#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 4.90 -4.14 6.12 6.94 -1.26 -4.92 115.26 122.90 1umf n ASN 2 Ca 0.00 -2.63 -0.29 0.00 -0.02 0.00 0.00 54.58 51.63 1umf n ASN 2 Cb 0.00 -0.59 -0.17 0.00 -2.36 0.00 0.00 39.78 36.66 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 -2.19 1.69 -0.13 5.53 2.01 -1.26 -1.28 115.64 120.01 1umf s THR 3 Ca 0.50 -0.80 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 1umf s THR 3 Cb 0.35 -1.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 1umf s THR 3 CO 0.20 0.48 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.32 1umf s LEU 4 N 0.50 3.09 0.00 4.42 2.96 0.33 -4.95 118.68 125.04 1umf s LEU 4 Ca -0.17 -0.17 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1umf s LEU 4 Cb -0.17 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.80 1umf s LEU 4 CO 0.06 0.20 0.00 0.61 -1.32 0.00 0.00 176.35 175.90 1umf n GLY 5 N 3.32 2.67 0.14 7.98 0.00 -1.26 -0.23 105.19 117.80 1umf n GLY 5 Ca -0.18 -1.87 -0.26 0.00 0.00 0.00 0.00 46.02 43.71 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 0.77 0.60 -0.02 1.61 3.00 -1.26 -4.74 116.66 116.62 1umf n ARG 6 Ca 0.00 0.22 -0.03 0.00 -0.00 0.00 0.00 57.85 58.05 1umf n ARG 6 Cb 0.00 -1.49 -0.02 0.00 0.00 0.00 0.00 32.46 30.95 1umf n ARG 6 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1umf n PHE 7 N -3.94 0.00 -2.96 -0.14 7.35 -1.26 -4.78 117.46 111.73 1umf n PHE 7 Ca -0.52 0.00 -0.44 0.00 -0.76 0.00 0.00 57.45 55.73 1umf n PHE 7 Cb 0.92 -0.14 -0.04 0.00 0.35 0.00 0.00 39.48 40.57 1umf n PHE 7 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1umf s LEU 8 N -5.22 4.88 -0.29 -2.13 2.96 -1.26 -3.98 118.68 113.64 1umf s LEU 8 Ca -0.05 -1.39 -0.08 0.00 -0.22 0.00 0.00 54.13 52.40 1umf s LEU 8 Cb 0.01 -2.38 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 1umf s LEU 8 CO 0.09 -1.25 0.10 -0.13 -1.32 0.00 0.00 176.35 173.84 1umf s ARG 9 N 3.28 3.31 -0.23 1.98 0.52 0.74 -4.32 118.95 124.23 1umf s ARG 9 Ca 0.21 -0.72 -0.15 0.00 -0.52 0.00 0.00 55.73 54.55 1umf s ARG 9 Cb -0.16 -3.43 -0.04 0.00 0.52 0.00 0.00 34.95 31.84 1umf s ARG 9 CO 0.04 -0.37 0.38 -1.17 0.02 0.00 0.00 175.30 174.20 1umf s LEU 10 N 1.57 4.12 -0.06 2.53 2.96 0.68 -1.24 118.68 129.23 1umf s LEU 10 Ca 0.04 0.43 0.06 0.00 -0.22 0.00 0.00 54.13 54.44 1umf s LEU 10 Cb -0.17 -2.47 -0.01 0.00 0.50 0.00 0.00 46.19 44.05 1umf s LEU 10 CO 0.04 -0.11 -0.24 -0.89 -1.32 0.00 0.00 176.35 173.83 1umf s THR 11 N 1.54 1.98 0.19 3.68 2.01 -0.08 -0.51 115.64 124.46 1umf s THR 11 Ca 0.17 -1.02 0.07 0.00 0.31 0.00 0.00 61.69 61.23 1umf s THR 11 Cb -0.15 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 1umf s THR 11 CO 0.08 0.55 0.01 0.28 -0.69 0.00 0.00 174.62 174.86 1umf s THR 12 N -0.08 3.74 -1.53 -0.82 -1.32 -0.40 -1.08 115.64 114.14 1umf s THR 12 Ca -0.05 -1.48 0.23 0.00 -1.21 0.00 0.00 61.69 59.18 1umf s THR 12 Cb -0.14 -2.91 0.45 0.00 -1.51 0.00 0.00 72.50 68.39 1umf s THR 12 CO 0.04 -0.16 1.75 0.49 -2.21 0.00 0.00 174.62 174.53 1umf n PHE 13 N -0.28 0.00 -2.16 9.09 3.01 -0.90 -4.91 117.46 121.31 1umf n PHE 13 Ca -0.09 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.40 1umf n PHE 13 Cb 0.56 -0.23 -0.01 0.00 -0.01 0.00 0.00 39.48 39.79 1umf n PHE 13 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1umf n GLY 14 N 0.61 -2.00 3.70 1.37 0.00 -1.26 -4.83 105.19 102.77 1umf n GLY 14 Ca 0.12 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.24 2.68 -3.91 1.61 0.00 -1.26 -4.97 120.64 113.55 1umf n GLU 15 Ca 0.00 0.97 -0.09 0.00 0.00 0.00 0.00 57.16 58.04 1umf n GLU 15 Cb 0.09 -2.84 -0.07 0.00 0.00 0.00 0.00 31.44 28.62 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 2.12 0.10 -0.15 -1.84 1.04 -1.26 -5.06 113.70 108.66 1umf s SER 16 Ca 0.80 -0.76 0.16 0.00 0.48 0.00 0.00 55.95 56.63 1umf s SER 16 Cb -0.52 0.37 0.43 0.00 0.10 0.00 0.00 66.02 66.40 1umf s SER 16 CO 0.37 -0.79 1.20 0.00 0.98 0.00 0.00 173.24 175.00 1umf n HIS 17 N -0.12 0.15 -3.24 5.02 1.44 -1.26 -4.92 115.22 112.30 1umf n HIS 17 Ca -0.12 -1.22 -0.13 0.00 -2.01 0.00 0.00 57.72 54.25 1umf n HIS 17 Cb 0.63 -0.22 0.03 0.00 0.12 0.00 0.00 29.99 30.54 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 -0.56 2.23 0.10 -1.39 0.00 -1.26 -5.02 105.19 99.29 1umf n GLY 18 Ca 0.16 -2.20 0.14 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.40 0.43 -4.01 1.61 5.75 -1.26 -4.83 116.55 111.85 1umf n ASP 19 Ca 0.06 -0.47 -0.23 0.00 -0.01 0.00 0.00 54.79 54.15 1umf n ASP 19 Cb 0.36 -0.09 -0.16 0.00 -1.03 0.00 0.00 41.12 40.20 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 -2.54 0.95 -0.05 2.12 1.01 -1.26 -1.30 120.40 119.33 1umf s VAL 20 Ca 0.27 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1umf s VAL 20 Cb 0.20 -0.87 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 1umf s VAL 20 CO 0.49 0.30 -0.18 -0.51 0.00 0.00 0.00 175.10 175.20 1umf s ILE 21 N 0.46 1.51 0.36 2.22 1.10 -0.36 -4.97 121.20 121.52 1umf s ILE 21 Ca -0.09 -0.76 0.06 0.00 -0.51 0.00 0.00 60.65 59.35 1umf s ILE 21 Cb -0.13 -1.29 -0.07 0.00 0.15 0.00 0.00 42.46 41.12 1umf s ILE 21 CO 0.02 0.43 0.02 -0.83 -2.11 0.00 0.00 174.94 172.47 1umf s GLY 22 N 0.02 2.26 0.13 1.50 0.00 -1.26 -0.01 107.32 109.95 1umf s GLY 22 Ca -0.04 -2.16 -0.25 0.00 0.00 0.00 0.00 44.72 42.27 1umf s GLY 22 CO 0.02 -1.96 0.80 -0.32 0.00 0.00 0.00 173.10 171.64 1umf s GLY 23 N -3.59 -0.39 -0.06 0.20 0.00 -0.51 -2.12 107.32 100.85 1umf s GLY 23 Ca 0.35 0.43 -0.03 0.00 0.00 0.00 0.00 44.72 45.48 1umf s GLY 23 CO 0.16 0.14 0.13 0.54 0.00 0.00 0.00 173.10 174.07 1umf s VAL 24 N -3.47 -0.06 -0.30 1.40 0.11 -0.24 -0.92 120.40 116.92 1umf s VAL 24 Ca 0.07 0.19 -0.07 0.00 -2.93 0.00 0.00 61.98 59.24 1umf s VAL 24 Cb -0.02 -0.23 0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1umf s VAL 24 CO -0.05 0.08 0.08 -0.22 -3.33 0.00 0.00 175.10 171.66 1umf s LEU 25 N 1.20 3.87 0.20 2.54 2.96 -0.45 -0.90 118.68 128.10 1umf s LEU 25 Ca -0.09 -0.73 0.08 0.00 -0.22 0.00 0.00 54.13 53.17 1umf s LEU 25 Cb -0.12 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1umf s LEU 25 CO -0.06 -0.20 -0.03 -0.62 -1.32 0.00 0.00 176.35 174.12 1umf s ASP 26 N 1.49 4.53 0.00 3.68 2.15 -0.38 -0.96 116.67 127.19 1umf s ASP 26 Ca 0.02 -0.52 0.00 0.00 0.43 0.00 0.00 52.55 52.48 1umf s ASP 26 Cb -0.17 -0.87 0.00 0.00 -0.30 0.00 0.00 42.92 41.58 1umf s ASP 26 CO 0.02 0.07 0.00 0.61 -0.17 0.00 0.00 175.17 175.71 1umf n GLY 27 N -0.25 0.47 3.71 2.66 0.00 -1.26 -0.18 105.19 110.34 1umf n GLY 27 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.99 4.31 0.78 1.61 -1.94 -1.26 -4.73 119.30 117.07 1umf s MET 28 Ca 0.00 2.05 -0.12 0.00 -1.71 0.00 0.00 55.69 55.91 1umf s MET 28 Cb 0.00 -3.37 0.07 0.00 2.01 0.00 0.00 34.83 33.53 1umf s MET 28 CO 0.00 -0.49 1.13 -2.14 -0.01 0.00 0.00 175.02 173.51 1umf s PRO 29 N 1.59 1.99 0.62 2.03 0.02 -1.26 -4.18 135.00 135.82 1umf s PRO 29 Ca 0.65 1.43 -0.09 0.00 0.02 0.00 0.00 61.00 63.01 1umf s PRO 29 Cb -0.35 -1.85 -0.01 0.00 0.02 0.00 0.00 34.50 32.31 1umf s PRO 29 CO 0.29 -1.88 0.98 -1.54 -0.33 0.00 0.00 177.00 174.52 1umf s SER 30 N -2.79 5.79 0.00 2.53 1.04 -1.26 -4.28 113.70 114.73 1umf s SER 30 Ca 0.66 1.05 0.00 0.00 0.48 0.00 0.00 55.95 58.15 1umf s SER 30 Cb -0.22 -2.04 0.00 0.00 0.10 0.00 0.00 66.02 63.86 1umf s SER 30 CO 0.52 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 174.30 1umf n GLY 31 N -2.72 0.72 3.66 7.32 0.00 -0.43 -4.94 105.19 108.80 1umf n GLY 31 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.51 5.03 0.19 -0.61 1.01 -1.26 -4.85 121.20 118.20 1umf s ILE 32 Ca 0.00 1.17 -0.30 0.00 0.00 0.00 0.00 60.65 61.51 1umf s ILE 32 Cb 0.00 -3.94 -0.09 0.00 0.01 0.00 0.00 42.46 38.44 1umf s ILE 32 CO 0.00 0.12 1.38 -0.75 0.00 0.00 0.00 174.94 175.69 1umf s LYS 33 N 1.86 4.33 -0.51 2.79 2.20 -1.26 -1.35 119.74 127.80 1umf s LYS 33 Ca 0.28 2.15 -0.27 0.00 -0.36 0.00 0.00 55.97 57.78 1umf s LYS 33 Cb -0.16 -3.18 0.03 0.00 -1.51 0.00 0.00 37.83 33.02 1umf s LYS 33 CO 0.10 -0.37 1.05 0.42 -0.36 0.00 0.00 175.35 176.20 1umf s ILE 34 N 0.36 4.28 -0.95 5.43 -1.09 0.46 -4.93 121.20 124.75 1umf s ILE 34 Ca 0.60 0.84 -0.22 0.00 -2.23 0.00 0.00 60.65 59.64 1umf s ILE 34 Cb -0.39 -4.57 0.07 0.00 -1.58 0.00 0.00 42.46 35.99 1umf s ILE 34 CO 0.37 -1.05 1.33 -0.62 -1.23 0.00 0.00 174.94 173.74 1umf s ASP 35 N 2.58 6.48 0.35 3.58 -1.08 -1.26 -4.85 116.67 122.47 1umf s ASP 35 Ca 0.40 -1.48 0.05 0.00 -0.52 0.00 0.00 52.55 51.00 1umf s ASP 35 Cb -0.09 -2.52 0.64 0.00 -1.46 0.00 0.00 42.92 39.50 1umf s ASP 35 CO 0.27 -1.42 1.89 1.88 0.52 0.00 0.00 175.17 178.30 1umf h TYR 36 N 9.56 0.50 -0.42 -5.34 0.05 -1.99 -2.30 116.97 117.04 1umf h TYR 36 Ca 0.12 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 1umf h TYR 36 Cb 1.02 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.60 1umf h TYR 36 CO 1.22 0.50 0.15 0.00 -1.05 0.00 0.00 178.16 178.98 1umf h ALA 37 N 1.54 0.55 0.41 3.88 0.00 -1.99 -0.48 119.26 123.17 1umf h ALA 37 Ca 0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1umf h ALA 37 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1umf h ALA 37 CO 0.01 0.18 -0.21 1.25 0.00 0.00 0.00 179.25 180.48 1umf h LEU 38 N 0.54 -0.49 -0.35 0.00 5.85 -1.89 0.64 115.31 119.60 1umf h LEU 38 Ca 0.14 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.95 1umf h LEU 38 Cb 0.23 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 1umf h LEU 38 CO -0.01 -0.35 -0.22 0.25 -0.34 0.00 0.00 178.44 177.78 1umf h LEU 39 N -0.57 -0.72 -0.74 2.25 5.85 -1.33 0.99 115.31 121.04 1umf h LEU 39 Ca -0.05 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.84 1umf h LEU 39 Cb 0.44 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 1umf h LEU 39 CO 0.09 -0.25 0.47 -0.08 -0.34 0.00 0.00 178.44 178.33 1umf h GLU 40 N -0.17 0.91 -0.36 1.25 4.81 -0.88 -2.00 114.58 118.15 1umf h GLU 40 Ca 0.18 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1umf h GLU 40 Cb 0.44 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1umf h GLU 40 CO -0.45 0.60 -0.15 -0.97 -0.73 0.00 0.00 179.01 177.31 1umf h ASN 41 N 0.94 0.64 -0.57 1.04 -1.24 0.21 -2.32 115.58 114.27 1umf h ASN 41 Ca 0.29 -0.19 -0.03 0.00 0.71 0.00 0.00 56.30 57.08 1umf h ASN 41 Cb -0.02 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 38.84 1umf h ASN 41 CO -0.10 0.81 0.24 -0.33 -1.29 0.00 0.00 177.43 176.76 1umf h GLU 42 N 0.58 0.85 -0.50 6.67 4.39 -0.28 0.13 114.58 126.42 1umf h GLU 42 Ca 