07 1umf s ILE 148 Cb -0.02 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 1umf s ILE 148 CO 0.06 0.58 -0.11 0.54 0.00 0.00 0.00 174.94 176.01 1umf s VAL 149 N -0.60 0.86 -0.01 2.92 0.11 0.20 -3.33 120.40 120.55 1umf s VAL 149 Ca 0.09 -1.12 0.08 0.00 -2.93 0.00 0.00 61.98 58.10 1umf s VAL 149 Cb -0.11 -0.85 -0.02 0.00 -1.53 0.00 0.00 36.38 33.87 1umf s VAL 149 CO 0.01 -0.23 -0.25 0.00 -3.33 0.00 0.00 175.10 171.30 1umf s GLU 151 N -0.71 1.22 0.37 0.00 2.02 0.58 -5.00 118.70 117.18 1umf s GLU 151 Ca 0.10 -1.40 -0.16 0.00 0.02 0.00 0.00 54.97 53.53 1umf s GLU 151 Cb -0.10 0.34 0.05 0.00 0.10 0.00 0.00 34.13 34.52 1umf s GLU 151 CO -0.00 -0.43 0.77 -1.54 0.02 0.00 0.00 175.26 174.08 1umf s SER 152 N -3.06 -0.02 0.00 -0.19 1.04 -1.26 -0.51 113.70 109.70 1umf s SER 152 Ca 0.27 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1umf s SER 152 Cb 0.04 0.83 0.00 0.00 0.10 0.00 0.00 66.02 67.00 1umf s SER 152 CO 0.06 -1.64 0.00 0.61 0.98 0.00 0.00 173.24 173.26 1umf n GLY 153 N -0.52 0.70 3.71 7.32 0.00 -0.60 -4.88 105.19 110.92 1umf n GLY 153 Ca -0.08 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.75 1umf n GLY 153 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1umf s ILE 154 N -2.00 5.10 -0.82 -0.61 -1.09 0.70 -0.84 121.20 121.64 1umf s ILE 154 Ca 0.00 1.23 0.08 0.00 -2.23 0.00 0.00 60.65 59.73 1umf s ILE 154 Cb 0.00 -3.94 0.03 0.00 -1.58 0.00 0.00 42.46 36.96 1umf s ILE 154 CO 0.00 0.27 0.63 2.30 -1.23 0.00 0.00 174.94 176.91 1umf n ILE 155 N 3.82 0.00 -3.64 2.92 -5.35 -0.82 -1.47 119.36 114.81 1umf n ILE 155 Ca -0.04 -0.45 -0.08 0.00 -0.27 0.00 0.00 62.75 61.91 1umf n ILE 155 Cb 0.51 1.12 -0.07 0.00 -1.74 0.00 0.00 39.64 39.47 1umf n ILE 155 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1umf s GLU 156 N -0.94 0.54 -0.05 6.28 2.12 -1.17 -0.13 118.70 125.36 1umf s GLU 156 Ca 0.08 0.72 -0.02 0.00 0.36 0.00 0.00 54.97 56.11 1umf s GLU 156 Cb 0.06 0.22 0.04 0.00 0.26 0.00 0.00 34.13 34.71 1umf s GLU 156 CO 0.15 -0.08 0.10 0.42 -0.54 0.00 0.00 175.26 175.31 1umf s ILE 157 N 0.60 -0.13 -1.46 -3.70 1.01 -0.84 -1.10 121.20 115.59 1umf s ILE 157 Ca -0.01 0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.93 1umf s ILE 157 Cb -0.05 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.25 1umf s ILE 157 CO -0.08 0.13 0.30 0.61 0.00 0.00 0.00 174.94 175.90 1umf n GLY 158 N 4.87 -0.51 2.29 6.18 0.00 -0.60 -0.81 105.19 116.62 1umf n GLY 158 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1umf n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 159 N -1.17 2.04 3.59 -0.02 0.00 -1.26 -4.98 105.19 103.38 1umf n GLY 159 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1umf n GLY 159 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1umf s ILE 160 N -2.90 4.06 0.27 -0.61 1.01 0.01 -5.00 121.20 118.04 1umf s ILE 160 Ca 0.00 1.00 -0.10 0.00 0.00 0.00 0.00 60.65 61.55 1umf s ILE 160 Cb 0.00 -4.66 -0.07 0.00 0.01 0.00 0.00 42.46 37.74 1umf s ILE 160 CO 0.00 -1.21 0.59 -0.54 0.00 0.00 0.00 174.94 173.78 1umf s LYS 161 N 4.83 3.80 0.23 2.79 1.02 -1.26 -1.98 119.74 129.17 1umf s LYS 161 Ca 0.46 0.30 -0.09 0.00 0.02 0.00 0.00 55.97 56.65 1umf s LYS 161 Cb -0.08 -2.59 -0.07 0.00 -0.52 0.00 0.00 37.83 34.57 1umf s LYS 161 CO 0.28 0.25 0.54 0.00 -0.92 0.00 0.00 175.35 175.49 1umf s ALA 162 N -1.94 3.59 -0.07 5.17 0.00 0.82 -4.95 121.76 124.39 1umf s ALA 162 Ca 0.48 -0.31 0.05 0.00 0.00 0.00 0.00 51.96 52.17 1umf s ALA 162 Cb -0.11 -2.40 -0.07 0.00 0.00 0.00 0.00 23.12 20.54 1umf s ALA 162 CO 0.23 0.50 0.00 1.63 0.00 0.00 0.00 175.76 178.13 1umf n LYS 163 N -0.18 2.40 -4.38 0.00 5.02 -1.26 -5.01 118.16 114.75 1umf n LYS 163 Ca 0.00 0.01 -0.29 0.00 -2.02 0.00 0.00 58.31 56.01 1umf n LYS 163 Cb 0.52 -1.16 -0.12 0.00 -0.02 0.00 0.00 35.03 34.25 1umf n LYS 163 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1umf s ASN 164 N -3.99 3.56 -0.12 4.39 0.01 -1.26 -5.12 114.94 112.41 1umf s ASN 164 Ca -0.05 -0.65 0.02 0.00 -0.71 0.00 0.00 52.86 51.47 1umf s ASN 164 Cb 0.02 -0.37 -0.00 0.00 0.41 0.00 0.00 41.25 41.31 1umf s ASN 164 CO 0.25 0.19 -0.20 -0.31 -1.51 0.00 0.00 177.10 175.51 1umf s TYR 165 N -1.08 2.66 -0.28 2.20 2.02 -1.26 -3.52 117.35 118.10 1umf s TYR 165 Ca 0.16 -1.04 -0.03 0.00 -0.37 0.00 0.00 57.07 55.79 1umf s TYR 165 Cb -0.10 -1.78 0.09 0.00 -0.40 0.00 0.00 41.96 39.77 1umf s TYR 165 CO 0.07 -0.43 0.11 0.34 -1.57 0.00 0.00 175.55 174.07 1umf s ASP 166 N 0.51 3.53 0.50 2.29 -1.08 -0.03 -5.01 116.67 117.39 1umf s ASP 166 Ca -0.13 -1.30 0.28 0.00 -0.52 0.00 0.00 52.55 50.88 1umf s ASP 166 Cb -0.17 -0.50 1.26 0.00 -1.46 0.00 0.00 42.92 42.06 1umf s ASP 166 CO 0.05 -0.42 1.97 -0.26 0.52 0.00 0.00 175.17 177.03 1umf h PHE 167 N 8.31 0.00 -0.21 -5.34 -1.00 -1.92 -2.19 116.94 114.59 1umf h PHE 167 Ca -0.18 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.42 1umf h PHE 167 Cb 1.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1umf h PHE 167 CO 0.30 0.14 -0.59 -0.97 -1.61 0.00 0.00 178.31 175.57 1umf h ASN 168 N 0.00 0.88 0.34 2.17 -0.00 -1.96 -2.56 115.58 114.45 1umf h ASN 168 Ca -0.00 -0.58 -0.07 0.00 -0.00 0.00 0.00 56.30 55.64 1umf h ASN 168 Cb 0.53 -0.25 -0.01 0.00 -0.00 0.00 0.00 38.32 38.58 1umf h ASN 168 CO 0.02 1.30 -0.35 -0.74 -0.00 0.00 0.00 177.43 177.66 1umf h HIS 169 N 0.49 0.02 -0.31 0.67 2.76 -1.79 -2.79 115.15 114.19 1umf h HIS 169 Ca -0.02 -0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.02 1umf h HIS 169 Cb 1.21 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.16 1umf h HIS 169 CO 0.09 0.36 -0.31 0.00 -1.30 0.00 0.00 177.93 176.76 1umf h ALA 170 N 1.64 0.46 -1.00 5.26 0.00 -1.29 -2.79 119.26 121.55 1umf h ALA 170 Ca -0.00 -0.42 0.19 0.00 0.00 0.00 0.00 54.91 54.68 1umf h ALA 170 Cb 0.62 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.21 1umf h ALA 170 CO 0.05 0.50 0.61 -0.07 0.00 0.00 0.00 179.25 180.34 1umf h LEU 171 N 0.53 0.77 -2.61 0.00 3.38 -1.17 -1.22 115.31 115.00 1umf h LEU 171 Ca 0.05 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1umf h LEU 171 Cb 0.89 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1umf h LEU 171 CO 0.08 0.28 0.00 2.29 0.09 0.00 0.00 178.44 181.18 1umf n LYS 172 N -4.74 2.62 -3.18 1.13 0.00 -1.21 -4.96 118.16 107.83 1umf n LYS 172 Ca 0.23 -2.44 -0.39 0.00 -0.00 0.00 0.00 58.31 55.71 1umf n LYS 172 Cb 0.57 -1.51 -0.06 0.00 -0.00 0.00 0.00 35.03 34.04 1umf n LYS 172 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1umf s SER 173 N -1.15 7.11 0.58 -5.58 0.15 -0.46 -4.95 113.70 109.39 1umf s SER 173 Ca 0.42 1.32 0.27 0.00 0.70 0.00 0.00 55.95 58.66 1umf s SER 173 Cb 0.23 -2.39 1.57 0.00 -1.71 0.00 0.00 66.02 63.71 1umf s SER 173 CO 0.30 0.19 2.05 -0.33 1.20 0.00 0.00 173.24 176.66 1umf h GLU 174 N 4.92 0.00 0.00 5.44 3.07 -1.86 -1.56 114.58 124.59 1umf h GLU 174 Ca -0.47 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.37 1umf h GLU 174 Cb 1.21 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.08 1umf h GLU 174 CO 0.66 0.00 -0.32 0.44 -1.40 0.00 0.00 179.01 178.40 1umf n ILE 175 N -3.92 1.62 -2.63 3.13 -5.35 -1.26 -4.54 119.36 106.42 1umf n ILE 175 Ca 0.04 -2.24 -0.11 0.00 -0.27 0.00 0.00 62.75 60.17 1umf n ILE 175 Cb 0.41 -0.05 -0.01 0.00 -1.74 0.00 0.00 39.64 38.26 1umf n ILE 175 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1umf n PHE 176 N -1.00 -1.62 -2.00 4.28 0.99 -0.59 -4.54 117.46 112.99 1umf n PHE 176 Ca 0.14 0.08 -0.40 0.00 -0.00 0.00 0.00 57.45 57.28 1umf n PHE 176 Cb 0.71 -2.31 -0.00 0.00 -1.00 0.00 0.00 39.48 36.87 1umf n PHE 176 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1umf s ALA 177 N -2.51 3.28 -0.25 4.37 0.00 -1.26 -0.22 121.76 125.17 1umf s ALA 177 Ca 0.07 1.29 0.22 0.00 0.00 0.00 0.00 51.96 53.55 1umf s ALA 177 Cb -0.04 -3.51 -0.11 0.00 0.00 0.00 0.00 23.12 19.47 1umf s ALA 177 CO 0.09 -0.89 0.85 1.28 0.00 0.00 0.00 175.76 177.09 1umf n LEU 178 N 0.11 0.52 -4.12 0.00 4.77 -0.55 -3.06 117.00 114.67 1umf n LEU 178 Ca 0.04 0.14 -0.34 0.00 -0.03 0.00 0.00 56.01 55.82 1umf n LEU 178 Cb 0.43 -0.05 -0.14 0.00 -2.33 0.00 0.00 43.42 41.33 1umf n LEU 178 CO 0.57 -0.08 -0.37 -0.62 -1.33 0.00 0.00 177.39 175.56 1umf s ASP 179 N -4.77 4.78 0.52 -1.43 -1.08 -1.23 -0.85 116.67 112.61 1umf s ASP 179 Ca -0.02 -1.46 0.26 0.00 -0.52 0.00 0.00 52.55 50.80 1umf s ASP 179 Cb 0.12 -1.67 1.43 0.00 -1.46 0.00 0.00 42.92 41.34 1umf s ASP 179 CO 0.83 -0.28 2.08 1.05 0.52 0.00 0.00 175.17 179.38 1umf h GLU 180 N 7.90 0.00 -0.02 4.34 4.11 -1.87 -1.38 114.58 127.66 1umf h GLU 180 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 1umf h GLU 180 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1umf h GLU 180 CO 0.52 0.12 0.00 0.39 0.07 0.00 0.00 179.01 180.11 1umf n GLU 181 N -3.75 1.17 0.00 1.06 1.02 -1.26 -3.27 120.64 115.60 1umf n GLU 181 Ca -0.02 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 1umf n GLU 181 Cb 0.22 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 1umf n GLU 181 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1umf n GLN 182 N -0.64 3.55 -0.07 3.49 1.13 -0.71 -4.84 117.38 119.30 1umf n GLN 182 Ca 0.19 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.18 1umf n GLN 182 Cb 0.15 -0.61 -0.01 0.00 0.11 0.00 0.00 30.24 29.88 1umf n GLN 182 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1umf h GLU 183 N 0.00 -0.19 -0.72 -1.09 4.81 -1.27 -1.66 114.58 114.46 1umf h GLU 183 Ca 0.00 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.33 1umf h GLU 183 Cb 0.00 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.36 1umf h GLU 183 CO 0.00 -0.13 0.38 0.93 -0.73 0.00 0.00 179.01 179.46 1umf h GLU 184 N -0.20 0.65 -0.66 1.92 4.39 -1.88 0.28 114.58 119.07 1umf h GLU 184 Ca 0.16 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.74 1umf h GLU 184 Cb 0.44 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 1umf h GLU 184 CO -0.41 0.43 0.13 0.00 -1.16 0.00 0.00 179.01 177.99 1umf h ALA 185 N 1.41 0.87 -0.65 3.43 0.00 -1.81 0.55 119.26 123.06 1umf h ALA 185 Ca 0.34 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1umf h ALA 185 Cb 0.31 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1umf h ALA 185 CO -0.24 0.62 0.29 1.96 0.00 0.00 0.00 179.25 181.88 1umf h GLN 186 N 1.00 0.96 -0.54 0.00 4.20 -0.31 -1.33 115.11 119.08 1umf h GLN 186 Ca 0.20 -0.16 -0.12 0.00 0.06 0.00 0.00 58.65 58.64 1umf h GLN 186 Cb 0.41 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1umf h GLN 186 CO 0.01 0.78 -0.12 0.87 -0.67 0.00 0.00 178.83 179.70 1umf h LYS 187 N 0.91 1.04 -0.50 1.46 1.57 -0.18 -2.54 116.57 118.33 1umf h LYS 187 Ca 0.22 -0.39 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1umf h LYS 187 Cb 0.16 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 1umf h LYS 187 CO -0.02 1.08 0.33 1.15 -0.57 0.00 0.00 179.45 181.42 1umf h THR 188 N 0.92 1.09 -0.28 -0.16 2.02 -0.50 -0.19 112.91 115.81 1umf h THR 188 Ca 0.14 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 67.00 1umf h THR 188 Cb 0.69 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1umf h THR 188 CO 0.05 0.11 -0.28 0.00 0.37 0.00 0.00 175.52 175.78 1umf h ALA 189 N 1.70 0.99 -0.38 6.16 0.00 -0.86 -1.99 119.26 124.88 1umf h ALA 189 Ca 0.19 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1umf h ALA 189 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1umf h ALA 189 CO -0.05 0.60 -0.34 0.82 0.00 0.00 0.00 179.25 180.28 1umf h ILE 190 N 0.49 1.28 -0.22 0.00 2.04 -0.71 -2.40 117.51 117.99 1umf h ILE 190 Ca 0.07 -1.50 -0.08 0.00 1.00 0.00 0.00 64.86 64.34 1umf h ILE 190 Cb 0.74 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1umf h ILE 190 CO 0.06 0.50 -0.23 1.56 0.00 0.00 0.00 178.15 180.04 1umf h GLN 191 N 0.72 0.40 -0.07 2.37 4.20 -0.87 -2.37 115.11 119.48 1umf h GLN 191 Ca 0.07 -0.14 -0.15 0.00 0.06 0.00 0.00 58.65 58.50 1umf h GLN 191 Cb 0.90 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 1umf h GLN 191 CO 0.08 0.60 -0.62 -0.91 -0.67 0.00 0.00 178.83 177.32 1umf h ASN 192 N 0.36 0.29 -0.10 1.46 2.35 -1.23 -1.31 115.58 117.40 1umf h ASN 192 Ca 0.06 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1umf h ASN 192 Cb 0.60 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 1umf h ASN 192 CO 0.04 0.84 0.03 0.00 -1.65 0.00 0.00 177.43 176.69 1umf h ALA 193 N 1.17 0.13 -0.58 -0.83 0.00 -1.11 -0.78 119.26 117.26 1umf h ALA 193 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1umf h ALA 193 Cb 1.13 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1umf h ALA 193 CO 0.10 -0.26 0.38 0.82 0.00 0.00 0.00 179.25 180.28 1umf h ILE 194 N -0.03 1.14 -0.54 0.00 2.04 -1.36 0.56 117.51 119.33 1umf h ILE 194 Ca 0.03 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1umf h ILE 194 Cb 0.21 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 1umf h ILE 194 CO -0.00 0.14 0.35 0.50 0.00 0.00 0.00 178.15 179.14 1umf h LYS 195 N 0.77 0.70 -0.15 2.37 3.64 -1.06 -1.90 116.57 120.94 1umf h LYS 195 Ca 0.21 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1umf h LYS 195 Cb -0.08 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.58 1umf h LYS 195 CO -0.05 0.46 0.00 0.09 -2.27 0.00 0.00 179.45 177.68 1umf n ASN 196 N -4.72 1.20 -3.66 4.20 3.02 -0.31 -4.90 115.26 110.09 1umf n ASN 196 Ca 0.03 -1.73 -0.26 0.00 -0.03 0.00 0.00 54.58 52.60 1umf n ASN 196 Cb 0.03 -0.10 0.06 0.00 -0.61 0.00 0.00 39.78 39.16 1umf n ASN 196 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1umf n HIS 197 N 0.05 -2.69 -3.88 3.10 8.25 -0.27 -4.98 115.22 114.81 1umf n HIS 197 Ca 0.13 0.96 0.00 0.00 -0.26 0.00 0.00 57.72 58.56 1umf n HIS 197 Cb 0.24 -4.72 0.00 0.00 1.12 0.00 0.00 29.99 26.63 1umf n HIS 197 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1umf n ASP 198 N -2.94 1.65 -3.94 0.41 -0.08 0.18 -3.42 116.55 108.41 1umf n ASP 198 Ca 0.01 -0.88 -0.08 0.00 -1.51 0.00 0.00 54.79 52.33 1umf n ASP 198 Cb 0.55 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.93 1umf n ASP 198 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1umf s SER 199 N -0.75 0.24 0.09 1.67 1.04 -1.26 -4.28 113.70 110.45 1umf s SER 199 Ca 0.00 -0.74 0.04 0.00 0.48 0.00 0.00 55.95 55.73 1umf s SER 199 Cb 0.00 0.28 -0.03 0.00 0.10 0.00 0.00 66.02 66.37 1umf s SER 199 CO 0.00 -0.66 -0.11 0.27 0.98 0.00 0.00 173.24 173.72 1umf s ILE 200 N -3.70 0.99 0.74 -1.02 -4.36 0.24 -4.77 121.20 109.31 1umf s ILE 200 Ca 0.04 -1.50 -0.06 0.00 -0.26 0.00 0.00 60.65 58.87 1umf s ILE 200 Cb 0.05 -1.22 0.10 0.00 1.25 0.00 0.00 42.46 42.64 1umf s ILE 200 CO -0.10 -0.44 1.04 -0.83 0.24 0.00 0.00 174.94 174.85 1umf s GLY 201 N -2.17 1.74 0.31 6.27 0.00 -1.26 -4.27 107.32 107.93 1umf s GLY 201 Ca 0.02 -1.24 -0.15 0.00 0.00 0.00 0.00 44.72 43.35 1umf s GLY 201 CO 0.01 -0.74 0.64 -0.32 0.00 0.00 0.00 173.10 172.69 1umf s GLY 202 N -4.64 