0.10 -0.15 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1umf h GLU 42 Cb 0.59 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1umf h GLU 42 CO 0.04 0.72 0.10 0.52 -1.16 0.00 0.00 179.01 179.23 1umf h MET 43 N 0.79 0.77 0.07 2.33 2.86 -1.14 -1.54 114.93 119.07 1umf h MET 43 Ca 0.19 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1umf h MET 43 Cb 0.18 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.72 1umf h MET 43 CO -0.02 0.71 -0.04 -0.22 1.06 0.00 0.00 176.91 178.40 1umf h LYS 44 N 0.74 -0.09 -0.83 1.72 3.64 -0.96 -3.10 116.57 117.68 1umf h LYS 44 Ca 0.16 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.67 1umf h LYS 44 Cb 0.30 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.05 1umf h LYS 44 CO 0.00 0.18 0.44 0.00 -2.27 0.00 0.00 179.45 177.80 1umf h ARG 45 N -0.37 0.66 -0.58 1.90 3.08 -0.64 -1.68 114.38 116.74 1umf h ARG 45 Ca -0.01 -0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.17 1umf h ARG 45 Cb 0.32 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1umf h ARG 45 CO 0.02 0.43 0.42 -0.09 -1.07 0.00 0.00 179.97 179.68 1umf h ARG 46 N 0.68 0.02 -1.32 0.04 2.43 -1.21 -1.49 114.38 113.52 1umf h ARG 46 Ca 0.43 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 1umf h ARG 46 Cb 0.54 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1umf h ARG 46 CO -0.32 0.01 0.00 1.04 -1.51 0.00 0.00 179.97 179.20 1umf n GLN 47 N -4.37 0.98 -4.12 0.20 6.02 -0.63 -4.80 117.38 110.66 1umf n GLN 47 Ca 0.11 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.76 1umf n GLN 47 Cb 0.64 -1.01 -0.06 0.00 1.02 0.00 0.00 30.24 30.83 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 0.82 -0.42 2.83 1.08 0.00 -0.56 -4.69 105.19 104.25 1umf n GLY 48 Ca 0.00 0.06 -0.52 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.94 0.08 0.00 -0.02 0.00 -1.25 -4.91 105.19 98.15 1umf n GLY 49 Ca 0.10 0.81 0.00 0.00 0.00 0.00 0.00 46.02 46.92 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 3.78 0.94 -2.15 1.61 1.85 -1.26 -4.61 116.66 116.81 1umf n ARG 50 Ca 0.29 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.71 1umf n ARG 50 Cb -0.04 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.34 1umf n ARG 50 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1umf s ASN 51 N 0.90 6.46 0.50 2.89 3.84 -1.26 -4.73 114.94 123.54 1umf s ASN 51 Ca 0.00 1.62 0.00 0.00 0.21 0.00 0.00 52.86 54.69 1umf s ASN 51 Cb 0.00 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.17 1umf s ASN 51 CO 0.00 -1.19 0.00 0.52 -2.79 0.00 0.00 177.10 173.64 1umf n VAL 52 N 6.27 -4.80 -3.63 -5.21 0.31 -1.26 -5.10 118.33 104.91 1umf n VAL 52 Ca 0.18 2.15 -0.06 0.00 -0.01 0.00 0.00 64.34 66.61 1umf n VAL 52 Cb 0.45 -3.01 -0.06 0.00 -0.91 0.00 0.00 33.84 30.32 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 -3.54 -0.20 0.20 3.52 -0.12 -1.26 -5.10 117.98 111.47 1umf s PHE 53 Ca 0.00 0.42 0.05 0.00 -0.05 0.00 0.00 56.93 57.35 1umf s PHE 53 Cb 0.00 0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 1umf s PHE 53 CO 0.00 -0.15 0.20 0.42 -0.05 0.00 0.00 175.22 175.64 1umf s ILE 54 N -0.56 4.67 -0.22 -4.49 1.01 -1.26 -4.99 121.20 115.35 1umf s ILE 54 Ca 0.05 -1.12 -0.17 0.00 0.00 0.00 0.00 60.65 59.41 1umf s ILE 54 Cb -0.03 -3.45 -0.08 0.00 0.01 0.00 0.00 42.46 38.92 1umf s ILE 54 CO -0.07 -0.21 0.89 0.35 0.00 0.00 0.00 174.94 175.90 1umf n THR 55 N -0.75 0.00 0.00 2.92 -2.24 -1.26 -4.72 114.28 108.23 1umf n THR 55 Ca -0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1umf n THR 55 Cb 0.56 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 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 3.07 0.00 0.00 -0.78 -0.02 -1.26 -3.17 135.00 132.84 1umf n PRO 56 Ca 0.23 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1umf n PRO 56 Cb -0.01 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1umf n PRO 56 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1umf n ARG 57 N -1.25 0.00 0.15 -0.52 0.63 -1.26 -1.75 116.66 112.66 1umf n ARG 57 Ca 0.00 0.01 0.12 0.00 -0.92 0.00 0.00 57.85 57.07 1umf n ARG 57 Cb 0.01 -0.52 0.27 0.00 0.45 0.00 0.00 32.46 32.67 1umf n ARG 57 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 1umf h LYS 58 N 0.00 0.00 -0.44 -0.14 2.10 -1.97 -3.31 116.57 112.82 1umf h LYS 58 Ca 0.00 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 1umf h LYS 58 Cb 0.00 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.31 1umf h LYS 58 CO 0.00 0.00 -0.03 0.93 -2.00 0.00 0.00 179.45 178.35 1umf h GLU 59 N 0.00 0.72 -3.75 0.07 4.39 -1.61 -3.47 114.58 110.93 1umf h GLU 59 Ca 0.00 -0.20 -0.17 0.00 0.34 0.00 0.00 59.36 59.33 1umf h GLU 59 Cb 0.86 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.37 1umf h GLU 59 CO 0.00 0.76 -0.05 -0.51 -1.16 0.00 0.00 179.01 178.04 1umf s ASP 60 N -6.68 0.53 -0.00 1.42 1.01 -0.72 -5.02 116.67 107.22 1umf s ASP 60 Ca -0.09 -1.31 -0.00 0.00 0.71 0.00 0.00 52.55 51.85 1umf s ASP 60 Cb 0.15 0.70 -0.00 0.00 1.01 0.00 0.00 42.92 44.78 1umf s ASP 60 CO 0.80 -1.38 0.01 0.47 0.21 0.00 0.00 175.17 175.28 1umf n ASP 61 N -1.27 0.00 -4.21 0.27 8.00 -1.26 -4.65 116.55 113.44 1umf n ASP 61 Ca -0.02 0.01 -0.32 0.00 0.71 0.00 0.00 54.79 55.17 1umf n ASP 61 Cb 0.61 -0.01 -0.17 0.00 -0.02 0.00 0.00 41.12 41.53 1umf n ASP 61 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1umf s LYS 62 N 0.01 2.99 -0.18 -1.24 1.02 -1.26 -4.96 119.74 116.13 1umf s LYS 62 Ca 0.01 -0.86 -0.18 0.00 0.02 0.00 0.00 55.97 54.95 1umf s LYS 62 Cb -0.01 -2.27 -0.03 0.00 -0.52 0.00 0.00 37.83 34.99 1umf s LYS 62 CO 0.00 0.16 0.51 0.08 -0.92 0.00 0.00 175.35 175.18 1umf s VAL 63 N 0.39 5.13 -0.32 3.17 1.01 -1.26 -3.84 120.40 124.68 1umf s VAL 63 Ca -0.18 0.96 -0.05 0.00 0.00 0.00 0.00 61.98 62.71 1umf s VAL 63 Cb -0.18 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1umf s VAL 63 CO 0.08 0.22 0.07 -0.70 0.00 0.00 0.00 175.10 174.77 1umf s GLU 64 N 1.35 2.69 -0.25 2.72 2.12 -0.10 -4.97 118.70 122.25 1umf s GLU 64 Ca 0.25 -1.12 -0.28 0.00 0.36 0.00 0.00 54.97 54.18 1umf s GLU 64 Cb -0.15 -3.37 0.01 0.00 0.26 0.00 0.00 34.13 30.88 1umf s GLU 64 CO 0.10 -0.60 1.02 0.42 -0.54 0.00 0.00 175.26 175.66 1umf s ILE 65 N 1.39 4.66 -0.74 -3.70 1.01 -1.26 -0.91 121.20 121.65 1umf s ILE 65 Ca -0.01 1.89 0.20 0.00 0.00 0.00 0.00 60.65 62.73 1umf s ILE 65 Cb -0.19 -4.31 -0.25 0.00 0.01 0.00 0.00 42.46 37.73 1umf s ILE 65 CO 0.02 -0.24 0.77 0.35 0.00 0.00 0.00 174.94 175.83 1umf n THR 66 N 5.45 0.00 -3.64 2.92 -2.24 0.90 -4.98 114.28 112.68 1umf n THR 66 Ca 0.11 -0.13 -0.06 0.00 -2.27 0.00 0.00 64.05 61.70 1umf n THR 66 Cb 0.46 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.45 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 -3.28 -0.28 0.00 3.42 1.04 -1.16 -4.89 113.70 108.55 1umf s SER 67 Ca 0.04 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1umf s SER 67 Cb 0.15 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1umf s SER 67 CO 0.84 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.86 1umf n GLY 68 N -0.38 0.78 2.93 7.32 0.00 -1.03 -2.99 105.19 111.82 1umf n GLY 68 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.01 0.97 -0.20 1.61 1.01 -1.26 -0.86 120.40 118.65 1umf s VAL 69 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1umf s VAL 69 Cb 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 36.38 35.46 1umf s VAL 69 CO 0.00 0.34 -0.06 0.12 0.00 0.00 0.00 175.10 175.50 1umf s PHE 70 N 1.36 2.13 -1.20 5.22 5.36 -0.13 -4.83 117.98 125.89 1umf s PHE 70 Ca -0.02 -1.48 -0.02 0.00 -0.96 0.00 0.00 56.93 54.45 1umf s PHE 70 Cb -0.14 -1.49 -0.01 0.00 -0.34 0.00 0.00 43.02 41.04 1umf s PHE 70 CO -0.04 -0.71 0.89 0.39 -1.46 0.00 0.00 175.22 174.29 1umf n GLU 71 N 4.75 -5.24 -1.88 10.12 1.02 -1.26 -2.73 120.64 125.42 1umf n GLU 71 Ca -0.12 0.77 -0.17 0.00 -0.02 0.00 0.00 57.16 57.62 1umf n GLU 71 Cb 0.46 -5.60 -0.04 0.00 -0.02 0.00 0.00 31.44 26.24 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 -3.11 -5.00 -3.86 1.62 8.00 -1.26 -5.00 116.55 107.95 1umf n ASP 72 Ca -0.25 0.21 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 1umf n ASP 72 Cb 0.66 -4.03 -0.14 0.00 -0.02 0.00 0.00 41.12 37.58 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 -2.73 0.05 0.32 1.24 0.08 -1.11 -0.40 117.98 115.43 1umf s PHE 73 Ca 0.00 0.01 -0.29 0.00 0.12 0.00 0.00 56.93 56.77 1umf s PHE 73 Cb 0.00 -0.07 -0.11 0.00 -0.57 0.00 0.00 43.02 42.27 1umf s PHE 73 CO 0.00 -0.02 1.49 -1.54 -0.10 0.00 0.00 175.22 175.06 1umf s SER 74 N 0.16 6.47 0.14 1.36 1.04 -0.46 -0.95 113.70 121.45 1umf s SER 74 Ca -0.01 2.90 0.24 0.00 0.48 0.00 0.00 55.95 59.55 1umf s SER 74 Cb -0.02 -2.65 0.25 0.00 0.10 0.00 0.00 66.02 63.71 1umf s SER 74 CO -0.00 -0.81 1.25 0.71 0.98 0.00 0.00 173.24 175.36 1umf h THR 75 N 3.24 0.00 0.00 2.02 1.35 -1.30 -1.14 112.91 117.08 1umf h THR 75 Ca -0.48 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1umf h THR 75 Cb 1.23 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1umf h THR 75 CO 0.72 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.60 1umf n GLY 76 N 1.30 0.15 4.01 5.82 0.00 -1.26 -4.67 105.19 110.55 1umf n GLY 76 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 2.66 0.34 2.61 -4.23 -1.26 -4.77 115.64 108.99 1umf s THR 77 Ca 0.00 -1.02 -0.28 0.00 -1.18 0.00 0.00 61.69 59.21 1umf s THR 77 Cb 0.00 -2.67 -0.12 0.00 1.34 0.00 0.00 72.50 71.05 1umf s THR 77 CO 0.00 0.00 1.37 -2.65 -0.54 0.00 0.00 174.62 172.80 1umf n PRO 78 N -1.98 2.30 -3.39 3.99 -0.02 -1.26 -4.62 135.00 130.01 1umf n PRO 78 Ca 0.11 0.81 -0.44 0.00 -2.02 0.00 0.00 63.50 61.95 1umf n PRO 78 Cb 0.60 -2.45 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 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 -0.95 4.94 0.11 4.25 1.01 -0.13 -2.45 121.20 127.97 1umf s ILE 79 Ca 0.56 -1.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.28 1umf s ILE 79 Cb -0.55 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 37.69 1umf s ILE 79 CO 0.61 -0.87 0.55 -0.83 0.00 0.00 0.00 174.94 174.40 1umf s GLY 80 N 3.04 2.54 -0.03 6.18 0.00 -1.16 -1.34 107.32 116.55 1umf s GLY 80 Ca 0.06 -0.07 -0.12 0.00 0.00 0.00 0.00 44.72 44.59 1umf s GLY 80 CO 0.00 0.27 0.27 -0.11 0.00 0.00 0.00 173.10 173.53 1umf s PHE 81 N -1.30 -0.16 0.05 1.90 -0.12 -0.09 -0.07 117.98 118.18 1umf s PHE 81 Ca 0.33 0.29 0.08 0.00 -0.05 0.00 0.00 56.93 57.59 1umf s PHE 81 Cb -0.17 0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.26 1umf s PHE 81 CO 0.19 -0.32 -0.21 -0.51 -0.05 0.00 0.00 175.22 174.31 1umf s LEU 82 N -1.04 2.46 -0.14 -1.99 1.43 -0.09 -1.42 118.68 117.89 1umf s LEU 82 Ca -0.11 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 1umf s LEU 82 Cb -0.05 -1.43 0.02 0.00 0.03 0.00 0.00 46.19 44.76 1umf s LEU 82 CO 0.03 0.25 -0.12 -0.63 0.23 0.00 0.00 176.35 176.10 1umf s ILE 83 N -0.91 1.41 -0.12 -0.59 1.01 0.99 -0.93 121.20 122.06 1umf s ILE 83 Ca 0.14 -0.53 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 1umf s ILE 83 Cb -0.10 -1.34 -0.05 0.00 0.01 0.00 0.00 42.46 40.98 1umf s ILE 83 CO 0.05 0.43 0.19 -1.00 0.00 0.00 0.00 174.94 174.61 1umf s HIS 84 N 1.52 3.57 0.00 3.97 3.76 -1.25 -1.22 115.29 125.63 1umf s HIS 84 Ca 0.04 0.57 0.00 0.00 -0.15 0.00 0.00 55.06 55.52 1umf s HIS 84 Cb -0.13 -2.08 0.00 0.00 1.11 0.00 0.00 32.58 31.48 1umf s HIS 84 CO -0.09 0.58 0.00 0.09 -0.85 0.00 0.00 174.74 174.47 1umf n ASN 85 N 2.44 0.08 -4.37 1.40 5.03 -0.42 -4.29 115.26 115.13 1umf n ASN 85 Ca -0.17 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 54.95 1umf n ASN 85 Cb 0.54 0.00 0.13 0.00 -1.02 0.00 0.00 39.78 39.43 1umf n ASN 85 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1umf n GLN 86 N 0.00 -0.59 -0.09 3.52 6.02 -1.26 -4.96 117.38 120.01 1umf n GLN 86 Ca 0.00 -0.14 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 1umf n GLN 86 Cb 0.00 -1.78 0.00 0.00 1.02 0.00 0.00 30.24 29.48 1umf n GLN 86 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1umf n ARG 87 N -1.62 0.00 -3.49 -1.09 1.74 -1.26 -4.92 116.66 106.02 1umf n ARG 87 Ca 0.05 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.85 1umf n ARG 87 Cb 0.56 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.89 1umf n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1umf s ALA 88 N 0.00 1.53 0.22 7.54 0.00 -1.26 -5.12 121.76 124.67 1umf s ALA 88 Ca 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 51.96 49.57 1umf s ALA 88 Cb 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1umf s ALA 88 CO 0.00 -2.04 0.00 2.89 0.00 0.00 0.00 175.76 176.61 1umf n ARG 89 N 3.24 -1.92 -0.27 0.00 -4.01 -1.26 -5.06 116.66 107.39 1umf n ARG 89 Ca 0.21 1.26 0.00 0.00 -1.04 0.00 0.00 57.85 58.28 1umf n ARG 89 Cb 0.42 -2.34 0.00 0.00 -3.04 0.00 0.00 32.46 27.50 1umf n ARG 89 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 1umf n SER 90 N -3.90 0.00 0.00 2.89 3.41 -1.26 -5.09 113.62 109.67 1umf n SER 90 Ca 0.01 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 1umf n SER 90 Cb 0.43 0.00 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 0.00 0.00 0.00 4.33 4.01 -1.26 -5.18 118.16 120.06 1umf n LYS 91 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1umf n LYS 91 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1umf n LYS 91 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1umf n ASP 92 N 0.00 0.00 -1.92 4.39 9.92 -1.26 -5.11 116.55 122.56 1umf n ASP 92 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 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 0.00 0.13 0.00 0.00 177.20 177.33 1umf n TYR 93 N 0.00 -1.25 -2.79 1.24 0.18 -1.24 -4.96 117.16 108.34 1umf n TYR 93 Ca 0.00 0.53 0.00 0.00 1.88 0.00 0.00 57.90 60.31 1umf n TYR 93 Cb 0.00 -2.35 0.00 0.00 -0.38 0.00 0.00 39.34 36.61 1umf n TYR 93 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 1umf n ASP 94 N -0.08 0.00 0.00 9.48 9.92 -1.22 -4.80 116.55 129.85 1umf n ASP 94 Ca 0.02 -0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.13 1umf n ASP 94 Cb 0.07 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.55 1umf n ASP 94 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1umf n ASN 95 N -0.05 0.00 -4.28 -2.24 2.85 -1.26 -2.63 115.26 107.64 1umf n ASN 95 Ca 0.00 0.00 -0.39 0.00 -0.11 0.00 0.00 54.58 54.08 1umf n ASN 95 Cb 0.00 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 40.91 1umf n ASN 95 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1umf s ILE 96 N 2.62 4.05 -1.47 -1.44 1.01 -1.26 -4.97 121.20 119.74 1umf s ILE 96 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 60.65 59.40 1umf s ILE 96 Cb 0.00 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.08 1umf s ILE 96 CO 0.00 -0.35 0.20 0.29 0.00 0.00 0.00 174.94 175.08 1umf n LYS 97 N 4.87 0.28 -0.01 2.79 5.02 -1.26 -2.61 118.16 127.24 1umf n LYS 97 Ca -0.11 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.19 1umf n LYS 97 Cb 0.44 -1.07 0.01 0.00 -0.02 0.00 0.00 35.03 34.39 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 -0.04 1.95 -4.50 4.39 3.02 -1.26 -4.87 115.26 113.94 1umf n ASN 98 Ca 0.00 -2.07 -0.25 0.00 -0.03 0.00 0.00 54.58 52.23 1umf n ASN 98 Cb 0.04 -0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.06 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 -1.14 2.66 -0.26 3.41 0.05 -1.07 -1.56 118.68 120.76 1umf s LEU 99 Ca 0.03 -1.13 -0.18 0.00 0.05 0.00 0.00 54.13 52.90 1umf s LEU 99 Cb 0.03 -1.00 -0.03 0.00 -2.05 0.00 0.00 46.19 43.14 1umf s LEU 99 CO 0.00 -0.12 0.51 -0.36 -0.55 0.00 0.00 176.35 175.83 1umf s PHE 100 N -2.61 3.26 -0.11 3.48 0.08 -0.72 -4.94 117.98 116.43 1umf s PHE 100 Ca 0.31 0.62 -0.30 0.00 0.12 0.00 0.00 56.93 57.68 1umf s PHE 100 Cb -0.00 -2.72 -0.01 0.00 -0.57 0.00 0.00 43.02 39.71 1umf s PHE 100 CO 0.15 -0.29 1.07 1.03 -0.10 0.00 0.00 175.22 177.09 1umf s ARG 101 N 2.30 4.38 0.23 0.44 0.52 -1.26 -4.56 118.95 121.00 1umf s ARG 101 Ca 0.21 1.47 -0.31 0.00 -0.52 0.00 0.00 55.73 56.58 1umf s ARG 101 Cb -0.16 -3.57 -0.14 0.00 0.52 0.00 0.00 34.95 31.61 1umf s ARG 101 CO 0.09 -0.41 1.39 -2.30 0.02 0.00 0.00 175.30 174.09 1umf n PRO 102 N 5.30 1.95 -1.04 3.54 -0.02 -1.26 -1.59 135.00 141.87 1umf n PRO 102 Ca 0.10 0.69 -0.01 0.00 -2.02 0.00 0.00 63.50 62.26 1umf n PRO 102 Cb 0.48 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 1umf n PRO 102 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1umf n SER 103 N 2.16 -4.10 -4.75 2.55 2.88 -1.26 -4.78 113.62 106.32 1umf n SER 103 Ca 0.12 0.03 -0.23 0.00 -1.33 0.00 0.00 58.87 57.47 1umf n SER 103 Cb 0.31 -1.71 -0.06 0.00 -0.75 0.00 0.00 64.21 62.00 1umf n SER 103 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1umf s HIS 104 N -1.73 2.76 -1.35 0.66 3.76 -0.62 -4.79 115.29 113.98 1umf s HIS 104 Ca 0.00 -0.33 0.20 0.00 -0.15 0.00 0.00 55.06 54.77 1umf s HIS 104 Cb 0.00 -1.60 0.96 0.00 1.11 0.00 0.00 32.58 33.06 1umf s HIS 104 CO 0.00 0.36 1.61 0.00 -0.85 0.00 0.00 174.74 175.86 1umf n ALA 105 N -1.16 2.01 -0.40 -1.40 0.00 -1.26 -4.26 120.51 114.04 1umf n ALA 105 Ca -0.04 -0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.24 1umf n ALA 105 Cb 0.61 -1.32 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 1umf n ALA 105 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1umf n ASP 106 N -1.32 -0.91 0.03 0.00 8.00 -1.26 -1.36 116.55 119.71 1umf n ASP 106 Ca 0.08 1.74 -0.10 0.00 0.71 0.00 0.00 54.79 57.22 1umf n ASP 106 Cb 0.17 -0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 40.94 1umf n ASP 106 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1umf h PHE 107 N 0.00 -0.27 -0.15 1.24 3.57 -1.89 -1.77 116.94 117.67 1umf h PHE 107 Ca 0.22 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.61 1umf h PHE 107 Cb 0.46 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1umf h PHE 107 CO -0.97 -0.16 -0.43 1.79 -2.23 0.00 0.00 178.31 176.31 1umf h THR 108 N -0.16 1.32 -0.43 4.41 1.35 -1.73 -2.19 112.91 115.48 1umf h THR 108 Ca 0.06 -1.60 -0.11 0.00 -0.55 0.00 0.00 66.41 64.21 1umf h THR 108 Cb 0.24 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 1umf h THR 108 CO -0.15 0.49 -0.15 1.88 -0.25 0.00 0.00 175.52 177.33 1umf h TYR 109 N 0.29 0.98 -0.41 4.73 0.05 -1.13 -0.91 116.97 120.58 1umf h TYR 109 Ca 0.02 -0.23 0.03 0.00 0.05 0.00 0.00 58.73 58.61 1umf h TYR 109 Cb 0.89 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 38.36 1umf h TYR 109 CO 0.02 0.99 0.20 0.35 -1.05 0.00 0.00 178.16 178.67 1umf h PHE 110 N 0.69 0.36 -0.01 4.88 3.57 -1.17 -1.79 116.94 123.48 1umf h PHE 110 Ca 0.10 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.41 1umf h PHE 110 Cb 0.71 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 1umf h PHE 110 CO 0.05 0.18 -0.89 0.45 -2.23 0.00 0.00 178.31 175.88 1umf h HIS 111 N 0.40 0.48 -0.09 0.41 3.86 -1.30 0.18 115.15 119.10 1umf h HIS 111 Ca 0.18 -0.26 -0.06 0.00 -1.16 0.00 0.00 60.37 59.07 1umf h HIS 111 Cb 0.09 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.51 1umf h HIS 111 CO -0.11 1.06 -0.17 -0.22 0.86 0.00 0.00 177.93 179.36 1umf h LYS 112 N 0.19 0.27 0.00 2.45 3.64 -1.04 -3.38 116.57 118.71 1umf h LYS 112 Ca -0.06 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1umf h LYS 112 Cb 1.51 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 1umf h LYS 112 CO 0.15 0.76 -1.21 0.66 -2.27 0.00 0.00 179.45 177.53 1umf n TYR 113 N -4.57 0.00 0.00 1.91 4.01 -0.68 -5.03 117.16 112.80 1umf n TYR 113 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1umf n TYR 113 Cb 0.39 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 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 1.64 1.56 3.55 2.72 0.00 0.63 -4.93 105.19 110.36 1umf n GLY 114 Ca -0.01 -0.04 -0.51 0.00 0.00 0.00 0.00 46.02 45.46 1umf n GLY 114 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1umf n ILE 115 N 0.00 0.29 0.00 -0.61 2.08 -1.26 -4.81 119.36 115.05 1umf n ILE 115 Ca 0.00 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.11 1umf n ILE 115 Cb 0.00 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.26 1umf n ILE 115 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1umf n ARG 116 N 7.38 0.00 -2.94 0.38 5.12 -1.26 -4.81 116.66 120.53 1umf n ARG 116 Ca 0.35 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 56.17 1umf n ARG 116 Cb 0.23 -0.22 0.01 0.00 -1.16 0.00 0.00 32.46 31.31 1umf n ARG 116 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1umf n ASP 117 N 0.00 -7.51 -3.66 0.55 2.03 -1.26 -4.89 116.55 101.82 1umf n ASP 117 Ca 0.00 0.68 -0.19 0.00 0.52 0.00 0.00 54.79 55.80 1umf n ASP 117 Cb 0.00 -4.50 -0.17 0.00 -0.72 0.00 0.00 41.12 35.73 1umf n ASP 117 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1umf s PHE 118 N -2.02 -0.04 0.01 -0.67 0.08 -1.26 -5.11 117.98 108.97 1umf s PHE 118 Ca 0.18 0.36 -0.03 0.00 0.12 0.00 0.00 56.93 57.56 1umf s PHE 118 Cb -0.04 -0.40 -0.01 0.00 -0.57 0.00 0.00 43.02 42.00 1umf s PHE 118 CO 0.73 -0.26 0.04 1.03 -0.10 