0.42 -0.08 0.20 0.00 -1.04 -1.56 107.32 100.64 1umf s GLY 202 Ca 0.64 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 44.62 1umf s GLY 202 CO 0.45 -0.42 -0.09 0.14 0.00 0.00 0.00 173.10 173.19 1umf s VAL 203 N -3.40 0.94 0.06 1.40 1.01 -0.26 -1.37 120.40 118.78 1umf s VAL 203 Ca 0.18 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1umf s VAL 203 Cb -0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1umf s VAL 203 CO 0.11 0.33 0.13 0.00 0.00 0.00 0.00 175.10 175.66 1umf s ALA 204 N 1.11 3.73 -0.12 5.51 0.00 -0.54 -1.95 121.76 129.50 1umf s ALA 204 Ca -0.07 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1umf s ALA 204 Cb -0.14 -1.60 -0.01 0.00 0.00 0.00 0.00 23.12 21.37 1umf s ALA 204 CO -0.01 0.77 -0.18 -1.17 0.00 0.00 0.00 175.76 175.17 1umf s LEU 205 N -2.36 2.42 -0.02 0.00 2.96 -0.02 -1.30 118.68 120.36 1umf s LEU 205 Ca 0.31 -0.44 0.06 0.00 -0.22 0.00 0.00 54.13 53.84 1umf s LEU 205 Cb -0.12 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 1umf s LEU 205 CO 0.23 0.16 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.59 1umf s ILE 206 N 0.38 1.58 0.01 6.68 1.09 0.18 -1.55 121.20 129.57 1umf s ILE 206 Ca -0.14 -0.85 -0.01 0.00 -1.10 0.00 0.00 60.65 58.54 1umf s ILE 206 Cb -0.17 -1.31 -0.01 0.00 -1.06 0.00 0.00 42.46 39.91 1umf s ILE 206 CO 0.07 0.45 0.01 -0.60 -0.10 0.00 0.00 174.94 174.76 1umf s ARG 207 N -0.46 0.27 -0.07 2.79 3.52 0.33 -0.27 118.95 125.07 1umf s ARG 207 Ca 0.07 -0.43 0.04 0.00 -0.13 0.00 0.00 55.73 55.29 1umf s ARG 207 Cb -0.08 0.10 -0.00 0.00 -1.56 0.00 0.00 34.95 33.41 1umf s ARG 207 CO -0.01 -0.05 -0.20 0.00 -0.81 0.00 0.00 175.30 174.24 1umf s ALA 208 N -1.11 1.78 0.22 6.12 0.00 -0.74 -0.30 121.76 127.72 1umf s ALA 208 Ca -0.12 -0.78 -0.07 0.00 0.00 0.00 0.00 51.96 50.98 1umf s ALA 208 Cb -0.07 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 1umf s ALA 208 CO -0.00 0.28 0.32 -0.98 0.00 0.00 0.00 175.76 175.37 1umf s ARG 209 N 0.20 1.37 -0.02 0.00 1.70 0.24 -2.02 118.95 120.42 1umf s ARG 209 Ca -0.10 -1.41 -0.22 0.00 -0.47 0.00 0.00 55.73 53.53 1umf s ARG 209 Cb -0.15 0.38 -0.05 0.00 -0.57 0.00 0.00 34.95 34.56 1umf s ARG 209 CO 0.05 -0.52 0.64 0.45 -1.08 0.00 0.00 175.30 174.84 1umf s SER 210 N -3.08 6.99 0.25 -2.89 0.15 -1.26 -0.63 113.70 113.24 1umf s SER 210 Ca 0.29 1.19 -0.05 0.00 0.70 0.00 0.00 55.95 58.08 1umf s SER 210 Cb 0.03 -2.39 0.30 0.00 -1.71 0.00 0.00 66.02 62.25 1umf s SER 210 CO 0.10 0.01 1.91 0.40 1.20 0.00 0.00 173.24 176.86 1umf h ILE 211 N 4.37 1.20 -2.75 6.45 2.04 -1.05 -3.42 117.51 124.35 1umf h ILE 211 Ca -0.43 -0.44 -0.52 0.00 1.00 0.00 0.00 64.86 64.46 1umf h ILE 211 Cb 1.20 -0.20 0.05 0.00 -0.74 0.00 0.00 36.82 37.13 1umf h ILE 211 CO 0.72 0.23 0.95 -0.54 0.00 0.00 0.00 178.15 179.51 1umf s LYS 212 N -6.09 4.18 0.09 2.37 -0.14 -1.26 -4.89 119.74 113.99 1umf s LYS 212 Ca -0.13 2.46 -0.35 0.00 -1.36 0.00 0.00 55.97 56.59 1umf s LYS 212 Cb 0.19 -3.17 -0.15 0.00 -1.68 0.00 0.00 37.83 33.01 1umf s LYS 212 CO 0.82 -0.68 1.50 2.41 -0.76 0.00 0.00 175.35 178.64 1umf n THR 213 N 4.06 0.05 -4.06 2.17 -1.04 -1.26 -2.15 114.28 112.05 1umf n THR 213 Ca 0.15 -0.01 -0.46 0.00 -2.04 0.00 0.00 64.05 61.69 1umf n THR 213 Cb 0.37 -1.22 0.02 0.00 -1.82 0.00 0.00 70.33 67.68 1umf n THR 213 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1umf n ASN 214 N 3.33 -4.10 -4.05 8.00 3.02 -1.26 -4.96 115.26 115.25 1umf n ASN 214 Ca 0.18 -1.29 -0.22 0.00 -0.03 0.00 0.00 54.58 53.23 1umf n ASN 214 Cb 0.24 -1.77 -0.15 0.00 -0.61 0.00 0.00 39.78 37.48 1umf n ASN 214 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1umf s GLN 215 N -7.37 1.13 0.48 3.52 -0.44 -0.91 -5.15 119.66 110.93 1umf s GLN 215 Ca 0.49 -0.40 -0.17 0.00 -2.50 0.00 0.00 55.36 52.78 1umf s GLN 215 Cb -0.26 -1.05 -0.08 0.00 -1.64 0.00 0.00 33.01 29.98 1umf s GLN 215 CO 0.97 0.18 0.95 0.15 0.50 0.00 0.00 175.29 178.04 1umf s LYS 216 N 0.03 3.99 0.82 1.67 -0.14 -1.26 -4.28 119.74 120.57 1umf s LYS 216 Ca -0.01 0.93 -0.12 0.00 -1.36 0.00 0.00 55.97 55.42 1umf s LYS 216 Cb -0.08 -2.18 0.08 0.00 -1.68 0.00 0.00 37.83 33.97 1umf s LYS 216 CO 0.01 -0.18 1.13 -0.51 -0.76 0.00 0.00 175.35 175.03 1umf s LEU 217 N -3.82 2.45 0.35 3.17 1.43 -0.19 -4.85 118.68 117.22 1umf s LEU 217 Ca 0.59 1.06 -0.29 0.00 -1.03 0.00 0.00 54.13 54.46 1umf s LEU 217 Cb -0.10 -3.59 -0.11 0.00 0.03 0.00 0.00 46.19 42.42 1umf s LEU 217 CO 0.27 -2.02 1.52 -2.84 0.23 0.00 0.00 176.35 173.50 1umf s PRO 218 N -5.32 4.12 -0.26 1.29 0.02 -1.26 -4.37 135.00 129.22 1umf s PRO 218 Ca 0.61 2.57 -0.14 0.00 0.02 0.00 0.00 61.00 64.06 1umf s PRO 218 Cb -0.13 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.36 1umf s PRO 218 CO 0.52 -0.56 0.33 0.42 -0.33 0.00 0.00 177.00 177.38 1umf s ILE 219 N -0.73 5.21 0.00 2.83 1.01 -1.26 -4.30 121.20 123.96 1umf s ILE 219 Ca 0.56 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.70 1umf s ILE 219 Cb -0.47 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.35 1umf s ILE 219 CO 0.58 0.20 0.00 0.61 0.00 0.00 0.00 174.94 176.32 1umf n GLY 220 N 4.64 1.20 3.71 6.18 0.00 -0.64 -4.99 105.19 115.29 1umf n GLY 220 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1umf n GLY 220 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umf s LEU 221 N 0.00 4.37 0.00 0.99 1.43 -1.26 -4.72 118.68 119.49 1umf s LEU 221 Ca 0.00 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.39 1umf s LEU 221 Cb 0.00 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.64 1umf s LEU 221 CO 0.00 -0.65 0.00 0.61 0.23 0.00 0.00 176.35 176.54 1umf n GLY 222 N 3.49 4.62 3.09 -3.19 0.00 -1.26 -1.34 105.19 110.59 1umf n GLY 222 Ca 0.11 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1umf n GLY 222 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1umf s GLN 223 N -4.60 2.70 1.27 1.61 -1.52 0.33 -4.87 119.66 114.58 1umf s GLN 223 Ca 0.00 -0.88 0.00 0.00 -1.95 0.00 0.00 55.36 52.53 1umf s GLN 223 Cb 0.00 -2.55 0.00 0.00 -0.22 0.00 0.00 33.01 30.24 1umf s GLN 223 CO 0.00 -0.29 0.00 0.41 -0.25 0.00 0.00 175.29 175.16 1umf n GLY 224 N 4.61 0.63 0.13 3.09 0.00 -1.26 -2.07 105.19 110.33 1umf n GLY 224 Ca -0.19 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 1umf n GLY 224 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1umf h LEU 225 N 0.00 0.55 -2.70 0.99 3.38 -1.98 -3.34 115.31 112.22 1umf h LEU 225 Ca 0.00 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1umf h LEU 225 Cb 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1umf h LEU 225 CO 0.00 1.37 0.00 -1.22 0.09 0.00 0.00 178.44 178.68 1umf n TYR 226 N -3.65 0.97 -2.77 1.13 4.01 -1.26 -4.23 117.16 111.36 1umf n TYR 226 Ca -0.09 -0.48 -0.04 0.00 -0.16 0.00 0.00 57.90 57.13 1umf n TYR 226 Cb 0.96 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 40.04 1umf n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1umf n ALA 227 N 1.65 2.90 -1.67 -0.72 0.00 -0.88 -5.00 120.51 116.80 1umf n ALA 227 Ca 0.24 -2.87 -0.35 0.00 0.00 0.00 0.00 53.44 50.47 1umf n ALA 227 Cb 0.62 -0.90 0.03 0.00 0.00 0.00 0.00 19.45 19.20 1umf n ALA 227 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1umf s LYS 228 N -3.46 2.98 0.13 0.00 1.02 -1.24 -0.51 119.74 118.65 1umf s LYS 228 Ca 0.27 1.66 -0.21 0.00 0.02 0.00 0.00 55.97 57.71 1umf s LYS 228 Cb 0.38 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.70 1umf s LYS 228 CO -0.01 -1.16 1.70 1.25 -0.92 0.00 0.00 175.35 176.20 1umf h LEU 229 N 0.70 -0.25 -1.10 3.17 5.85 -1.05 -1.47 115.31 121.16 1umf h LEU 229 Ca -0.49 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.21 1umf h LEU 229 Cb 1.28 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1umf h LEU 229 CO 0.55 -0.10 -0.20 -2.24 -0.34 0.00 0.00 178.44 176.11 1umf h ASP 230 N -0.06 0.38 -0.54 1.25 2.03 -1.93 -1.36 116.42 116.19 1umf h ASP 230 Ca 0.09 -0.11 -0.03 0.00 -0.73 0.00 0.00 57.03 56.25 1umf h ASP 230 Cb 0.19 -0.10 -0.02 0.00 -0.83 0.00 0.00 39.33 38.56 1umf h ASP 230 CO -0.19 0.60 0.23 0.00 -1.03 0.00 0.00 179.24 178.85 1umf h ALA 231 N 1.44 0.70 -0.00 4.15 0.00 -1.78 -0.55 119.26 123.21 1umf h ALA 231 Ca 0.06 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1umf h ALA 231 Cb 0.56 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1umf h ALA 231 CO 0.04 0.30 -0.67 0.87 0.00 0.00 0.00 179.25 179.78 1umf h LYS 232 N 0.73 0.02 0.06 0.00 1.79 -1.01 -1.01 116.57 117.14 1umf h LYS 232 Ca 0.18 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.64 1umf h LYS 232 Cb 0.