0.00 0.00 175.22 176.66 1umf s ARG 119 N 2.22 0.37 0.00 0.44 0.52 -1.26 -4.94 118.95 116.30 1umf s ARG 119 Ca 0.04 -0.51 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 1umf s ARG 119 Cb -0.12 0.14 0.00 0.00 0.52 0.00 0.00 34.95 35.49 1umf s ARG 119 CO -0.05 -0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.61 1umf n GLY 120 N 1.59 -2.06 3.06 -3.53 0.00 -1.26 -4.21 105.19 98.79 1umf n GLY 120 Ca -0.23 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 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 1.64 -1.10 2.87 -0.02 0.00 -1.26 -2.44 105.19 104.87 1umf n GLY 121 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 -1.46 0.08 2.97 -0.02 0.00 -1.26 -4.74 105.19 100.76 1umf n GLY 122 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.34 0.00 0.03 1.61 1.85 -1.02 -3.17 116.66 116.29 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 0.42 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.83 1umf n ARG 123 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1umf n SER 124 N 0.03 0.12 -0.13 2.89 7.64 -1.26 -4.66 113.62 118.25 1umf n SER 124 Ca 0.00 0.09 -0.03 0.00 1.01 0.00 0.00 58.87 59.94 1umf n SER 124 Cb 0.00 0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.19 1umf n SER 124 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1umf n SER 125 N -2.77 -0.32 -0.10 6.43 7.64 -1.21 -2.05 113.62 121.24 1umf n SER 125 Ca 0.00 0.83 -0.03 0.00 1.01 0.00 0.00 58.87 60.67 1umf n SER 125 Cb 0.00 -0.21 -0.03 0.00 -1.01 0.00 0.00 64.21 62.96 1umf n SER 125 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1umf h ALA 126 N -0.14 -0.20 -0.39 -0.43 0.00 -1.91 -0.95 119.26 115.24 1umf h ALA 126 Ca 0.05 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.04 1umf h ALA 126 Cb 0.12 1.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 1umf h ALA 126 CO -0.28 -0.31 -0.50 0.00 0.00 0.00 0.00 179.25 178.17 1umf h ARG 127 N -0.02 -0.37 -0.92 0.00 3.08 -1.60 -1.65 114.38 112.90 1umf h ARG 127 Ca 0.04 0.02 0.17 0.00 0.07 0.00 0.00 59.98 60.28 1umf h ARG 127 Cb 0.12 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.18 1umf h ARG 127 CO -0.24 -0.24 0.59 0.93 -1.07 0.00 0.00 179.97 179.94 1umf h GLU 128 N -0.38 0.63 0.00 0.04 4.39 -1.15 0.16 114.58 118.27 1umf h GLU 128 Ca 0.10 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.70 1umf h GLU 128 Cb 0.60 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1umf h GLU 128 CO -0.58 0.42 -0.29 0.77 -1.16 0.00 0.00 179.01 178.17 1umf h SER 129 N 0.65 0.00 -0.50 1.42 0.02 -0.22 -0.32 113.55 114.59 1umf h SER 129 Ca 0.48 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.35 1umf h SER 129 Cb 0.85 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.38 1umf h SER 129 CO -0.23 0.29 -0.01 0.00 -1.14 0.00 0.00 176.83 175.73 1umf h ALA 130 N 1.71 0.68 -0.66 3.77 0.00 -0.63 0.31 119.26 124.44 1umf h ALA 130 Ca -0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1umf h ALA 130 Cb 0.53 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1umf h ALA 130 CO 0.04 0.51 0.13 0.82 0.00 0.00 0.00 179.25 180.74 1umf h ILE 131 N 0.76 1.26 -0.40 0.00 1.08 -1.07 -1.69 117.51 117.45 1umf h ILE 131 Ca 0.14 -1.00 -0.11 0.00 -0.39 0.00 0.00 64.86 63.50 1umf h ILE 131 Cb 0.54 0.63 -0.01 0.00 -3.07 0.00 0.00 36.82 34.91 1umf h ILE 131 CO 0.03 0.38 -0.19 0.03 -0.69 0.00 0.00 178.15 177.71 1umf h ARG 132 N 1.00 0.83 -0.40 2.37 3.08 -0.83 -1.84 114.38 118.58 1umf h ARG 132 Ca 0.20 -0.36 -0.15 0.00 0.07 0.00 0.00 59.98 59.74 1umf h ARG 132 Cb 0.41 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1umf h ARG 132 CO 0.01 0.99 -0.34 0.28 -1.07 0.00 0.00 179.97 179.84 1umf h VAL 133 N 0.64 1.27 -0.19 2.04 2.07 -0.86 0.99 116.25 122.21 1umf h VAL 133 Ca 0.09 -1.51 -0.00 0.00 0.82 0.00 0.00 66.70 66.09 1umf h VAL 133 Cb 0.74 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1umf h VAL 133 CO 0.06 0.51 0.10 0.00 0.02 0.00 0.00 177.57 178.26 1umf h ALA 134 N 0.79 0.25 -0.69 1.67 0.00 -1.30 -1.49 119.26 118.48 1umf h ALA 134 Ca 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1umf h ALA 134 Cb 0.93 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1umf h ALA 134 CO 0.09 -0.22 0.37 0.00 0.00 0.00 0.00 179.25 179.49 1umf h ALA 135 N 0.99 0.89 -0.31 0.00 0.00 -1.24 -2.36 119.26 117.22 1umf h ALA 135 Ca 0.07 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1umf h ALA 135 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1umf h ALA 135 CO -0.01 0.42 0.21 0.78 0.00 0.00 0.00 179.25 180.64 1umf h GLY 136 N 0.95 0.36 1.03 0.00 0.00 -0.40 -1.12 103.07 103.89 1umf h GLY 136 Ca 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 1umf h GLY 136 CO -0.04 0.11 0.49 0.00 0.00 0.00 0.00 176.54 177.11 1umf h ALA 137 N 1.82 1.15 -0.40 3.60 0.00 -0.72 0.24 119.26 124.95 1umf h ALA 137 Ca 0.13 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1umf h ALA 137 Cb 0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1umf h ALA 137 CO -0.03 0.66 -0.33 0.74 0.00 0.00 0.00 179.25 180.30 1umf h PHE 138 N 1.26 1.11 -0.75 0.00 -1.00 -1.22 -2.03 116.94 114.31 1umf h PHE 138 Ca 0.32 -0.31 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1umf h PHE 138 Cb 0.03 -0.24 -0.04 0.00 3.61 0.00 0.00 35.95 39.31 1umf h PHE 138 CO 0.01 1.14 0.39 0.00 -1.61 0.00 0.00 178.31 178.23 1umf h ALA 139 N 0.79 1.27 -0.07 2.45 0.00 -0.64 -1.69 119.26 121.38 1umf h ALA 139 Ca 0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1umf h ALA 139 Cb 0.92 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1umf h ALA 139 CO 0.09 0.58 -0.24 0.87 0.00 0.00 0.00 179.25 180.55 1umf h LYS 140 N 1.05 0.11 -0.35 0.00 1.57 -0.24 -0.29 116.57 118.43 1umf h LYS 140 Ca 0.26 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.95 1umf h LYS 140 Cb 0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1umf h LYS 140 CO -0.04 0.35 -0.02 0.52 -0.57 0.00 0.00 179.45 179.69 1umf h MET 141 N 0.10 0.63 0.01 3.15 2.86 -0.59 -1.20 114.93 119.89 1umf h MET 141 Ca 0.02 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1umf h MET 141 Cb 0.48 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1umf h MET 141 CO 0.03 0.76 -0.00 1.25 1.06 0.00 0.00 176.91 180.01 1umf h LEU 142 N 0.43 -0.01 -1.04 1.22 6.46 -0.99 -2.97 115.31 118.41 1umf h LEU 142 Ca 0.10 -0.15 0.08 0.00 -0.12 0.00 0.00 57.88 57.79 1umf h LEU 142 Cb 0.49 0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.35 1umf h LEU 142 CO 0.02 0.15 0.63 -0.07 -0.62 0.00 0.00 178.44 178.55 1umf h LEU 143 N -0.17 0.97 -1.68 2.25 3.38 -0.97 -1.71 115.31 117.38 1umf h LEU 143 Ca -0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1umf h LEU 143 Cb 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1umf h LEU 143 CO 0.00 0.59 -0.00 -0.09 0.09 0.00 0.00 178.44 179.03 1umf h ARG 144 N 1.08 0.19 0.00 1.13 2.43 -1.08 -1.38 114.38 116.76 1umf h ARG 144 Ca 0.45 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.58 1umf h ARG 144 Cb 0.29 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1umf h ARG 144 CO -0.20 0.22 -0.05 0.93 -1.51 0.00 0.00 179.97 179.36 1umf h GLU 145 N 0.19 0.00 -0.16 0.20 4.39 -1.16 -1.71 114.58 116.34 1umf h GLU 145 Ca 0.05 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 1umf h GLU 145 Cb 0.14 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.75 1umf h GLU 145 CO 0.00 0.05 -0.23 0.44 -1.16 0.00 0.00 179.01 178.11 1umf n ILE 146 N -3.37 2.30 -1.43 3.13 -5.35 -0.72 -4.99 119.36 108.94 1umf n ILE 146 Ca -0.02 -2.81 -0.09 0.00 -0.27 0.00 0.00 62.75 59.56 1umf n ILE 146 Cb 0.19 -0.27 -0.03 0.00 -1.74 0.00 0.00 39.64 37.79 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 -1.12 0.89 3.66 3.28 0.00 -0.64 -5.00 105.19 106.27 1umf n GLY 147 Ca 0.24 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.36 4.06 0.02 -0.61 1.01 -0.60 -0.50 121.20 122.22 1umf s ILE 148 Ca 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1umf s ILE 148 Cb 0.00 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.66 1umf s ILE 148 CO 0.00 0.40 -0.05 0.54 0.00 0.00 0.00 174.94 175.83 1umf s VAL 149 N -1.05 0.32 0.02 2.92 0.11 -0.53 -3.31 120.40 118.88 1umf s VAL 149 Ca 0.19 -0.78 0.07 0.00 -2.93 0.00 0.00 61.98 58.52 1umf s VAL 149 Cb -0.11 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.32 1umf s VAL 149 CO 0.09 -0.31 -0.19 0.00 -3.33 0.00 0.00 175.10 171.36 1umf s GLU 151 N -1.21 1.17 0.34 0.00 -1.05 0.32 -5.00 118.70 113.27 1umf s GLU 151 Ca 0.13 -1.20 -0.11 0.00 -0.15 0.00 0.00 54.97 53.64 1umf s GLU 151 Cb -0.10 0.38 0.02 0.00 -0.44 0.00 0.00 34.13 33.99 1umf s GLU 151 CO 0.03 -0.43 0.62 -1.54 0.95 0.00 0.00 175.26 174.90 1umf s SER 152 N -2.98 0.27 -0.13 0.83 1.04 -1.26 -0.46 113.70 111.01 1umf s SER 152 Ca 0.18 -1.17 -0.34 0.00 0.48 0.00 0.00 55.95 55.11 1umf s SER 152 Cb 0.03 0.73 0.15 0.00 0.10 0.00 0.00 66.02 67.04 1umf s SER 152 CO 0.01 -1.43 1.44 -0.83 0.98 0.00 0.00 173.24 173.41 1umf s GLY 153 N -3.10 -0.46 -0.13 7.32 0.00 -0.77 -4.84 107.32 105.33 1umf s GLY 153 Ca 0.21 1.12 -0.19 0.00 0.00 0.00 0.00 44.72 45.86 1umf s GLY 153 CO 0.13 0.25 0.53 -0.42 0.00 0.00 0.00 173.10 173.59 1umf s ILE 154 N -2.01 5.14 -0.28 0.90 -1.09 0.11 -0.88 121.20 123.09 1umf s ILE 154 Ca 0.15 1.04 0.11 0.00 -2.23 0.00 0.00 60.65 59.72 1umf s ILE 154 Cb 0.07 -3.86 -0.15 0.00 -1.58 0.00 0.00 42.46 36.93 1umf s ILE 154 CO -0.06 0.27 0.37 2.30 -1.23 0.00 0.00 174.94 176.58 1umf n ILE 155 N 3.95 0.00 -3.77 2.92 -5.35 -0.28 -1.76 119.36 115.07 1umf n ILE 155 Ca -0.05 -0.25 -0.13 0.00 -0.27 0.00 0.00 62.75 62.05 1umf n ILE 155 Cb 0.51 0.63 -0.10 0.00 -1.74 0.00 0.00 39.64 38.94 1umf n ILE 155 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1umf s GLU 156 N -2.42 0.51 -0.16 6.28 2.02 -1.02 0.01 118.70 123.92 1umf s GLU 156 Ca 0.00 0.13 -0.04 0.00 0.02 0.00 0.00 54.97 55.08 1umf s GLU 156 Cb 0.08 0.23 0.08 0.00 0.10 0.00 0.00 34.13 34.62 1umf s GLU 156 CO 0.47 -0.11 0.25 0.42 0.02 0.00 0.00 175.26 176.31 1umf s ILE 157 N -0.54 -0.38 -1.47 -1.63 1.01 -1.08 -0.84 121.20 116.27 1umf s ILE 157 Ca -0.07 0.11 -0.11 0.00 0.00 0.00 0.00 60.65 60.58 1umf s ILE 157 Cb -0.04 -0.55 0.05 0.00 0.01 0.00 0.00 42.46 41.94 1umf s ILE 157 CO 0.02 -0.02 0.95 0.61 0.00 0.00 0.00 174.94 176.50 1umf n GLY 158 N 5.34 -0.52 2.72 6.18 0.00 -0.44 -1.74 105.19 116.74 1umf n GLY 158 Ca -0.05 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.72 2.06 3.53 -0.02 0.00 -1.26 -4.98 105.19 102.79 1umf n GLY 159 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.25 4.62 0.14 -0.61 1.01 -0.71 -5.03 121.20 117.37 1umf s ILE 160 Ca 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 60.65 60.93 1umf s ILE 160 Cb 0.00 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 1umf s ILE 160 CO 0.00 -0.81 0.31 -0.54 0.00 0.00 0.00 174.94 173.90 1umf s LYS 161 N 3.35 3.50 0.41 2.79 1.02 -1.26 -2.64 119.74 126.91 1umf s LYS 161 Ca 0.28 -0.37 -0.22 0.00 0.02 0.00 0.00 55.97 55.67 1umf s LYS 161 Cb -0.13 -2.93 -0.10 0.00 -0.52 0.00 0.00 37.83 34.15 1umf s LYS 161 CO 0.21 0.50 0.98 0.00 -0.92 0.00 0.00 175.35 176.12 1umf s ALA 162 N -1.69 3.05 -0.14 5.17 0.00 0.10 -4.90 121.76 123.36 1umf s ALA 162 Ca 0.37 0.51 0.10 0.00 0.00 0.00 0.00 51.96 52.95 1umf s ALA 162 Cb -0.12 -3.20 -0.16 0.00 0.00 0.00 0.00 23.12 19.65 1umf s ALA 162 CO 0.28 0.01 0.01 1.63 0.00 0.00 0.00 175.76 177.69 1umf n LYS 163 N -0.35 1.56 -4.19 0.00 5.02 -1.26 -5.00 118.16 113.95 1umf n LYS 163 Ca 0.06 0.01 -0.19 0.00 -2.02 0.00 0.00 58.31 56.18 1umf n LYS 163 Cb 0.52 -1.35 -0.12 0.00 -0.02 0.00 0.00 35.03 34.07 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 -4.83 1.77 -0.22 4.39 0.01 -1.26 -5.14 114.94 109.66 1umf s ASN 164 Ca -0.09 -0.65 -0.04 0.00 -0.71 0.00 0.00 52.86 51.37 1umf s ASN 164 Cb 0.04 -0.06 -0.01 0.00 0.41 0.00 0.00 41.25 41.64 1umf s ASN 164 CO 0.53 -0.08 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.68 1umf s TYR 165 N -1.40 2.95 -0.35 2.20 2.02 -1.26 -3.70 117.35 117.81 1umf s TYR 165 Ca 0.00 -0.97 0.01 0.00 -0.37 0.00 0.00 57.07 55.74 1umf s TYR 165 Cb -0.09 -2.10 0.11 0.00 -0.40 0.00 0.00 41.96 39.48 1umf s TYR 165 CO 0.02 -0.56 0.12 0.34 -1.57 0.00 0.00 175.55 173.90 1umf s ASP 166 N 1.46 4.16 0.36 2.29 -1.08 0.21 -5.01 116.67 119.07 1umf s ASP 166 Ca 0.06 -1.99 0.12 0.00 -0.52 0.00 0.00 52.55 50.22 1umf s ASP 166 Cb -0.14 -1.11 0.66 0.00 -1.46 0.00 0.00 42.92 40.87 1umf s ASP 166 CO -0.04 -0.37 1.79 -0.26 0.52 0.00 0.00 175.17 176.81 1umf h PHE 167 N 7.68 0.00 -0.50 -5.34 -1.00 -1.93 -2.58 116.94 113.27 1umf h PHE 167 Ca -0.09 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.64 1umf h PHE 167 Cb 1.00 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.54 1umf h PHE 167 CO 0.41 0.41 0.12 -0.97 -1.61 0.00 0.00 178.31 176.67 1umf h ASN 168 N 0.00 0.77 -0.42 2.17 -0.00 -1.95 -2.50 115.58 113.65 1umf h ASN 168 Ca -0.00 -0.24 -0.08 0.00 -0.00 0.00 0.00 56.30 55.98 1umf h ASN 168 Cb 0.73 -0.20 -0.02 0.00 -0.00 0.00 0.00 38.32 38.83 1umf h ASN 168 CO 0.05 0.81 -0.00 -0.74 -0.00 0.00 0.00 177.43 177.55 1umf h HIS 169 N 0.70 0.87 -0.38 0.67 2.76 -1.85 -2.98 115.15 114.93 1umf h HIS 169 Ca 0.16 -0.12 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 1umf h HIS 169 Cb 0.34 -0.24 -0.04 0.00 1.55 0.00 0.00 27.41 29.03 1umf h HIS 169 CO 0.02 0.80 0.14 0.00 -1.30 0.00 0.00 177.93 177.60 1umf h ALA 170 N 1.24 0.45 -0.85 5.26 0.00 -1.06 -1.48 119.26 122.82 1umf h ALA 170 Ca 0.15 0.04 0.20 0.00 0.00 0.00 0.00 54.91 55.30 1umf h ALA 170 Cb 0.46 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1umf h ALA 170 CO 0.02 -0.24 0.57 -0.07 0.00 0.00 0.00 179.25 179.53 1umf h LEU 171 N 0.31 0.29 -0.14 0.00 3.38 -1.31 -0.01 115.31 117.82 1umf h LEU 171 Ca 0.17 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1umf h LEU 171 Cb 0.14 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1umf h LEU 171 CO -0.17 0.12 -0.62 0.29 0.09 0.00 0.00 178.44 178.15 1umf n LYS 172 N -4.45 0.21 -2.63 1.13 5.02 -0.75 -4.94 118.16 111.75 1umf n LYS 172 Ca 0.18 -0.14 -0.39 0.00 -2.02 0.00 0.00 58.31 55.94 1umf n LYS 172 Cb 0.72 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 34.18 1umf n LYS 172 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1umf s SER 173 N -2.89 7.25 0.61 4.39 0.15 -0.02 -4.94 113.70 118.25 1umf s SER 173 Ca 0.12 2.04 0.38 0.00 0.70 0.00 0.00 55.95 59.19 1umf s SER 173 Cb 0.17 -2.60 1.97 0.00 -1.71 0.00 0.00 66.02 63.85 1umf s SER 173 CO 0.72 -0.14 2.23 -0.33 1.20 0.00 0.00 173.24 176.92 1umf h GLU 174 N 3.42 0.00 0.00 5.44 3.07 -1.85 -2.46 114.58 122.20 1umf h GLU 174 Ca -0.47 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.39 1umf h GLU 174 Cb 1.20 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.10 1umf h GLU 174 CO 0.66 0.02 -0.24 0.44 -1.40 0.00 0.00 179.01 178.49 1umf n ILE 175 N -3.25 1.24 -2.89 3.13 -5.35 -1.26 -4.46 119.36 106.53 1umf n ILE 175 Ca -0.02 -1.58 -0.19 0.00 -0.27 0.00 0.00 62.75 60.69 1umf n ILE 175 Cb 0.15 0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.10 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 -0.88 -1.64 -1.86 4.28 0.99 -0.93 -4.50 117.46 112.92 1umf n PHE 176 Ca 0.11 0.29 -0.42 0.00 -0.00 0.00 0.00 57.45 57.43 1umf n PHE 176 Cb 0.68 -3.39 -0.03 0.00 -1.00 0.00 0.00 39.48 35.74 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 -2.91 3.80 -0.59 4.37 0.00 -1.26 0.07 121.76 125.24 1umf s ALA 177 Ca 0.21 1.40 0.24 0.00 0.00 0.00 0.00 51.96 53.82 1umf s ALA 177 Cb -0.10 -3.67 0.38 0.00 0.00 0.00 0.00 23.12 19.73 1umf s ALA 177 CO 0.26 -0.91 1.38 -0.07 0.00 0.00 0.00 175.76 176.42 1umf h LEU 178 N 7.28 0.00 -7.65 0.00 3.38 -1.61 -3.15 115.31 113.56 1umf h LEU 178 Ca -0.43 -0.14 -0.63 0.00 0.09 0.00 0.00 57.88 56.78 1umf h LEU 178 Cb 1.20 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.57 1umf h LEU 178 CO 0.93 0.07 -0.78 -0.62 0.09 0.00 0.00 178.44 178.13 1umf s ASP 179 N -4.55 4.09 0.53 -0.43 -1.08 -1.24 -0.62 116.67 113.37 1umf s ASP 179 Ca 0.06 -1.38 0.28 0.00 -0.52 0.00 0.00 52.55 51.00 1umf s ASP 179 Cb 0.12 -1.28 1.47 0.00 -1.46 0.00 0.00 42.92 41.76 1umf s ASP 179 CO 0.71 -0.26 2.07 1.05 0.52 0.00 0.00 175.17 179.26 1umf h GLU 180 N 7.89 0.00 0.00 4.34 4.11 -1.87 -1.94 114.58 127.10 1umf h GLU 180 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.27 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 0.44 0.11 0.00 0.93 0.07 0.00 0.00 179.01 180.56 1umf h GLU 181 N 0.00 0.00 -0.01 1.06 5.08 -1.96 -3.16 114.58 115.59 1umf h GLU 181 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1umf h GLU 181 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1umf h GLU 181 CO 0.01 0.00 -0.30 1.04 -1.00 0.00 0.00 179.01 178.76 1umf n GLN 182 N -2.86 2.51 -0.02 2.33 1.13 -0.90 -4.73 117.38 114.84 1umf n GLN 182 Ca 0.03 -0.44 -0.09 0.00 -1.94 0.00 0.00 57.00 54.56 1umf n GLN 182 Cb 0.40 -1.07 -0.02 0.00 0.11 0.00 0.00 30.24 29.65 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 0.84 -0.22 -0.47 -1.09 4.81 -1.33 -1.68 114.58 115.43 1umf h GLU 183 Ca 0.00 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1umf h GLU 183 Cb 0.33 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1umf h GLU 183 CO 0.00 -0.15 0.25 0.93 -0.73 0.00 0.00 179.01 179.31 1umf h GLU 184 N -0.23 0.48 -0.93 1.92 4.39 -1.85 0.64 114.58 119.00 1umf h GLU 184 Ca 0.11 -0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.79 1umf h GLU 184 Cb 0.40 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.89 1umf h GLU 184 CO -0.30 0.32 0.61 0.00 -1.16 0.00 0.00 179.01 178.48 1umf h ALA 185 N 1.24 1.18 -0.29 3.43 0.00 -1.84 0.15 119.26 123.13 1umf h ALA 185 Ca 0.20 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1umf h ALA 185 Cb 0.08 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1umf h ALA 185 CO -0.13 0.56 0.05 1.96 0.00 0.00 0.00 179.25 181.69 1umf h GLN 186 N 1.24 0.49 -0.66 0.00 4.20 -0.29 -1.87 115.11 118.21 1umf h GLN 186 Ca 0.34 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1umf h GLN 186 Cb -0.12 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 1umf h GLN 186 CO -0.08 0.58 0.42 0.87 -0.67 0.00 0.00 178.83 179.95 1umf h LYS 187 N 0.31 0.88 -0.72 1.46 1.57 0.87 -2.35 116.57 118.59 1umf h LYS 187 Ca 0.09 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1umf h LYS 187 Cb 0.33 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1umf h LYS 187 CO 0.00 0.60 0.21 1.15 -0.57 0.00 0.00 179.45 180.84 1umf h THR 188 N 0.90 1.26 -0.57 -0.16 2.02 -0.32 -1.05 112.91 114.99 1umf h THR 188 Ca 0.24 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 1umf h THR 188 Cb -0.07 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 1umf h THR 188 CO -0.05 0.36 0.29 0.00 0.37 0.00 0.00 175.52 176.49 1umf h ALA 189 N 1.10 1.43 -0.36 6.16 0.00 -0.83 0.28 119.26 127.04 1umf h ALA 189 Ca 0.23 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1umf h ALA 189 Cb 0.33 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1umf h ALA 189 CO -0.00 0.46 -0.20 0.82 0.00 0.00 0.00 179.25 180.33 1umf h ILE 190 N 0.80 1.29 -0.42 0.00 2.04 -1.05 -2.06 117.51 118.11 1umf h ILE 190 Ca 0.20 -1.33 -0.09 0.00 1.00 0.00 0.00 64.86 64.64 1umf h ILE 190 Cb 0.07 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1umf h ILE 190 CO -0.03 0.44 -0.10 1.56 0.00 0.00 0.00 178.15 180.02 1umf h GLN 191 N 0.56 0.75 -0.13 2.37 1.08 -0.51 -1.47 115.11 117.74 1umf h GLN 191 Ca 0.08 -0.24 -0.10 0.00 -1.45 0.00 0.00 58.65 56.94 1umf h GLN 191 Cb 0.75 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.10 1umf h GLN 191 CO 0.06 0.82 -0.37 -0.91 -0.95 0.00 0.00 178.83 177.48 1umf h ASN 192 N 0.68 0.29 -0.08 1.46 2.35 -0.88 0.12 115.58 119.52 1umf h ASN 192 Ca 0.12 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1umf h ASN 192 Cb 0.56 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1umf h ASN 192 CO 0.03 0.64 0.01 0.00 -1.65 0.00 0.00 177.43 176.47 1umf h ALA 193 N 1.38 0.10 -0.43 -0.83 0.00 -0.92 -0.76 119.26 117.80 1umf h ALA 193 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1umf h ALA 193 Cb 0.77 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1umf h ALA 193 CO 0.06 -0.25 0.28 0.82 0.00 0.00 0.00 179.25 180.16 1umf h ILE 194 N -0.11 1.12 -0.64 0.00 2.04 -1.01 0.20 117.51 119.10 1umf h ILE 194 Ca 0.02 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.72 1umf h ILE 194 Cb 0.28 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.80 1umf h ILE 194 CO 0.00 0.11 0.35 0.50 0.00 0.00 0.00 178.15 179.11 1umf h LYS 195 N 0.58 0.62 -0.59 2.37 3.64 -0.63 -2.22 116.57 120.35 1umf h LYS 195 Ca 0.16 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1umf h LYS 195 Cb -0.06 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 1umf h LYS 195 CO -0.03 0.41 0.00 0.09 -2.27 0.00 0.00 179.45 177.65 1umf n ASN 196 N -4.81 2.79 -3.97 4.20 3.02 -0.30 -4.90 115.26 111.28 1umf n ASN 196 Ca 