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1umf h LYS 232 CO -0.02 0.68 -0.03 0.82 -1.08 0.00 0.00 179.45 179.82 1umf h ILE 233 N 0.01 1.19 -0.61 1.86 2.04 -1.03 -2.01 117.51 118.96 1umf h ILE 233 Ca -0.01 -0.87 0.09 0.00 1.00 0.00 0.00 64.86 65.07 1umf h ILE 233 Cb 1.19 1.75 -0.07 0.00 -0.74 0.00 0.00 36.82 38.95 1umf h ILE 233 CO 0.09 0.22 0.25 0.00 0.00 0.00 0.00 178.15 178.70 1umf h ALA 234 N 0.44 0.79 -0.57 1.87 0.00 -1.02 -0.49 119.26 120.27 1umf h ALA 234 Ca -0.01 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1umf h ALA 234 Cb 0.41 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1umf h ALA 234 CO 0.01 -0.16 0.34 1.49 0.00 0.00 0.00 179.25 180.93 1umf h GLU 235 N 0.44 0.65 -0.11 0.00 4.81 -1.13 -0.12 114.58 119.13 1umf h GLU 235 Ca 0.30 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 1umf h GLU 235 Cb 0.35 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1umf h GLU 235 CO -0.28 0.43 -0.01 0.00 -0.73 0.00 0.00 179.01 178.42 1umf h ALA 236 N 1.26 0.15 0.37 2.92 0.00 -0.56 -2.72 119.26 120.68 1umf h ALA 236 Ca 0.23 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1umf h ALA 236 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1umf h ALA 236 CO -0.11 -0.14 -0.18 0.52 0.00 0.00 0.00 179.25 179.35 1umf h MET 237 N -0.09 -0.48 -0.12 0.00 2.86 -0.96 -2.71 114.93 113.44 1umf h MET 237 Ca 0.03 0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1umf h MET 237 Cb 0.40 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 1umf h MET 237 CO 0.01 -0.23 0.17 1.98 1.06 0.00 0.00 176.91 179.90 1umf h MET 238 N -0.65 0.00 0.00 1.72 -1.53 -1.11 0.44 114.93 113.81 1umf h MET 238 Ca -0.05 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.21 1umf h MET 238 Cb 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.52 1umf h MET 238 CO 0.08 0.00 0.00 0.41 0.14 0.00 0.00 176.91 177.54 1umf n GLY 239 N -1.33 -1.34 3.73 1.39 0.00 -1.02 -4.70 105.19 101.92 1umf n GLY 239 Ca 0.00 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1umf n GLY 239 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1umf s LEU 240 N -4.13 4.43 0.18 0.99 0.20 0.14 -4.95 118.68 115.54 1umf s LEU 240 Ca 0.07 2.04 -0.32 0.00 0.69 0.00 0.00 54.13 56.60 1umf s LEU 240 Cb 0.11 -3.59 -0.11 0.00 -0.43 0.00 0.00 46.19 42.16 1umf s LEU 240 CO 0.42 -0.32 1.72 0.21 -0.29 0.00 0.00 176.35 178.09 1umf s ASN 241 N 0.43 6.42 0.00 3.68 3.04 -1.26 -2.03 114.94 125.22 1umf s ASN 241 Ca 0.53 2.81 0.00 0.00 0.04 0.00 0.00 52.86 56.24 1umf s ASN 241 Cb -0.29 -2.59 0.00 0.00 -1.54 0.00 0.00 41.25 36.83 1umf s ASN 241 CO 0.32 -0.96 0.00 0.61 -3.04 0.00 0.00 177.10 174.04 1umf n GLY 242 N 4.00 3.02 3.71 1.21 0.00 -1.26 -5.02 105.19 110.85 1umf n GLY 242 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1umf n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1umf s VAL 243 N -2.68 4.84 0.00 1.61 1.01 -0.86 -0.72 120.40 123.61 1umf s VAL 243 Ca 0.00 2.05 0.00 0.00 0.00 0.00 0.00 61.98 64.03 1umf s VAL 243 Cb 0.00 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.07 1umf s VAL 243 CO 0.00 0.13 0.36 0.29 0.00 0.00 0.00 175.10 175.88 1umf n LYS 244 N 4.09 1.28 -3.57 2.72 4.76 -0.07 -4.92 118.16 122.45 1umf n LYS 244 Ca 0.07 -0.36 -0.13 0.00 -2.87 0.00 0.00 58.31 55.02 1umf n LYS 244 Cb 0.51 -0.86 -0.06 0.00 -1.84 0.00 0.00 35.03 32.78 1umf n LYS 244 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1umf s ALA 245 N -0.28 -1.87 -0.02 7.82 0.00 -1.25 -5.01 121.76 121.14 1umf s ALA 245 Ca 0.00 1.58 0.02 0.00 0.00 0.00 0.00 51.96 53.56 1umf s ALA 245 Cb 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.50 1umf s ALA 245 CO 0.00 -0.32 -0.07 0.08 0.00 0.00 0.00 175.76 175.45 1umf s VAL 246 N -0.82 0.65 0.07 0.00 1.01 -1.26 -1.54 120.40 118.51 1umf s VAL 246 Ca -0.04 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 61.73 1umf s VAL 246 Cb -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 1umf s VAL 246 CO 0.03 0.21 -0.22 -1.61 0.00 0.00 0.00 175.10 173.52 1umf s GLU 247 N 0.20 1.31 -0.14 2.72 2.02 0.03 -4.98 118.70 119.86 1umf s GLU 247 Ca -0.03 -1.07 0.02 0.00 0.02 0.00 0.00 54.97 53.92 1umf s GLU 247 Cb -0.08 -1.51 0.01 0.00 0.10 0.00 0.00 34.13 32.65 1umf s GLU 247 CO 0.00 0.37 -0.20 0.42 0.02 0.00 0.00 175.26 175.87 1umf s ILE 248 N -0.96 1.95 0.00 -1.63 -1.09 -1.26 -1.61 121.20 116.60 1umf s ILE 248 Ca 0.08 -0.91 0.00 0.00 -2.23 0.00 0.00 60.65 57.59 1umf s ILE 248 Cb -0.09 -1.74 0.00 0.00 -1.58 0.00 0.00 42.46 39.04 1umf s ILE 248 CO 0.03 0.53 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 1umf n GLY 249 N 4.18 3.36 0.29 6.18 0.00 0.02 -1.00 105.19 118.22 1umf n GLY 249 Ca -0.20 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 45.84 1umf n GLY 249 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1umf h LYS 250 N 0.00 0.00 0.00 1.61 1.63 -1.11 -3.46 116.57 115.24 1umf h LYS 250 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1umf h LYS 250 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1umf h LYS 250 CO 0.00 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.41 1umf n GLY 251 N -1.24 2.76 0.08 5.01 0.00 -0.17 -1.45 105.19 110.18 1umf n GLY 251 Ca -0.02 0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1umf n GLY 251 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1umf n VAL 252 N 0.00 1.04 0.31 1.61 0.24 -1.26 -1.74 118.33 118.53 1umf n VAL 252 Ca 0.00 0.34 0.13 0.00 -2.04 0.00 0.00 64.34 62.77 1umf n VAL 252 Cb 0.00 -1.24 0.26 0.00 -1.47 0.00 0.00 33.84 31.39 1umf n VAL 252 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1umf h GLU 253 N 0.00 0.00 -0.65 7.34 5.08 -1.63 -3.28 114.58 121.44 1umf h GLU 253 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1umf h GLU 253 Cb 0.