0.08 -2.25 -0.29 0.00 -0.03 0.00 0.00 54.58 52.09 1umf n ASN 196 Cb 0.18 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 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 0.47 -1.96 -4.57 3.10 8.25 -0.74 -4.95 115.22 114.81 1umf n HIS 197 Ca 0.14 0.83 -0.28 0.00 -0.26 0.00 0.00 57.72 58.15 1umf n HIS 197 Cb 0.54 -3.74 -0.08 0.00 1.12 0.00 0.00 29.99 27.84 1umf n HIS 197 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1umf s ASP 198 N -3.71 3.14 0.33 0.41 -1.08 0.63 -3.48 116.67 112.92 1umf s ASP 198 Ca 0.43 -1.73 0.04 0.00 -0.52 0.00 0.00 52.55 50.77 1umf s ASP 198 Cb -0.22 0.61 -0.06 0.00 -1.46 0.00 0.00 42.92 41.79 1umf s ASP 198 CO 0.86 -0.98 0.07 -0.94 0.52 0.00 0.00 175.17 174.71 1umf s SER 199 N -3.68 2.34 -0.03 -0.34 1.04 -1.26 -4.20 113.70 107.57 1umf s SER 199 Ca 0.18 -1.42 -0.11 0.00 0.48 0.00 0.00 55.95 55.09 1umf s SER 199 Cb 0.01 0.01 0.02 0.00 0.10 0.00 0.00 66.02 66.16 1umf s SER 199 CO 0.12 -0.66 0.25 -0.51 0.98 0.00 0.00 173.24 173.42 1umf s ILE 200 N -3.32 0.05 0.88 -1.02 1.10 -0.05 -4.85 121.20 114.00 1umf s ILE 200 Ca 0.35 -0.41 -0.14 0.00 -0.51 0.00 0.00 60.65 59.94 1umf s ILE 200 Cb 0.08 -0.49 0.14 0.00 0.15 0.00 0.00 42.46 42.33 1umf s ILE 200 CO 0.15 -0.23 1.24 -0.83 -2.11 0.00 0.00 174.94 173.17 1umf s GLY 201 N -0.95 1.69 0.22 1.50 0.00 -1.26 -4.18 107.32 104.33 1umf s GLY 201 Ca -0.10 -0.94 -0.23 0.00 0.00 0.00 0.00 44.72 43.44 1umf s GLY 201 CO 0.02 -0.32 0.83 -0.32 0.00 0.00 0.00 173.10 173.32 1umf s GLY 202 N -4.73 -0.17 -0.07 0.20 0.00 -1.05 -1.32 107.32 100.18 1umf s GLY 202 Ca 0.68 -0.08 0.02 0.00 0.00 0.00 0.00 44.72 45.35 1umf s GLY 202 CO 0.51 -0.04 -0.13 0.14 0.00 0.00 0.00 173.10 173.58 1umf s VAL 203 N -3.61 1.18 -0.01 1.40 1.01 -0.02 -1.29 120.40 119.06 1umf s VAL 203 Ca 0.11 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1umf s VAL 203 Cb -0.04 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1umf s VAL 203 CO 0.04 0.37 0.01 0.00 0.00 0.00 0.00 175.10 175.51 1umf s ALA 204 N 0.64 3.31 -0.16 5.51 0.00 -0.59 -1.12 121.76 129.35 1umf s ALA 204 Ca -0.15 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 1umf s ALA 204 Cb -0.16 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 1umf s ALA 204 CO 0.04 0.64 -0.06 -1.17 0.00 0.00 0.00 175.76 175.21 1umf s LEU 205 N -1.46 3.10 -0.03 0.00 2.96 -0.06 -1.22 118.68 121.96 1umf s LEU 205 Ca 0.19 -0.20 0.06 0.00 -0.22 0.00 0.00 54.13 53.96 1umf s LEU 205 Cb -0.12 -1.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.82 1umf s LEU 205 CO 0.09 0.15 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.41 1umf s ILE 206 N 0.50 1.86 0.02 6.68 -1.09 0.44 -1.85 121.20 127.76 1umf s ILE 206 Ca -0.05 -0.99 0.01 0.00 -2.23 0.00 0.00 60.65 57.40 1umf s ILE 206 Cb -0.15 -1.56 -0.01 0.00 -1.58 0.00 0.00 42.46 39.16 1umf s ILE 206 CO 0.03 0.52 -0.04 -0.60 -1.23 0.00 0.00 174.94 173.63 1umf s ARG 207 N -0.34 0.30 -0.07 2.79 3.52 0.39 -0.99 118.95 124.57 1umf s ARG 207 Ca 0.03 -0.46 0.04 0.00 -0.13 0.00 0.00 55.73 55.20 1umf s ARG 207 Cb -0.11 -0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.23 1umf s ARG 207 CO 0.01 0.00 -0.17 0.00 -0.81 0.00 0.00 175.30 174.33 1umf s ALA 208 N -0.98 1.62 0.33 6.12 0.00 -0.97 -0.52 121.76 127.36 1umf s ALA 208 Ca -0.09 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.14 1umf s ALA 208 Cb -0.07 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.45 1umf s ALA 208 CO -0.00 0.23 0.50 -0.98 0.00 0.00 0.00 175.76 175.50 1umf s ARG 209 N 0.32 1.87 0.20 0.00 1.70 -0.53 -2.03 118.95 120.48 1umf s ARG 209 Ca -0.11 -1.65 -0.19 0.00 -0.47 0.00 0.00 55.73 53.31 1umf s ARG 209 Cb -0.15 0.46 -0.08 0.00 -0.57 0.00 0.00 34.95 34.61 1umf s ARG 209 CO 0.04 -0.79 0.68 0.45 -1.08 0.00 0.00 175.30 174.61 1umf s SER 210 N -3.19 7.01 0.07 -2.89 0.15 -1.26 -1.45 113.70 112.14 1umf s SER 210 Ca 0.28 1.35 -0.16 0.00 0.70 0.00 0.00 55.95 58.11 1umf s SER 210 Cb -0.01 -2.39 -0.15 0.00 -1.71 0.00 0.00 66.02 61.76 1umf s SER 210 CO 0.18 0.06 1.29 0.40 1.20 0.00 0.00 173.24 176.36 1umf h ILE 211 N 2.79 1.34 -2.98 6.45 2.04 -1.13 -3.41 117.51 122.62 1umf h ILE 211 Ca -0.48 -1.75 -0.57 0.00 1.00 0.00 0.00 64.86 63.06 1umf h ILE 211 Cb 1.19 2.01 -0.04 0.00 -0.74 0.00 0.00 36.82 39.25 1umf h ILE 211 CO 0.65 0.54 1.14 -0.54 0.00 0.00 0.00 178.15 179.94 1umf s LYS 212 N -3.86 3.58 -0.26 2.37 1.02 -1.26 -4.83 119.74 116.50 1umf s LYS 212 Ca -0.12 1.27 -0.27 0.00 0.02 0.00 0.00 55.97 56.87 1umf s LYS 212 Cb 0.07 -4.07 -0.11 0.00 -0.52 0.00 0.00 37.83 33.20 1umf s LYS 212 CO 0.84 -1.56 0.89 2.41 -0.92 0.00 0.00 175.35 177.01 1umf n THR 213 N 6.97 0.00 -1.36 2.17 -1.04 -1.26 -1.28 114.28 118.48 1umf n THR 213 Ca 0.19 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.11 1umf n THR 213 Cb 0.47 -0.26 -0.04 0.00 -1.82 0.00 0.00 70.33 68.68 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 2.15 -2.44 -4.81 8.00 3.02 -1.26 -4.95 115.26 114.97 1umf n ASN 214 Ca 0.17 0.23 -0.36 0.00 -0.03 0.00 0.00 54.58 54.59 1umf n ASN 214 Cb -0.03 -2.41 -0.06 0.00 -0.61 0.00 0.00 39.78 36.67 1umf n ASN 214 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1umf s GLN 215 N -2.95 4.29 0.57 3.52 -0.21 -0.41 -5.02 119.66 119.47 1umf s GLN 215 Ca 0.00 0.93 -0.20 0.00 0.02 0.00 0.00 55.36 56.11 1umf s GLN 215 Cb 0.00 -2.86 -0.04 0.00 1.00 0.00 0.00 33.01 31.11 1umf s GLN 215 CO 0.00 0.37 1.24 0.15 -2.12 0.00 0.00 175.29 174.93 1umf s LYS 216 N -2.01 3.05 0.73 2.91 -0.14 -1.26 -4.35 119.74 118.67 1umf s LYS 216 Ca 0.44 1.91 -0.12 0.00 -1.36 0.00 0.00 55.97 56.85 1umf s LYS 216 Cb -0.17 -2.03 0.03 0.00 -1.68 0.00 0.00 37.83 33.98 1umf s LYS 216 CO 0.21 -1.17 1.11 -0.51 -0.76 0.00 0.00 175.35 174.24 1umf s LEU 217 N -3.89 2.80 0.37 3.17 1.43 -0.48 -4.91 118.68 117.18 1umf s LEU 217 Ca 0.75 1.08 -0.28 0.00 -1.03 0.00 0.00 54.13 54.66 1umf s LEU 217 Cb -0.33 -3.81 -0.11 0.00 0.03 0.00 0.00 46.19 41.97 1umf s LEU 217 CO 0.36 -1.50 1.41 -2.65 0.23 0.00 0.00 176.35 174.20 1umf n PRO 218 N -3.10 2.43 -3.59 1.29 -0.02 -1.26 -4.31 135.00 126.44 1umf n PRO 218 Ca 0.07 0.85 -0.36 0.00 -2.02 0.00 0.00 63.50 62.04 1umf n PRO 218 Cb 0.58 -2.54 -0.08 0.00 -0.02 0.00 0.00 33.50 31.45 1umf n PRO 218 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1umf s ILE 219 N -1.12 5.33 0.00 4.25 1.01 -1.26 -4.30 121.20 125.11 1umf s ILE 219 Ca 0.55 0.43 0.00 0.00 0.00 0.00 0.00 60.65 61.63 1umf s ILE 219 Cb -0.51 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.38 1umf s ILE 219 CO 0.63 0.39 0.00 0.61 0.00 0.00 0.00 174.94 176.56 1umf n GLY 220 N 3.54 1.03 3.74 6.18 0.00 0.36 -4.97 105.19 115.08 1umf n GLY 220 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 4.42 0.00 0.99 1.43 -1.26 -4.71 118.68 119.54 1umf s LEU 221 Ca 0.00 2.42 0.00 0.00 -1.03 0.00 0.00 54.13 55.52 1umf s LEU 221 Cb 0.00 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1umf s LEU 221 CO 0.00 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 176.66 1umf n GLY 222 N 2.30 4.15 3.17 -3.19 0.00 -1.26 -0.82 105.19 109.53 1umf n GLY 222 Ca 0.06 -1.32 -0.33 0.00 0.00 0.00 0.00 46.02 44.43 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 -4.79 3.06 1.18 1.61 -1.52 0.97 -4.83 119.66 115.34 1umf s GLN 223 Ca 0.00 -0.82 0.00 0.00 -1.95 0.00 0.00 55.36 52.59 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 -0.11 0.00 0.41 -0.25 0.00 0.00 175.29 175.34 1umf n GLY 224 N 4.35 0.72 0.11 3.09 0.00 -1.26 -1.57 105.19 110.63 1umf n GLY 224 Ca -0.20 -0.81 0.01 0.00 0.00 0.00 0.00 46.02 45.02 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 0.00 -3.04 0.99 3.38 -1.97 -3.36 115.31 111.30 1umf h LEU 225 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1umf h LEU 225 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1umf h LEU 225 CO 0.00 0.55 0.00 -1.22 0.09 0.00 0.00 178.44 177.86 1umf n TYR 226 N -3.06 0.70 -2.78 1.13 4.01 -1.25 -4.44 117.16 111.46 1umf n TYR 226 Ca -0.04 -0.65 -0.02 0.00 -0.16 0.00 0.00 57.90 57.03 1umf n TYR 226 Cb 0.79 -0.15 0.06 0.00 -0.31 0.00 0.00 39.34 39.73 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 0.14 2.72 -1.36 -0.72 0.00 -0.61 -5.01 120.51 115.69 1umf n ALA 227 Ca 0.16 -2.54 -0.33 0.00 0.00 0.00 0.00 53.44 50.73 1umf n ALA 227 Cb 0.63 -0.89 0.08 0.00 0.00 0.00 0.00 19.45 19.27 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 -3.03 2.30 0.08 0.00 1.02 -1.19 -0.02 119.74 118.90 1umf s LYS 228 Ca 0.24 1.58 -0.28 0.00 0.02 0.00 0.00 55.97 57.53 1umf s LYS 228 Cb 0.36 -1.87 -0.17 0.00 -0.52 0.00 0.00 37.83 35.63 1umf s LYS 228 CO -0.04 -1.67 1.68 1.25 -0.92 0.00 0.00 175.35 175.65 1umf h LEU 229 N -0.34 -0.39 -1.61 3.17 5.85 -0.15 -1.54 115.31 120.30 1umf h LEU 229 Ca -0.47 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.23 1umf h LEU 229 Cb 1.27 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 1umf h LEU 229 CO 0.51 -0.28 -0.16 -2.24 -0.34 0.00 0.00 178.44 175.93 1umf h ASP 230 N -0.46 0.04 -0.31 1.25 2.03 -1.93 -1.12 116.42 115.92 1umf h ASP 230 Ca -0.05 -0.01 -0.06 0.00 -0.73 0.00 0.00 57.03 56.19 1umf h ASP 230 Cb 0.35 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 38.83 1umf h ASP 230 CO 0.08 0.21 -0.02 0.00 -1.03 0.00 0.00 179.24 178.47 1umf h ALA 231 N 1.80 0.43 -0.08 4.15 0.00 -1.82 -0.67 119.26 123.06 1umf h ALA 231 Ca 0.01 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1umf h ALA 231 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1umf h ALA 231 CO 0.02 0.20 -0.51 0.87 0.00 0.00 0.00 179.25 179.84 1umf h LYS 232 N 0.36 0.20 -0.37 0.00 1.79 -0.95 -0.50 116.57 117.09 1umf h LYS 232 Ca 0.09 -0.12 -0.07 0.00 -2.18 0.00 0.00 60.65 58.37 1umf h LYS 232 Cb 0.48 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 1umf h LYS 232 CO 0.02 0.66 -0.02 0.82 -1.08 0.00 0.00 179.45 179.85 1umf h ILE 233 N 0.16 1.26 -0.70 1.86 2.04 -1.07 -1.59 117.51 119.48 1umf h ILE 233 Ca 0.01 -1.04 -0.08 0.00 1.00 0.00 0.00 64.86 64.75 1umf h ILE 233 Cb 0.95 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1umf h ILE 233 CO 0.08 0.35 0.14 0.00 0.00 0.00 0.00 178.15 178.71 1umf h ALA 234 N 0.86 0.92 -0.77 1.87 0.00 -0.88 -1.26 119.26 120.01 1umf h ALA 234 Ca 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1umf h ALA 234 Cb 0.50 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1umf h ALA 234 CO 0.02 0.67 0.45 1.49 0.00 0.00 0.00 179.25 181.89 1umf h GLU 235 N 1.07 1.05 -0.22 0.00 4.81 -0.94 -0.50 114.58 