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1umf h GLU 253 CO 0.00 0.00 0.41 0.77 -1.00 0.00 0.00 179.01 179.19 1umf h SER 254 N 0.00 0.69 0.22 1.42 0.02 -1.34 -1.72 113.55 112.83 1umf h SER 254 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1umf h SER 254 Cb 0.90 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.28 1umf h SER 254 CO 0.00 0.49 0.00 -1.54 -1.14 0.00 0.00 176.83 174.64 1umf n SER 255 N -4.67 0.00 -0.32 3.07 3.41 -1.23 -2.09 113.62 111.79 1umf n SER 255 Ca 0.06 0.35 0.10 0.00 -0.26 0.00 0.00 58.87 59.11 1umf n SER 255 Cb 0.06 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1umf n SER 255 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1umf n LEU 256 N -1.40 1.59 -4.99 1.04 4.77 -0.65 -5.00 117.00 112.36 1umf n LEU 256 Ca 0.03 -0.69 -0.19 0.00 -0.03 0.00 0.00 56.01 55.13 1umf n LEU 256 Cb 0.08 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1umf n LEU 256 CO 0.07 0.31 0.07 -0.76 -1.33 0.00 0.00 177.39 175.75 1umf s LEU 257 N -2.47 3.95 0.28 2.23 1.02 -0.89 -5.12 118.68 117.68 1umf s LEU 257 Ca 0.14 -0.19 0.07 0.00 0.02 0.00 0.00 54.13 54.16 1umf s LEU 257 Cb 0.15 -2.76 -0.03 0.00 0.02 0.00 0.00 46.19 43.58 1umf s LEU 257 CO 0.58 -0.46 0.26 -0.54 0.02 0.00 0.00 176.35 176.21 1umf s LYS 258 N -4.19 2.95 0.12 1.70 1.02 -1.26 -4.92 119.74 115.15 1umf s LYS 258 Ca 0.46 -1.08 -0.22 0.00 0.02 0.00 0.00 55.97 55.15 1umf s LYS 258 Cb -0.10 -2.60 -0.06 0.00 -0.52 0.00 0.00 37.83 34.55 1umf s LYS 258 CO 0.31 0.30 1.70 0.78 -0.92 0.00 0.00 175.35 177.53 1umf h GLY 259 N 1.35 0.01 1.21 -3.33 0.00 -1.98 0.26 103.07 100.59 1umf h GLY 259 Ca -0.48 0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.02 1umf h GLY 259 CO 0.60 -0.09 0.32 1.48 0.00 0.00 0.00 176.54 178.85 1umf h SER 260 N -0.08 0.00 0.00 0.19 4.64 -1.95 -2.27 113.55 114.07 1umf h SER 260 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1umf h SER 260 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1umf h SER 260 CO -0.15 0.00 -0.34 -0.33 -0.87 0.00 0.00 176.83 175.14 1umf h GLU 261 N 0.00 0.00 0.00 4.77 5.08 -1.61 -3.46 114.58 119.36 1umf h GLU 261 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1umf h GLU 261 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1umf h GLU 261 CO -0.00 0.06 0.00 0.98 -1.00 0.00 0.00 179.01 179.05 1umf n TYR 262 N -4.67 0.00 -1.73 4.33 4.19 0.79 -4.97 117.16 115.10 1umf n TYR 262 Ca -0.06 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.15 1umf n TYR 262 Cb 0.19 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.02 1umf n TYR 262 CO 0.00 0.00 0.00 0.09 0.91 0.00 0.00 176.86 177.86 1umf n ASN 263 N 0.00 -2.83 -4.80 2.98 5.03 -1.06 -4.92 115.26 109.66 1umf n ASN 263 Ca 0.00 0.65 -0.31 0.00 0.87 0.00 0.00 54.58 55.79 1umf n ASN 263 Cb 0.00 -1.02 0.05 0.00 -1.02 0.00 0.00 39.78 37.79 1umf n ASN 263 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1umf s ASP 264 N 0.00 5.24 0.29 6.41 1.11 -1.26 -5.01 116.67 123.44 1umf s ASP 264 Ca 0.00 1.74 0.02 0.00 0.18 0.00 0.00 52.55 54.49 1umf s ASP 264 Cb 0.00 -2.51 -0.05 0.00 1.07 0.00 0.00 42.92 41.43 1umf s ASP 264 CO 0.00 -1.54 0.10 -0.76 1.18 0.00 0.00 175.17 174.15 1umf s LEU 265 N -5.37 1.79 0.00 1.23 1.02 -1.26 -5.15 118.68 110.94 1umf s LEU 265 Ca 0.61 -1.43 0.00 0.00 0.02 0.00 0.00 54.13 53.32 1umf s LEU 265 Cb -0.16 -0.05 0.00 0.00 0.02 0.00 0.00 46.19 46.01 1umf s LEU 265 CO 0.50 -0.75 0.00 0.23 0.02 0.00 0.00 176.35 176.36 1umf n MET 266 N -0.57 0.67 0.00 1.70 2.81 -1.26 -4.21 117.12 116.25 1umf n MET 266 Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1umf n MET 266 Cb 0.66 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.17 1umf n MET 266 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1umf n ASP 267 N -2.28 0.00 -0.49 7.83 4.64 -1.26 -5.02 116.55 119.97 1umf n ASP 267 Ca 0.00 0.00 -0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1umf n ASP 267 Cb 0.00 0.03 -0.00 0.00 -1.04 0.00 0.00 41.12 40.11 1umf n ASP 267 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1umf n GLN 268 N -1.16 0.00 0.00 -0.67 6.02 -1.26 -5.06 117.38 115.25 1umf n GLN 268 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1umf n GLN 268 Cb 0.00 0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.27 1umf n GLN 268 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1umf n LYS 269 N 0.00 0.00 -3.66 -1.09 5.02 -1.26 -5.15 118.16 112.02 1umf n LYS 269 Ca -0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 1umf n LYS 269 Cb 0.49 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.42 1umf n LYS 269 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1umf s GLY 270 N -1.11 -0.50 0.01 0.72 0.00 -1.26 -4.93 107.32 100.25 1umf s GLY 270 Ca 0.00 1.90 -0.02 0.00 0.00 0.00 0.00 44.72 46.60 1umf s GLY 270 CO 0.00 2.43 0.03 0.69 0.00 0.00 0.00 173.10 176.25 1umf n PHE 271 N 4.98 -0.02 0.00 1.90 3.01 -1.26 -4.91 117.46 121.15 1umf n PHE 271 Ca -0.15 0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1umf n PHE 271 Cb 0.52 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 1umf n PHE 271 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1umf n LEU 272 N 0.11 1.40 -4.62 4.37 4.77 -1.26 -4.70 117.00 117.07 1umf n LEU 272 Ca 0.01 0.30 -0.43 0.00 -0.03 0.00 0.00 56.01 55.86 1umf n LEU 272 Cb 0.01 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 1umf n LEU 272 CO 0.03 -0.23 1.55 -0.94 -1.33 0.00 0.00 177.39 176.48 1umf s SER 273 N -1.93 6.09 -1.48 -1.43 1.04 -1.26 -4.88 113.70 109.84 1umf s SER 273 Ca 0.00 1.83 -0.08 0.00 0.48 0.00 0.00 55.95 58.17 1umf s SER 273 Cb 0.00 -2.53 0.01 0.00 0.10 0.00 0.00 66.02 63.61 1umf s SER 273 CO 0.00 -1.46 2.66 -3.20 0.98 0.00 0.00 173.24 172.21 1umf n ASN 274 N 9.37 8.11 0.18 7.02 5.15 -1.26 -4.48 115.26 139.35 1umf n ASN 274 Ca 0.22 -2.83 0.10 0.00 -0.60 0.00 0.00 54.58 51.47 1umf n ASN 274 Cb 0.45 -1.48 0.11 0.00 -0.53 0.00 0.00 39.78 38.33 1umf n ASN 274 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1umf h ARG 275 N 4.92 0.00 0.00 1.20 3.08 -1.96 -3.16 114.38 118.45 1umf h ARG 275 Ca 0.78 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.78 1umf h ARG 275 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1umf h ARG 275 CO 1.66 0.09 -0.21 0.77 -1.07 0.00 0.00 179.97 181.21 1umf h SER 276 N 0.00 0.00 -0.45 7.04 0.02 -1.87 0.53 113.55 118.82 1umf h SER 276 Ca -0.01 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1umf h SER 276 Cb 1.08 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 1umf h SER 276 CO 0.01 0.21 -0.10 0.61 -1.14 0.00 0.00 176.83 176.42 1umf n GLY 277 N 0.46 0.40 2.33 -3.77 0.00 -1.19 -3.13 105.19 100.28 1umf n GLY 277 Ca 0.01 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1umf n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 278 N -1.59 0.74 2.89 -0.02 0.00 -0.85 -1.43 105.19 104.93 1umf n GLY 278 Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1umf n GLY 278 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1umf s VAL 279 N -2.91 0.96 -0.07 1.61 1.01 -1.18 -1.51 120.40 118.31 1umf s VAL 279 Ca 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1umf s VAL 279 Cb 0.00 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.39 1umf s VAL 279 CO 0.00 0.33 -0.10 -0.22 0.00 0.00 0.00 175.10 175.12 1umf s LEU 280 N 1.73 1.46 -1.28 3.92 2.96 0.33 -4.73 118.68 123.07 1umf s LEU 280 Ca 0.05 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1umf s LEU 280 Cb -0.13 -0.77 0.00 0.00 0.50 0.00 0.00 46.19 45.80 1umf s LEU 280 CO -0.08 -0.02 0.00 0.61 -1.32 0.00 0.00 176.35 175.54 1umf n GLY 281 N 4.17 0.15 2.47 7.98 0.00 -1.26 -1.83 105.19 116.87 1umf n GLY 281 Ca -0.20 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1umf n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umf n GLY 282 N -1.06 1.05 3.41 -0.02 0.00 -1.26 -5.02 105.19 102.29 1umf n GLY 282 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 1umf n GLY 282 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1umf s MET 283 N -0.18 1.51 0.11 1.61 -1.94 -0.76 -0.56 119.30 119.09 1umf s MET 283 Ca 0.00 -1.69 -0.31 0.00 -1.71 0.00 0.00 55.69 51.98 1umf s MET 283 Cb 0.00 -1.41 -0.07 0.00 2.01 0.00 0.00 34.83 35.36 1umf s MET 283 CO 0.00 0.23 1.25 -1.54 -0.01 0.00 0.00 175.02 174.95 1umf s SER 284 N -3.42 7.00 0.00 3.03 1.04 -0.45 0.12 113.70 121.03 1umf s SER 284 Ca 0.26 2.17 0.23 0.00 0.48 0.00 0.00 55.95 59.10 1umf s SER 284 Cb -0.02 -2.59 0.46 0.00 0.10 0.00 0.00 66.02 63.97 1umf s SER 284 CO 0.11 -0.50 1.41 -0.46 0.98 0.00 0.00 173.24 174.79 1umf n ASN 285 N 3.51 3.01 0.00 7.02 0.23 -0.57 -1.63 115.26 126.84 1umf n ASN 285 Ca 0.08 -1.93 0.00 0.00 -0.53 0.00 0.00 54.58 52.20 1umf n ASN 285 Cb 0.45 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 1umf n ASN 285 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1umf n GLY 286 N 1.41 2.77 3.77 4.83 0.00 -1.26 -4.63 105.19 112.07 1umf n GLY 286 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1umf n GLY 286 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1umf s GLU 287 N -0.28 0.92 0.36 1.61 0.41 -1.26 -1.02 118.70 119.44 1umf s GLU 287 Ca 0.00 0.27 -0.28 0.00 -0.41 0.00 0.00 54.97 54.55 1umf s GLU 287 Cb 0.00 -1.82 -0.11 0.00 -1.78 0.00 0.00 34.13 30.43 1umf s GLU 287 CO 0.00 -2.34 1.46 -1.21 -0.49 0.00 0.00 175.26 172.67 1umf s GLU 288 N -5.27 4.16 -0.24 1.61 2.02 -1.26 -4.49 118.70 115.22 1umf s GLU 288 Ca 0.65 2.50 -0.21 0.00 0.02 0.00 0.00 54.97 57.93 1umf s GLU 288 Cb -0.15 -2.99 -0.02 0.00 0.10 0.00 0.00 34.13 31.08 1umf s GLU 288 CO 0.54 -0.47 0.68 0.42 0.02 0.00 0.00 175.26 176.44 1umf s ILE 289 N -1.08 4.96 -0.18 -1.63 1.01 -0.86 -2.00 121.20 121.42 1umf s ILE 289 Ca 0.52 1.25 -0.00 0.00 0.00 0.00 0.00 60.65 62.42 1umf s ILE 289 Cb -0.45 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.05 1umf s ILE 289 CO 0.61 0.03 -0.15 -0.63 0.00 0.00 0.00 174.94 174.79 1umf s ILE 290 N 2.42 2.57 -0.03 2.92 -1.09 -0.52 -1.80 121.20 125.68 1umf s ILE 290 Ca 0.29 -0.78 0.04 0.00 -2.23 0.00 0.00 60.65 57.97 1umf s ILE 290 Cb -0.16 -2.10 -0.00 0.00 -1.58 0.00 0.00 42.46 38.62 1umf s ILE 290 CO 0.09 0.50 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.48 1umf s VAL 291 N 1.16 1.12 -0.11 2.92 1.01 0.63 -0.80 120.40 126.33 1umf s VAL 291 Ca 0.01 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1umf s VAL 291 Cb -0.14 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 1umf s VAL 291 CO -0.06 0.33 -0.19 -0.13 0.00 0.00 0.00 175.10 175.05 1umf s ARG 292 N -0.01 3.11 -0.14 2.72 0.52 -0.63 0.51 118.95 125.02 1umf s ARG 292 Ca -0.01 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.43 1umf s ARG 292 Cb -0.09 -2.43 0.02 0.00 0.52 0.00 0.00 34.95 32.97 1umf s ARG 292 CO 0.01 0.24 -0.19 0.08 0.02 0.00 0.00 175.30 175.46 1umf s VAL 293 N 0.23 1.83 -0.26 3.52 1.01 -0.42 -0.79 120.40 125.53 1umf s VAL 293 Ca -0.12 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1umf s VAL 293 Cb -0.16 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1umf s VAL 293 CO 0.07 0.50 0.34 -1.00 0.00 0.00 0.00 175.10 175.01 1umf s HIS 294 N 1.07 3.26 -0.16 5.22 3.76 -0.59 -1.47 115.29 126.39 1umf s HIS 294 Ca -0.02 0.38 -0.07 0.00 -0.15 0.00 0.00 55.06 55.20 1umf s HIS 294 Cb -0.14 -2.52 -0.04 0.00 1.11 0.00 0.00 32.58 30.99 1umf s HIS 294 CO -0.06 -0.18 0.07 -0.06 -0.85 0.00 0.00 174.74 173.67 1umf s PHE 295 N 1.88 3.31 0.76 1.40 0.40 -0.47 -0.90 117.98 124.36 1umf s PHE 295 Ca 0.14 0.19 -0.11 0.00 -0.60 0.00 0.00 56.93 56.55 1umf s PHE 295 Cb -0.16 -2.01 0.05 0.00 0.51 0.00 0.00 43.02 41.41 1umf s PHE 295 CO 0.09 0.33 1.09 -1.59 0.70 0.00 0.00 175.22 175.84 1umf s LYS 296 N -0.10 2.41 0.58 0.44 -2.85 0.10 -2.49 119.74 117.84 1umf s LYS 296 Ca 0.07 0.62 -0.18 0.00 -1.00 0.00 0.00 55.97 55.48 1umf s LYS 296 Cb -0.12 -1.96 -0.04 0.00 -2.06 0.00 0.00 37.83 33.65 1umf s LYS 296 CO 0.01 -1.39 1.14 -1.25 0.10 0.00 0.00 175.35 173.97 1umf s PRO 297 N -5.20 3.12 0.16 1.78 0.04 -1.26 -4.54 135.00 129.10 1umf s PRO 297 Ca 0.60 1.62 -0.33 0.00 0.04 0.00 0.00 61.00 62.92 1umf s PRO 297 Cb -0.13 -1.97 -0.16 0.00 0.04 0.00 0.00 34.50 32.27 1umf s PRO 297 CO 0.54 -1.04 1.13 2.41 0.04 0.00 0.00 177.00 180.08 1umf n THR 298 N -1.63 0.87 0.00 1.26 -1.04 -1.26 -4.91 114.28 107.58 1umf n THR 298 Ca 0.12 -0.22 -0.12 0.00 -2.04 0.00 0.00 64.05 61.79 1umf n THR 298 Cb 0.51 -0.76 -0.08 0.00 -1.82 0.00 0.00 70.33 68.19 1umf n THR 298 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1umf h PRO 299 N 3.26 0.05 -6.34 -2.82 0.11 -1.88 -3.43 132.00 120.95 1umf h PRO 299 Ca -0.43 -0.01 -0.57 0.00 0.11 0.00 0.00 66.00 65.10 1umf h PRO 299 Cb 1.35 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.42 1umf h PRO 299 CO 0.69 0.25 1.08 -1.12 -0.21 0.00 0.00 178.00 178.70 1umf s SER 300 N -5.46 6.42 0.00 -2.05 0.01 -1.26 -4.90 113.70 106.46 1umf s SER 300 Ca -0.14 1.33 0.03 0.00 1.31 0.00 0.00 55.95 58.48 1umf s SER 300 Cb 0.05 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 1umf s SER 300 CO 0.67 -1.27 -0.10 0.27 0.41 0.00 0.00 173.24 173.22 1umf s ILE 301 N 5.14 0.81 -1.40 1.44 -4.36 -1.26 -4.73 121.20 116.84 1umf s ILE 301 Ca 0.66 -0.55 -0.09 0.00 -0.26 0.00 0.00 60.65 60.41 1umf s ILE 301 Cb -0.20 -0.70 -0.08 0.00 1.25 0.00 0.00 42.46 42.73 1umf s ILE 301 CO 0.28 0.14 2.69 0.33 0.24 0.00 0.00 174.94 178.63 1umf n PHE 302 N 2.60 2.09 -4.06 1.37 -0.00 -1.22 -4.14 117.46 114.10 1umf n PHE 302 Ca -0.15 -2.74 -0.08 0.00 -0.00 0.00 0.00 57.45 54.48 1umf n PHE 302 Cb 0.56 -2.24 -0.10 0.00 -0.00 0.00 0.00 39.48 37.70 1umf n PHE 302 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 1umf s GLN 303 N 2.58 0.53 -0.25 -4.13 -0.21 -1.26 -4.90 119.66 112.02 1umf s GLN 303 Ca 0.60 -1.00 -0.29 0.00 0.02 0.00 0.00 55.36 54.69 1umf s GLN 303 Cb 0.15 0.10 -0.00 0.00 1.00 0.00 0.00 33.01 34.26 1umf s GLN 303 CO -0.05 -0.07 1.25 -1.25 -2.12 0.00 0.00 175.29 173.05 1umf s PRO 304 N -2.93 4.07 0.04 2.91 0.04 -1.26 -4.37 135.00 133.51 1umf s PRO 304 Ca -0.01 1.39 0.09 0.00 0.04 0.00 0.00 61.00 62.51 1umf s PRO 304 Cb 0.00 -3.81 -0.03 0.00 0.04 0.00 0.00 34.50 30.71 1umf s PRO 304 CO -0.06 -0.91 -0.25 -0.65 0.04 0.00 0.00 177.00 175.17 1umf s GLN 305 N 3.80 1.88 0.22 4.56 -0.21 -0.75 -4.95 119.66 124.20 1umf s GLN 305 Ca 0.54 -1.07 -0.30 0.00 0.02 0.00 0.00 55.36 54.55 1umf s GLN 305 Cb -0.18 -2.02 -0.08 0.00 1.00 0.00 0.00 33.01 31.73 1umf s GLN 305 CO 0.18 0.52 0.95 1.03 -2.12 0.00 0.00 175.29 175.85 1umf s ARG 306 N -1.19 4.83 0.04 2.91 0.52 -1.26 -1.29 118.95 123.51 1umf s ARG 306 Ca 0.12 1.49 -0.28 0.00 -0.52 0.00 0.00 55.73 56.53 1umf s ARG 306 Cb -0.10 -3.30 0.10 0.00 0.52 0.00 0.00 34.95 32.17 1umf s ARG 306 CO 0.02 0.46 1.18 -0.08 0.02 0.00 0.00 175.30 176.91 1umf s THR 307 N -0.97 0.00 0.52 0.02 -1.32 -0.98 -4.91 115.64 108.00 1umf s THR 307 Ca 0.42 -0.36 0.07 0.00 -1.21 0.00 0.00 61.69 60.61 1umf s THR 307 Cb -0.26 -2.11 0.03 0.00 -1.51 0.00 0.00 72.50 68.65 1umf s THR 307 CO 0.32 0.00 0.47 0.27 -2.21 0.00 0.00 174.62 173.47 1umf s ILE 308 N -2.62 2.01 0.48 5.08 -4.36 -1.26 -0.26 121.20 120.27 1umf s ILE 308 Ca 0.15 -1.36 0.04 0.00 -0.26 0.00 0.00 60.65 59.22 1umf s ILE 308 Cb 0.02 -2.37 -0.02 0.00 1.25 0.00 0.00 42.46 41.34 1umf s ILE 308 CO -0.01 0.00 0.10 1.51 0.24 0.00 0.00 174.94 176.77 1umf s ASP 309 N -4.31 4.21 0.46 4.36 -4.77 -1.06 -2.43 116.67 113.12 1umf s ASP 309 Ca 0.43 -1.44 0.13 0.00 -3.30 0.00 0.00 52.55 48.37 1umf s ASP 309 Cb -0.03 0.16 0.69 0.00 -1.09 0.00 0.00 42.92 42.65 1umf s ASP 309 CO 0.26 -0.76 1.30 0.40 0.70 0.00 0.00 175.17 177.06 1umf h ILE 310 N 1.35 0.00 0.00 2.11 2.04 -1.22 0.28 117.51 122.07 1umf h ILE 310 Ca -0.43 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1umf h ILE 310 Cb 1.29 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1umf h ILE 310 CO 0.72 0.00 -0.93 0.59 0.00 0.00 0.00 178.15 178.53 1umf n ASN 311 N -2.26 0.84 0.00 1.72 3.02 -1.26 -5.02 115.26 112.30 1umf n ASN 311 Ca -0.01 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 1umf n ASN 311 Cb 0.52 1.13 0.00 0.00 -0.61 0.00 0.00 39.78 40.82 1umf n ASN 311 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1umf n GLY 312 N 1.41 2.13 3.60 7.41 0.00 0.99 -5.08 105.19 115.66 1umf n GLY 312 Ca 0.02 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 1umf n GLY 312 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1umf n ASN 313 N 0.14 0.93 -4.74 1.61 5.03 -1.26 -4.48 115.26 112.49 1umf n ASN 313 Ca 0.00 0.94 -0.41 0.00 0.87 0.00 0.00 54.58 55.98 1umf n ASN 313 Cb 0.00 -1.35 -0.04 0.00 -1.02 0.00 0.00 39.78 37.37 1umf n ASN 313 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1umf s GLU 314 N -2.26 4.63 0.22 3.52 2.02 -1.26 -2.56 118.70 123.01 1umf s GLU 314 Ca 0.67 1.67 -0.10 0.00 0.02 0.00 0.00 54.97 57.23 1umf s GLU 314 Cb -0.50 -3.29 -0.01 0.00 0.10 0.00 0.00 34.13 30.43 1umf s GLU 314 CO 0.54 0.14 0.37 0.00 0.02 0.00 0.00 175.26 176.32 1umf s GLU 316 N -4.03 4.09 -0.37 0.00 2.12 -1.26 -2.32 118.70 116.93 1umf s GLU 316 Ca 0.24 -0.27 -0.15 0.00 0.36 0.00 0.00 54.97 55.15 1umf s GLU 316 Cb 0.02 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 30.94 1umf s GLU 316 CO 0.07 0.15 0.34 0.00 -0.54 0.00 0.00 175.26 175.28 1umf s LEU 318 N 1.92 3.60 -0.72 0.00 1.98 -1.26 -1.80 118.68 122.39 1umf s LEU 318 Ca 0.09 -1.69 -0.19 0.00 -2.89 0.00 0.00 54.13 49.45 1umf s LEU 318 Cb -0.17 -1.39 0.12 0.00 0.66 0.00 0.00 46.19 45.41 1umf s LEU 318 CO 0.12 -0.31 0.85 -0.76 -1.89 0.00 0.00 176.35 174.35 1umf s LEU 319 N 1.17 5.37 1.13 -0.68 1.43 -1.26 -4.49 118.68 121.35 1umf s LEU 319 Ca 0.03 -1.70 -0.15 0.00 -1.03 0.00 0.00 54.13 51.28 1umf s LEU 319 Cb -0.19 -2.33 0.25 0.00 0.03 0.00 0.00 46.19 43.96 1umf s LEU 319 CO -0.10 -1.07 1.06 -0.54 0.23 0.00 0.00 176.35 175.94 1umf s LYS 320 N 2.52 -0.65 0.00 1.70 3.01 -0.80 -3.60 119.74 121.92 1umf s LYS 320 Ca 0.19 0.40 0.00 0.00 -1.01 0.00 0.00 55.97 55.55 1umf s LYS 320 Cb -0.17 -1.62 0.00 0.00 -1.01 0.00 0.00 37.83 35.03 1umf s LYS 320 CO 0.01 -3.43 0.00 0.41 0.51 0.00 0.00 175.35 172.85 1umf n GLY 321 N -0.38 -0.76 3.75 -3.33 0.00 -1.26 -4.58 105.19 98.64 1umf n GLY 321 Ca 0.07 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.01 1umf n GLY 321 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1umf s ARG 322 N -1.71 4.26 0.41 1.61 3.00 -1.26 -4.69 118.95 120.57 1umf s ARG 322 Ca 0.00 0.54 0.07 0.00 0.00 0.00 0.00 55.73 56.33 1umf s ARG 322 Cb 0.00 -3.37 -0.08 0.00 0.00 0.00 0.00 34.95 31.50 1umf s ARG 322 CO 0.00 0.31 0.01 -1.01 0.00 0.00 0.00 175.30 174.62 1umf s HIS 323 N 0.08 2.49 -0.17 -0.53 3.76 -1.26 -5.09 115.29 114.57 1umf s HIS 323 Ca 0.27 -0.68 -0.29 0.00 -0.15 0.00 0.00 55.06 54.21 1umf s HIS 323 Cb -0.16 -1.77 -0.02 0.00 1.11 0.00 0.00 32.58 31.74 1umf s HIS 323 CO 0.13 0.44 1.40 0.34 -0.85 0.00 0.00 174.74 176.19 1umf s ASP 324 N -3.71 6.77 0.41 1.40 -1.08 -1.26 -4.90 116.67 114.29 1umf s ASP 324 Ca 0.34 1.71 0.20 0.00 -0.52 0.00 0.00 52.55 54.29 1umf s ASP 324 Cb 0.10 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.90 1umf s ASP 324 CO 0.18 -0.91 1.84 1.55 0.52 0.00 0.00 175.17 178.34 1umf h PRO 325 N 9.00 0.00 -1.63 4.34 0.13 -1.94 -3.42 132.00 138.48 1umf h PRO 325 Ca -0.30 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.60 1umf h PRO 325 Cb 1.12 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.98 1umf h PRO 325 CO 0.98 0.30 -0.57 0.00 -0.23 0.00 0.00 178.00 178.48 1umf h ILE 327 N 5.47 0.45 -1.00 0.00 3.07 -1.80 -2.66 117.51 121.04 1umf h ILE 327 Ca -0.00 -0.14 0.24 0.00 1.55 0.00 0.00 64.86 66.50 1umf h ILE 327 Cb 1.11 1.09 -0.09 0.00 -0.27 0.00 0.00 36.82 38.66 1umf h ILE 327 CO 0.20 0.03 0.64 0.00 -1.05 0.00 0.00 178.15 177.97 1umf h ALA 328 N 1.97 2.08 0.70 0.16 0.00 -1.87 0.30 119.26 122.60 1umf h ALA 328 Ca -0.00 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1umf h ALA 328 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1umf h ALA 328 CO 0.00 -0.46 -0.39 0.82 0.00 0.00 0.00 179.25 179.22 1umf h ILE 329 N 0.49 0.00 -0.51 0.00 2.04 -1.84 0.68 117.51 118.37 1umf h ILE 329 Ca 0.57 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.35 1umf h ILE 329 Cb 1.29 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1umf h ILE 329 CO -0.30 0.00 0.02 0.03 0.00 0.00 0.00 178.15 177.90 1umf h ARG 330 N -1.02 0.85 -0.12 2.37 3.08 -1.67 -2.38 114.38 115.50 1umf h ARG 330 Ca -0.10 -0.23 0.03 0.00 0.07 0.00 0.00 59.98 59.76 1umf h ARG 330 Cb 0.80 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 1umf h ARG 330 CO 0.12 0.84 0.11 0.78 -1.07 0.00 0.00 179.97 180.74 1umf h GLY 331 N 0.99 0.00 1.61 0.04 0.00 -0.24 -1.68 103.07 103.80 1umf h GLY 331 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.46 1umf h GLY 331 CO 0.02 0.00 0.10 1.48 0.00 0.00 0.00 176.54 178.13 1umf h SER 332 N 0.00 0.45 -0.12 0.19 4.64 -0.31 -0.57 113.55 117.83 1umf h SER 332 Ca 0.06 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.14 1umf h SER 332 Cb 0.27 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1umf h SER 332 CO -0.00 0.45 -0.61 0.58 -0.87 0.00 0.00 176.83 176.38 1umf h VAL 333 N 0.49 1.30 -0.41 0.95 2.07 -1.42 -2.49 116.25 116.74 1umf h VAL 333 Ca 0.12 -1.83 -0.06 0.00 0.82 0.00 0.00 66.70 65.74 1umf h VAL 333 Cb 0.17 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1umf h VAL 333 CO -0.01 0.58 0.01 0.58 0.02 0.00 0.00 177.57 178.75 1umf h VAL 334 N 0.54 1.26 -0.52 2.57 2.07 -1.35 -1.57 116.25 119.26 1umf h VAL 334 Ca -0.00 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1umf h VAL 334 Cb 1.20 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1umf h VAL 334 CO 0.12 0.34 0.33 0.00 0.02 0.00 0.00 177.57 178.39 1umf h GLU 336 N 0.70 0.67 -0.43 0.00 4.81 -1.03 -1.07 114.58 118.23 1umf h GLU 336 Ca 0.19 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1umf h GLU 336 Cb -0.07 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1umf h GLU 336 CO -0.04 0.70 0.06 0.77 -0.73 0.00 0.00 179.01 179.78 1umf h SER 337 N 0.53 0.70 -0.54 1.04 0.02 -0.29 -2.25 113.55 112.75 1umf h SER 337 Ca 0.13 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 1umf h SER 337 Cb 0.34 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 1umf h SER 337 CO 0.00 0.78 0.28 -0.07 -1.14 0.00 0.00 176.83 176.68 1umf h LEU 338 N 0.58 0.72 -0.59 5.07 3.38 -0.44 -0.45 115.31 123.58 1umf h LEU 338 Ca 0.13 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 1umf h LEU 338 Cb 0.39 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1umf h LEU 338 CO 0.01 0.61 -0.10 0.25 0.09 0.00 0.00 178.44 179.30 1umf h LEU 339 N 0.81 1.02 0.06 1.67 5.85 -1.01 -1.20 115.31 122.50 1umf h LEU 339 Ca 0.20 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1umf h LEU 339 Cb 0.08 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 