119.85 1umf h GLU 235 Ca 0.22 -0.10 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 1umf h GLU 235 Cb 0.41 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1umf h GLU 235 CO 0.01 0.75 -0.47 0.00 -0.73 0.00 0.00 179.01 178.57 1umf h ALA 236 N 1.24 0.35 0.04 2.92 0.00 -1.01 -2.49 119.26 120.31 1umf h ALA 236 Ca 0.27 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1umf h ALA 236 Cb -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1umf h ALA 236 CO -0.05 0.50 -0.02 0.52 0.00 0.00 0.00 179.25 180.21 1umf h MET 237 N 0.41 -0.05 -0.01 0.00 2.86 -1.12 -3.12 114.93 113.90 1umf h MET 237 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1umf h MET 237 Cb 1.08 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.75 1umf h MET 237 CO 0.10 0.51 0.01 1.98 1.06 0.00 0.00 176.91 180.57 1umf h MET 238 N -0.65 0.00 0.00 1.72 -1.53 -1.20 0.69 114.93 113.95 1umf h MET 238 Ca -0.01 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.25 1umf h MET 238 Cb 0.58 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.63 1umf h MET 238 CO 0.01 0.00 0.00 0.78 0.14 0.00 0.00 176.91 177.84 1umf h GLY 239 N 0.00 0.00 -4.62 1.39 0.00 -1.38 -3.44 103.07 95.03 1umf h GLY 239 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1umf h GLY 239 CO -0.00 0.00 0.65 -2.27 0.00 0.00 0.00 176.54 174.92 1umf s LEU 240 N -4.71 4.34 0.18 3.11 0.20 0.23 -4.95 118.68 117.09 1umf s LEU 240 Ca 0.06 2.03 -0.33 0.00 0.69 0.00 0.00 54.13 56.58 1umf s LEU 240 Cb 0.10 -3.57 -0.13 0.00 -0.43 0.00 0.00 46.19 42.15 1umf s LEU 240 CO 0.47 -0.56 1.60 -3.20 -0.29 0.00 0.00 176.35 174.37 1umf n ASN 241 N 4.43 3.28 0.00 3.68 4.05 -1.26 -1.79 115.26 127.65 1umf n ASN 241 Ca 0.10 1.08 0.00 0.00 0.45 0.00 0.00 54.58 56.22 1umf n ASN 241 Cb 0.45 -1.46 0.00 0.00 1.23 0.00 0.00 39.78 40.00 1umf n ASN 241 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1umf n GLY 242 N 3.41 1.73 3.71 8.20 0.00 -1.26 -5.03 105.19 115.95 1umf n GLY 242 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.43 5.03 -0.24 1.61 1.01 -0.74 -0.47 120.40 124.18 1umf s VAL 243 Ca 0.00 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.48 1umf s VAL 243 Cb 0.00 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 1umf s VAL 243 CO 0.00 0.23 0.33 0.29 0.00 0.00 0.00 175.10 175.95 1umf n LYS 244 N 3.92 3.10 -3.57 2.72 4.76 -0.20 -4.90 118.16 123.98 1umf n LYS 244 Ca -0.01 -0.31 -0.13 0.00 -2.87 0.00 0.00 58.31 55.00 1umf n LYS 244 Cb 0.51 -0.82 -0.06 0.00 -1.84 0.00 0.00 35.03 32.82 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 -0.80 -1.88 -0.01 7.82 0.00 -1.23 -5.01 121.76 120.64 1umf s ALA 245 Ca 0.02 1.58 0.02 0.00 0.00 0.00 0.00 51.96 53.57 1umf s ALA 245 Cb 0.02 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1umf s ALA 245 CO 0.08 -0.32 -0.05 0.08 0.00 0.00 0.00 175.76 175.55 1umf s VAL 246 N -0.85 0.42 0.05 0.00 1.01 -1.26 -1.20 120.40 118.57 1umf s VAL 246 Ca -0.04 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 61.81 1umf s VAL 246 Cb -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 1umf s VAL 246 CO 0.03 0.13 -0.19 -1.61 0.00 0.00 0.00 175.10 173.46 1umf s GLU 247 N 0.07 1.23 -0.17 2.72 2.02 0.21 -4.97 118.70 119.80 1umf s GLU 247 Ca -0.00 -0.93 0.00 0.00 0.02 0.00 0.00 54.97 54.06 1umf s GLU 247 Cb -0.04 -1.34 0.01 0.00 0.10 0.00 0.00 34.13 32.86 1umf s GLU 247 CO -0.00 0.33 -0.17 0.42 0.02 0.00 0.00 175.26 175.86 1umf s ILE 248 N -0.87 2.36 0.00 -1.63 -1.09 -1.26 -1.16 121.20 117.55 1umf s ILE 248 Ca 0.06 -0.85 0.00 0.00 -2.23 0.00 0.00 60.65 57.63 1umf s ILE 248 Cb -0.09 -2.00 0.00 0.00 -1.58 0.00 0.00 42.46 38.79 1umf s ILE 248 CO 0.02 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 1umf n GLY 249 N 4.45 3.24 0.34 6.18 0.00 0.22 -1.91 105.19 117.70 1umf n GLY 249 Ca -0.20 -0.18 0.18 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.09 -3.46 116.57 115.25 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 -1.17 3.05 0.25 5.01 0.00 -0.80 -2.14 105.19 109.39 1umf n GLY 251 Ca -0.02 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 45.98 1umf n GLY 251 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1umf h VAL 252 N 0.00 0.95 0.00 1.61 -1.51 -1.91 -0.85 116.25 114.54 1umf h VAL 252 Ca 0.00 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1umf h VAL 252 Cb 0.00 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.28 1umf h VAL 252 CO 0.00 0.06 0.00 -0.33 -1.23 0.00 0.00 177.57 176.07 1umf h GLU 253 N 0.00 0.00 -0.91 5.19 5.08 -1.82 -3.08 114.58 119.04 1umf h GLU 253 Ca -0.00 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1umf h GLU 253 Cb 0.11 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.29 1umf h GLU 253 CO 0.01 0.00 0.55 0.77 -1.00 0.00 0.00 179.01 179.34 1umf h SER 254 N 0.00 0.84 0.25 1.42 0.02 -1.14 -1.44 113.55 113.49 1umf h SER 254 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1umf h SER 254 Cb 0.40 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.81 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 -4.64 0.00 -0.45 3.07 3.41 -1.16 -2.23 113.62 111.61 1umf n SER 255 Ca 0.15 0.02 0.10 0.00 -0.26 0.00 0.00 58.87 58.88 1umf n SER 255 Cb 0.26 -0.26 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.26 1.88 -4.95 1.04 4.77 -0.54 -4.98 117.00 112.95 1umf n LEU 256 Ca 0.07 -0.77 -0.24 0.00 -0.03 0.00 0.00 56.01 55.04 1umf n LEU 256 Cb 0.11 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1umf n LEU 256 CO 0.11 0.35 -0.04 -0.76 -1.33 0.00 0.00 177.39 175.73 1umf s LEU 257 N -2.26 4.29 0.42 2.23 1.02 -0.95 -5.11 118.68 118.32 1umf s LEU 257 Ca 0.16 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.49 1umf s LEU 257 Cb 0.16 -2.96 -0.02 0.00 0.02 0.00 0.00 46.19 43.39 1umf s LEU 257 CO 0.49 -0.03 0.66 -0.54 0.02 0.00 0.00 176.35 176.94 1umf s LYS 258 N -3.61 3.31 0.21 1.70 1.02 -1.26 -4.90 119.74 116.20 1umf s LYS 258 Ca 0.35 -0.28 -0.10 0.00 0.02 0.00 0.00 55.97 55.96 1umf s LYS 258 Cb -0.10 -2.55 0.28 0.00 -0.52 0.00 0.00 37.83 34.94 1umf s LYS 258 CO 0.29 -0.12 1.71 0.78 -0.92 0.00 0.00 175.35 177.09 1umf h GLY 259 N 0.47 0.75 2.00 -3.33 0.00 -1.99 0.01 103.07 100.98 1umf h GLY 259 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1umf h GLY 259 CO 0.60 -0.10 0.00 1.48 0.00 0.00 0.00 176.54 178.52 1umf h SER 260 N 0.26 0.00 0.30 0.19 4.64 -1.94 -1.72 113.55 115.29 1umf h SER 260 Ca 0.31 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.30 1umf h SER 260 Cb 0.44 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.48 1umf h SER 260 CO -0.39 0.00 -1.96 -0.62 -0.87 0.00 0.00 176.83 173.00 1umf n GLU 261 N -2.71 0.66 -0.10 4.77 1.02 -0.10 -4.65 120.64 119.54 1umf n GLU 261 Ca -0.01 0.20 -0.18 0.00 -0.02 0.00 0.00 57.16 57.14 1umf n GLU 261 Cb 0.12 -1.70 -0.09 0.00 -0.02 0.00 0.00 31.44 29.75 1umf n GLU 261 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1umf n TYR 262 N -3.00 0.93 -1.44 -0.32 4.19 -0.68 -4.95 117.16 111.89 1umf n TYR 262 Ca -0.24 0.40 -0.56 0.00 3.31 0.00 0.00 57.90 60.81 1umf n TYR 262 Cb 1.08 -1.02 -0.08 0.00 0.49 0.00 0.00 39.34 39.81 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 -4.46 0.34 -4.63 2.98 4.13 -0.68 -4.71 115.26 108.23 1umf n ASN 263 Ca -0.28 1.06 -0.41 0.00 1.68 0.00 0.00 54.58 56.64 1umf n ASN 263 Cb 0.60 -0.82 -0.06 0.00 -1.54 0.00 0.00 39.78 37.96 1umf n ASN 263 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1umf s ASP 264 N 0.87 6.61 0.63 6.41 1.01 -1.26 -5.00 116.67 125.93 1umf s ASP 264 Ca 0.87 0.75 -0.10 0.00 0.71 0.00 0.00 52.55 54.78 1umf s ASP 264 Cb -1.22 -2.35 -0.01 0.00 1.01 0.00 0.00 42.92 40.35 1umf s ASP 264 CO 0.59 -0.39 1.00 -0.76 0.21 0.00 0.00 175.17 175.82 1umf s LEU 265 N 2.56 3.16 0.07 1.23 1.43 -1.26 -4.86 118.68 121.00 1umf s LEU 265 Ca 0.27 1.13 0.05 0.00 -1.03 0.00 0.00 54.13 54.56 1umf s LEU 265 Cb -0.15 -4.04 -0.03 0.00 0.03 0.00 0.00 46.19 42.00 1umf s LEU 265 CO 0.08 -1.03 -0.15 -0.04 0.23 0.00 0.00 176.35 175.44 1umf s MET 266 N -5.16 0.87 0.15 1.70 -1.94 -1.26 0.35 119.30 114.02 1umf s MET 266 Ca 0.55 -0.92 0.01 0.00 -1.71 0.00 0.00 55.69 53.62 1umf s MET 266 Cb -0.11 -0.90 -0.00 0.00 2.01 0.00 0.00 34.83 35.83 1umf s MET 266 CO 0.51 0.21 0.03 -0.40 -0.01 0.00 0.00 175.02 175.35 1umf n ASP 267 N 1.42 1.58 0.14 3.03 3.85 -0.36 -4.94 116.55 121.28 1umf n ASP 267 Ca -0.20 -1.76 0.06 0.00 -0.71 0.00 0.00 54.79 52.18 1umf n ASP 267 Cb 0.54 0.27 0.53 0.00 -1.35 0.00 0.00 41.12 41.11 1umf n ASP 267 CO 0.00 0.00 0.00 -0.61 -1.01 0.00 0.00 177.20 175.58 1umf h GLN 268 N 0.00 0.24 0.00 0.11 4.15 -2.01 -2.89 115.11 114.70 1umf h GLN 268 Ca -0.12 -0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.15 1umf h GLN 268 Cb 0.43 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1umf h GLN 268 CO 0.20 0.18 -0.75 0.87 -1.93 0.00 0.00 178.83 177.39 1umf h LYS 269 N 0.24 0.00 0.00 1.69 1.57 -2.04 -3.50 116.57 114.54 1umf h LYS 269 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1umf h LYS 269 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1umf h LYS 269 CO -0.01 0.49 0.00 0.41 -0.57 0.00 0.00 179.45 179.76 1umf n GLY 270 N 1.27 -0.52 3.78 3.86 0.00 -1.09 -5.04 105.19 107.45 1umf n GLY 270 Ca -0.01 -1.20 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 1umf n GLY 270 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1umf s PHE 271 N -2.99 3.23 -0.78 1.61 0.40 -1.26 -1.23 117.98 116.97 1umf s PHE 271 Ca 0.00 1.63 0.26 0.00 -0.60 0.00 0.00 56.93 58.22 1umf s PHE 271 Cb 0.00 -3.13 0.64 0.00 0.51 0.00 0.00 43.02 41.04 1umf s PHE 271 CO 0.00 -0.67 1.55 1.28 0.70 0.00 0.00 175.22 178.09 1umf n LEU 272 N -0.16 0.59 -3.88 -0.37 4.77 0.16 -4.90 117.00 113.21 1umf n LEU 272 Ca 0.05 0.33 -0.09 0.00 -0.03 0.00 0.00 56.01 56.27 1umf n LEU 272 Cb 0.50 -0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1umf n LEU 272 CO 0.45 -0.05 0.21 -0.94 -1.33 0.00 0.00 177.39 175.73 1umf s SER 273 N -3.92 -0.15 -0.41 -1.43 1.04 -1.26 -4.98 113.70 102.59 1umf s SER 273 Ca 0.09 -0.71 0.10 0.00 0.48 0.00 0.00 55.95 55.92 1umf s SER 273 Cb 0.15 0.57 0.41 0.00 0.10 0.00 0.00 66.02 67.25 1umf s SER 273 CO 0.65 -1.09 0.99 -3.20 0.98 0.00 0.00 173.24 171.58 1umf n ASN 274 N -0.35 3.09 0.15 7.02 5.15 -1.26 -4.80 115.26 124.26 1umf n ASN 274 Ca -0.06 -3.28 0.02 0.00 -0.60 0.00 0.00 54.58 50.66 1umf n ASN 274 Cb 0.62 -0.52 0.38 0.00 -0.53 0.00 0.00 39.78 39.73 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 