1umf h LEU 339 CO -0.03 1.12 -0.05 0.00 -0.34 0.00 0.00 178.44 179.14 1umf h ALA 340 N 0.96 -0.10 -0.49 1.25 0.00 -0.70 0.09 119.26 120.27 1umf h ALA 340 Ca 0.14 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1umf h ALA 340 Cb 0.67 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1umf h ALA 340 CO 0.05 -0.57 0.23 -0.07 0.00 0.00 0.00 179.25 178.90 1umf h LEU 341 N -0.12 0.32 -0.20 0.00 3.38 -0.94 -0.45 115.31 117.30 1umf h LEU 341 Ca 0.00 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1umf h LEU 341 Cb 0.12 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1umf h LEU 341 CO -0.01 0.23 0.00 0.58 0.09 0.00 0.00 178.44 179.32 1umf h VAL 342 N 0.46 1.25 -0.68 1.22 2.07 -1.00 -1.82 116.25 117.75 1umf h VAL 342 Ca 0.22 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 1umf h VAL 342 Cb 0.14 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1umf h VAL 342 CO -0.16 0.27 0.27 0.25 0.02 0.00 0.00 177.57 178.22 1umf h LEU 343 N 0.12 0.94 -0.77 2.57 5.85 -0.82 -0.77 115.31 122.42 1umf h LEU 343 Ca 0.06 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 1umf h LEU 343 Cb 0.39 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1umf h LEU 343 CO 0.01 0.85 0.36 0.00 -0.34 0.00 0.00 178.44 179.32 1umf h ALA 344 N 1.12 1.00 -0.18 1.25 0.00 -1.04 0.16 119.26 121.57 1umf h ALA 344 Ca 0.23 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1umf h ALA 344 Cb 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1umf h ALA 344 CO -0.02 0.57 0.05 0.22 0.00 0.00 0.00 179.25 180.08 1umf h ASP 345 N 1.09 0.05 -0.60 0.00 -0.00 -0.82 -2.06 116.42 114.07 1umf h ASP 345 Ca 0.26 0.02 -0.04 0.00 -0.00 0.00 0.00 57.03 57.27 1umf h ASP 345 Cb 0.14 0.02 -0.03 0.00 -0.00 0.00 0.00 39.33 39.46 1umf h ASP 345 CO -0.03 0.06 0.23 0.24 -0.00 0.00 0.00 179.24 179.73 1umf h MET 346 N 0.14 0.95 -0.87 0.28 2.86 -0.59 -1.07 114.93 116.63 1umf h MET 346 Ca 0.08 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1umf h MET 346 Cb 0.06 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 1umf h MET 346 CO -0.09 0.80 0.54 0.28 1.06 0.00 0.00 176.91 179.49 1umf h VAL 347 N 0.93 1.24 0.05 -2.22 2.07 -0.25 -1.80 116.25 116.26 1umf h VAL 347 Ca 0.21 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1umf h VAL 347 Cb 0.22 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 1umf h VAL 347 CO -0.01 0.24 -0.03 -0.07 0.02 0.00 0.00 177.57 177.72 1umf h LEU 348 N 1.19 -0.06 -1.65 2.57 3.38 -0.79 -3.16 115.31 116.79 1umf h LEU 348 Ca 0.31 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 58.00 1umf h LEU 348 Cb -0.07 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1umf h LEU 348 CO -0.06 0.33 0.35 -0.07 0.09 0.00 0.00 178.44 179.07 1umf h LEU 349 N -0.46 0.38 -1.99 1.67 3.38 -1.11 -1.82 115.31 115.36 1umf h LEU 349 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1umf h LEU 349 Cb 0.41 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1umf h LEU 349 CO 0.01 0.24 -0.04 -1.13 0.09 0.00 0.00 178.44 177.62 1umf h ASN 350 N 0.43 0.00 0.00 -0.43 -1.24 -1.29 -2.97 115.58 110.08 1umf h ASN 350 Ca 0.23 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.24 1umf h ASN 350 Cb 0.35 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.40 1umf h ASN 350 CO -0.06 0.04 0.10 -0.07 -1.29 0.00 0.00 177.43 176.15 1umf h LEU 351 N 0.00 0.00 -1.59 0.34 3.38 -1.38 -1.60 115.31 114.46 1umf h LEU 351 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1umf h LEU 351 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1umf h LEU 351 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1umf n THR 352 N -2.70 0.14 0.01 0.22 -2.24 -1.12 -4.65 114.28 103.94 1umf n THR 352 Ca -0.02 -0.45 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1umf n THR 352 Cb 0.15 0.91 -0.08 0.00 -2.10 0.00 0.00 70.33 69.21 1umf n THR 352 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1umf h SER 353 N 3.55 0.01 -3.60 3.42 0.02 -1.51 -3.44 113.55 112.00 1umf h SER 353 Ca 0.00 -0.21 -0.68 0.00 -0.84 0.00 0.00 61.79 60.06 1umf h SER 353 Cb 0.76 -0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.11 1umf h SER 353 CO 0.00 0.22 -0.69 -0.54 -1.14 0.00 0.00 176.83 174.68 1umf s LYS 354 N -5.34 2.89 0.53 3.45 1.02 -1.26 -4.99 119.74 116.04 1umf s LYS 354 Ca -0.14 -0.54 0.21 0.00 0.02 0.00 0.00 55.97 55.51 1umf s LYS 354 Cb 0.04 -2.64 1.35 0.00 -0.52 0.00 0.00 37.83 36.06 1umf s LYS 354 CO 0.67 0.60 2.08 0.97 -0.92 0.00 0.00 175.35 178.75 1umf h ILE 355 N 4.40 0.86 -0.02 2.17 6.09 -1.97 0.16 117.51 129.20 1umf h ILE 355 Ca -0.46 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.02 1umf h ILE 355 Cb 1.18 0.88 -0.00 0.00 0.47 0.00 0.00 36.82 39.34 1umf h ILE 355 CO 0.54 0.00 -0.04 1.05 -3.07 0.00 0.00 178.15 176.63 1umf h GLU 356 N 0.00 0.03 -0.20 2.19 4.11 -1.99 -1.09 114.58 117.64 1umf h GLU 356 Ca 0.11 -0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.53 1umf h GLU 356 Cb 0.45 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1umf h GLU 356 CO -0.00 0.07 0.08 1.88 0.07 0.00 0.00 179.01 181.11 1umf h TYR 357 N 0.03 0.30 -0.24 2.06 0.99 -1.00 -0.67 116.97 118.43 1umf h TYR 357 Ca 0.01 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.71 1umf h TYR 357 Cb 0.09 -0.09 -0.01 0.00 1.00 0.00 0.00 36.73 37.72 1umf h TYR 357 CO 0.00 0.34 0.14 -0.07 -0.00 0.00 0.00 178.16 178.56 1umf h LEU 358 N 0.17 0.29 -0.27 3.88 4.07 -1.29 -1.86 115.31 120.31 1umf h LEU 358 Ca 0.07 -0.07 0.01 0.00 0.08 0.00 0.00 57.88 57.97 1umf h LEU 358 Cb 0.16 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 1umf h LEU 358 CO -0.01 0.28 0.14 0.11 -1.08 0.00 0.00 178.44 177.88 1umf h LYS 359 N 0.29 0.29 -0.87 1.13 1.57 -1.15 0.30 116.57 118.12 1umf h LYS 359 Ca 0.08 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1umf h LYS 359 Cb 0.04 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.23 1umf h LYS 359 CO -0.01 0.19 0.57 1.15 -0.57 0.00 0.00 179.45 180.78 1umf h THR 360 N 0.30 1.06 0.20 -0.16 2.02 -0.91 0.24 112.91 115.66 1umf h THR 360 Ca 0.11 -0.34 -0.29 0.00 0.77 0.00 0.00 66.41 66.66 1umf h THR 360 Cb 0.01 -0.01 0.03 0.00 -1.74 0.00 0.00 68.15 66.44 1umf h THR 360 CO -0.06 0.18 -1.31 0.40 0.37 0.00 0.00 175.52 175.10 1umf h ILE 361 N 0.98 1.29 0.00 3.11 2.04 -0.84 -3.28 117.51 120.81 1umf h ILE 361 Ca 0.38 -2.60 -0.18 0.00 1.00 0.00 0.00 64.86 63.46 1umf h ILE 361 Cb 0.21 3.03 -0.03 0.00 -0.74 0.00 0.00 36.82 39.30 1umf h ILE 361 CO -0.14 0.78 -1.01 1.88 0.00 0.00 0.00 178.15 179.66 1umf h TYR 362 N -0.06 0.00 0.00 1.37 0.05 -0.27 -3.36 116.97 114.70 1umf h TYR 362 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.54 1umf h TYR 362 Cb 1.97 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.71 1umf h TYR 362 CO 0.15 1.31 0.00 -0.91 -1.05 0.00 0.00 178.16 177.65 1umf h ASN 363 N -1.00 0.00 -1.36 3.88 2.35 -0.67 -3.20 115.58 115.59 1umf h ASN 363 Ca -0.27 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 54.89 1umf h ASN 363 Cb 1.19 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 39.15 1umf h ASN 363 CO -0.16 0.00 -0.63 -0.62 -1.65 0.00 0.00 177.43 174.36 1umf n GLU 364 N -2.46 3.43 0.00 0.81 1.02 -1.12 -5.02 120.64 117.30 1umf n GLU 364 Ca 0.03 -4.36 0.00 0.00 -0.02 0.00 0.00 57.16 52.81 1umf n GLU 364 Cb 0.33 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.49 1umf n GLU 364 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60