2.83 0.14 0.00 1.20 -0.00 -1.96 -1.88 114.38 114.71 1umf h ARG 275 Ca 0.11 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.55 1umf h ARG 275 Cb 0.96 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.91 1umf h ARG 275 CO 0.68 0.38 0.00 0.77 0.00 0.00 0.00 179.97 181.80 1umf h SER 276 N 0.13 0.00 -1.09 7.04 0.02 -1.88 0.75 113.55 118.52 1umf h SER 276 Ca 0.02 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.76 1umf h SER 276 Cb 0.50 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1umf h SER 276 CO 0.03 0.00 -0.24 0.61 -1.14 0.00 0.00 176.83 176.09 1umf n GLY 277 N -0.86 0.47 1.91 -3.77 0.00 -0.71 -3.04 105.19 99.19 1umf n GLY 277 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.29 1.04 2.91 -0.02 0.00 -1.03 -0.64 105.19 106.16 1umf n GLY 278 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.15 1.20 -0.14 1.61 1.01 -1.17 -1.43 120.40 118.33 1umf s VAL 279 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1umf s VAL 279 Cb 0.00 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1umf s VAL 279 CO 0.00 0.18 -0.13 -0.22 0.00 0.00 0.00 175.10 174.93 1umf s LEU 280 N 1.60 1.60 -0.49 3.92 2.96 0.59 -4.66 118.68 124.20 1umf s LEU 280 Ca 0.01 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 1umf s LEU 280 Cb -0.15 -1.12 0.00 0.00 0.50 0.00 0.00 46.19 45.42 1umf s LEU 280 CO -0.08 -0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.49 1umf n GLY 281 N 4.80 0.71 1.09 7.98 0.00 -1.26 -2.38 105.19 116.14 1umf n GLY 281 Ca -0.16 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.90 0.69 3.28 -0.02 0.00 -1.26 -5.00 105.19 100.98 1umf n GLY 282 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.64 1.26 0.29 1.61 -1.94 -1.00 0.53 119.30 119.40 1umf s MET 283 Ca 0.00 -1.07 -0.30 0.00 -1.71 0.00 0.00 55.69 52.61 1umf s MET 283 Cb 0.00 -1.47 -0.11 0.00 2.01 0.00 0.00 34.83 35.26 1umf s MET 283 CO 0.00 0.36 1.58 -1.54 -0.01 0.00 0.00 175.02 175.40 1umf s SER 284 N -1.59 6.40 0.00 3.03 1.04 -0.00 -0.30 113.70 122.28 1umf s SER 284 Ca 0.07 2.92 0.18 0.00 0.48 0.00 0.00 55.95 59.60 1umf s SER 284 Cb -0.09 -2.63 0.47 0.00 0.10 0.00 0.00 66.02 63.87 1umf s SER 284 CO 0.03 -0.89 1.39 -0.46 0.98 0.00 0.00 173.24 174.29 1umf n ASN 285 N 2.17 3.45 0.00 7.02 6.94 -0.52 -0.49 115.26 133.83 1umf n ASN 285 Ca 0.08 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.66 1umf n ASN 285 Cb 0.38 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 1umf n ASN 285 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1umf n GLY 286 N 1.18 2.76 3.90 4.83 0.00 -1.26 -4.90 105.19 111.70 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 -0.11 1.12 0.34 1.61 0.41 -1.26 -1.38 118.70 119.42 1umf s GLU 287 Ca 0.00 -0.15 -0.29 0.00 -0.41 0.00 0.00 54.97 54.13 1umf s GLU 287 Cb 0.00 -1.88 -0.11 0.00 -1.78 0.00 0.00 34.13 30.36 1umf s GLU 287 CO 0.00 -2.13 1.49 -1.21 -0.49 0.00 0.00 175.26 172.92 1umf s GLU 288 N -5.71 4.15 -0.25 1.61 2.02 -1.26 -4.60 118.70 114.67 1umf s GLU 288 Ca 0.68 2.52 -0.23 0.00 0.02 0.00 0.00 54.97 57.97 1umf s GLU 288 Cb -0.08 -3.01 -0.01 0.00 0.10 0.00 0.00 34.13 31.14 1umf s GLU 288 CO 0.52 -0.52 0.73 0.42 0.02 0.00 0.00 175.26 176.43 1umf s ILE 289 N -0.72 4.91 -0.23 -1.63 1.01 -0.86 -2.47 121.20 121.21 1umf s ILE 289 Ca 0.56 1.36 -0.04 0.00 0.00 0.00 0.00 60.65 62.53 1umf s ILE 289 Cb -0.46 -4.03 -0.00 0.00 0.01 0.00 0.00 42.46 37.98 1umf s ILE 289 CO 0.56 -0.02 -0.04 -0.63 0.00 0.00 0.00 174.94 174.81 1umf s ILE 290 N 2.67 3.33 -0.02 2.92 -1.09 0.18 -2.30 121.20 126.90 1umf s ILE 290 Ca 0.31 -0.59 0.05 0.00 -2.23 0.00 0.00 60.65 58.19 1umf s ILE 290 Cb -0.15 -2.56 -0.01 0.00 -1.58 0.00 0.00 42.46 38.16 1umf s ILE 290 CO 0.08 0.37 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.29 1umf s VAL 291 N 1.46 1.40 -0.09 2.92 1.01 -0.16 -0.61 120.40 126.33 1umf s VAL 291 Ca 0.05 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1umf s VAL 291 Cb -0.15 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.07 1umf s VAL 291 CO -0.03 0.40 -0.20 -0.13 0.00 0.00 0.00 175.10 175.14 1umf s ARG 292 N -0.39 2.60 -0.16 2.72 0.52 -0.31 -0.42 118.95 123.50 1umf s ARG 292 Ca 0.06 -0.72 0.01 0.00 -0.52 0.00 0.00 55.73 54.56 1umf s ARG 292 Cb -0.07 -2.01 0.02 0.00 0.52 0.00 0.00 34.95 33.40 1umf s ARG 292 CO -0.01 0.11 -0.18 0.08 0.02 0.00 0.00 175.30 175.32 1umf s VAL 293 N 0.49 1.89 -0.26 3.52 1.01 -0.35 -0.62 120.40 126.09 1umf s VAL 293 Ca -0.16 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 60.82 1umf s VAL 293 Cb -0.17 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1umf s VAL 293 CO 0.06 0.51 0.37 -1.00 0.00 0.00 0.00 175.10 175.05 1umf s HIS 294 N 1.27 3.27 -0.14 5.22 3.76 -0.34 -1.54 115.29 126.78 1umf s HIS 294 Ca 0.03 0.44 -0.06 0.00 -0.15 0.00 0.00 55.06 55.31 1umf s HIS 294 Cb -0.13 -2.56 -0.04 0.00 1.11 0.00 0.00 32.58 30.96 1umf s HIS 294 CO -0.10 -0.19 0.08 -0.06 -0.85 0.00 0.00 174.74 173.62 1umf s PHE 295 N 1.93 3.35 0.86 1.40 0.40 -0.41 -1.03 117.98 124.48 1umf s PHE 295 Ca 0.15 0.27 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 1umf s PHE 295 Cb -0.16 -1.98 0.11 0.00 0.51 0.00 0.00 43.02 41.50 1umf s PHE 295 CO 0.09 0.42 1.13 -1.59 0.70 0.00 0.00 175.22 175.97 1umf s LYS 296 N -0.34 1.55 0.69 0.44 -2.85 0.38 -2.52 119.74 117.09 1umf s LYS 296 Ca 0.09 0.39 -0.15 0.00 -1.00 0.00 0.00 55.97 55.31 1umf s LYS 296 Cb -0.12 -1.88 0.02 0.00 -2.06 0.00 0.00 37.83 33.79 1umf s LYS 296 CO 0.02 -1.93 1.13 -1.25 0.10 0.00 0.00 175.35 173.42 1umf s PRO 297 N -5.27 2.54 0.12 1.78 0.04 -1.26 -4.53 135.00 128.43 1umf s PRO 297 Ca 0.63 1.48 -0.35 0.00 0.04 0.00 0.00 61.00 62.79 1umf s PRO 297 Cb -0.14 -1.91 -0.16 0.00 0.04 0.00 0.00 34.50 32.33 1umf s PRO 297 CO 0.53 -1.47 1.39 2.41 0.04 0.00 0.00 177.00 179.90 1umf n THR 298 N -2.61 0.15 -0.12 1.26 -1.04 -1.26 -4.89 114.28 105.77 1umf n THR 298 Ca 0.11 -0.04 -0.08 0.00 -2.04 0.00 0.00 64.05 62.00 1umf n THR 298 Cb 0.52 -1.04 -0.00 0.00 -1.82 0.00 0.00 70.33 67.98 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 4.76 0.49 -6.29 -2.82 0.11 -1.90 -3.43 132.00 122.93 1umf h PRO 299 Ca -0.46 -0.03 -0.57 0.00 0.11 0.00 0.00 66.00 65.05 1umf h PRO 299 Cb 1.31 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.25 1umf h PRO 299 CO 0.80 0.33 0.89 -1.12 -0.21 0.00 0.00 178.00 178.68 1umf s SER 300 N -5.53 6.87 -0.00 -2.05 0.01 -1.26 -4.91 113.70 106.82 1umf s SER 300 Ca -0.13 1.19 0.03 0.00 1.31 0.00 0.00 55.95 58.35 1umf s SER 300 Cb 0.10 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.78 1umf s SER 300 CO 0.72 -0.91 -0.09 0.27 0.41 0.00 0.00 173.24 173.64 1umf s ILE 301 N 3.82 0.68 -1.30 1.44 -4.36 -1.26 -4.78 121.20 115.45 1umf s ILE 301 Ca 0.50 -0.44 -0.14 0.00 -0.26 0.00 0.00 60.65 60.31 1umf s ILE 301 Cb -0.15 -0.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.94 1umf s ILE 301 CO 0.17 0.14 2.33 0.33 0.24 0.00 0.00 174.94 178.15 1umf n PHE 302 N 2.73 2.68 -3.77 1.37 -0.00 -1.23 -4.14 117.46 115.11 1umf n PHE 302 Ca -0.14 -2.65 -0.13 0.00 -0.00 0.00 0.00 57.45 54.53 1umf n PHE 302 Cb 0.57 -2.27 -0.10 0.00 -0.00 0.00 0.00 39.48 37.68 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 3.34 0.46 0.29 -4.13 -0.21 -1.26 -4.85 119.66 113.29 1umf s GLN 303 Ca 0.54 0.24 -0.30 0.00 0.02 0.00 0.00 55.36 55.85 1umf s GLN 303 Cb 0.15 0.21 -0.12 0.00 1.00 0.00 0.00 33.01 34.25 1umf s GLN 303 CO -0.03 -0.08 1.62 -1.25 -2.12 0.00 0.00 175.29 173.43 1umf s PRO 304 N -0.30 4.11 -0.03 2.91 0.04 -1.26 -4.51 135.00 135.96 1umf s PRO 304 Ca -0.04 2.61 0.00 0.00 0.04 0.00 0.00 61.00 63.61 1umf s PRO 304 Cb -0.03 -3.02 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1umf s PRO 304 CO 0.02 -0.67 0.00 -0.65 0.04 0.00 0.00 177.00 175.74 1umf s GLN 305 N -0.30 0.32 0.09 4.56 -0.21 0.15 -4.93 119.66 119.34 1umf s GLN 305 Ca 0.65 0.08 -0.31 0.00 0.02 0.00 0.00 55.36 55.80 1umf s GLN 305 Cb -0.49 -0.50 -0.06 0.00 1.00 0.00 0.00 33.01 32.96 1umf s GLN 305 CO 0.46 -0.14 1.22 1.03 -2.12 0.00 0.00 175.29 175.74 1umf s ARG 306 N 1.06 4.43 0.00 2.91 0.52 -1.26 -0.61 118.95 126.00 1umf s ARG 306 Ca -0.09 1.83 0.00 0.00 -0.52 0.00 0.00 55.73 56.94 1umf s ARG 306 Cb -0.13 -3.31 0.00 0.00 0.52 0.00 0.00 34.95 32.02 1umf s ARG 306 CO -0.02 -0.24 0.00 -2.37 0.02 0.00 0.00 175.30 172.69 1umf n THR 307 N 3.63 0.00 -4.13 0.02 5.66 -0.99 -4.94 114.28 113.53 1umf n THR 307 Ca 0.08 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.98 1umf n THR 307 Cb 0.45 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.13 1umf n THR 307 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1umf s ILE 308 N -2.74 0.57 0.69 1.09 -4.36 -1.26 -1.83 121.20 113.36 1umf s ILE 308 Ca 0.00 -1.70 0.02 0.00 -0.26 0.00 0.00 60.65 58.71 1umf s ILE 308 Cb 0.00 -1.38 0.13 0.00 1.25 0.00 0.00 42.46 42.46 1umf s ILE 308 CO 0.00 -0.78 0.96 1.51 0.24 0.00 0.00 174.94 176.87 1umf s ASP 309 N -2.66 4.47 0.26 4.36 3.84 -0.59 -1.75 116.67 124.60 1umf s ASP 309 Ca 0.05 -0.55 0.18 0.00 -0.00 0.00 0.00 52.55 52.23 1umf s ASP 309 Cb 0.02 0.18 0.95 0.00 -1.38 0.00 0.00 42.92 42.68 1umf s ASP 309 CO -0.04 -1.78 1.54 2.30 -0.00 0.00 0.00 175.17 177.19 1umf n ILE 310 N -2.71 1.20 1.14 2.11 -5.35 -0.60 -0.97 119.36 114.18 1umf n ILE 310 Ca 0.16 0.66 0.12 0.00 -0.27 0.00 0.00 62.75 63.42 1umf n ILE 310 Cb 0.61 -1.65 0.20 0.00 -1.74 0.00 0.00 39.64 37.06 1umf n ILE 310 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1umf n ASN 311 N -2.11 1.52 0.00 7.28 3.02 -1.26 -4.95 115.26 118.76 1umf n ASN 311 Ca -0.01 -1.21 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1umf n ASN 311 Cb 0.04 0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 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 1.37 0.75 3.81 7.41 0.00 -0.14 -5.06 105.19 113.33 1umf n GLY 312 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1umf n GLY 312 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1umf s ASN 313 N -2.50 6.83 0.26 1.61 0.02 -1.26 -4.80 114.94 115.10 1umf s ASN 313 Ca 0.00 0.98 -0.30 0.00 -1.02 0.00 0.00 52.86 52.52 1umf s ASN 313 Cb 0.00 -2.28 -0.10 0.00 0.02 0.00 0.00 41.25 38.89 1umf s ASN 313 CO 0.00 0.24 1.45 -1.61 0.02 0.00 0.00 177.10 177.20 1umf s GLU 314 N -0.70 4.25 0.29 -0.60 2.02 -1.26 -1.54 118.70 121.16 1umf s GLU 314 Ca 0.25 2.33 -0.11 0.00 0.02 0.00 0.00 54.97 57.46 1umf s GLU 314 Cb -0.17 -3.09 0.01 0.00 0.10 0.00 0.00 34.13 30.97 1umf s GLU 314 CO 0.14 -0.43 0.53 0.00 0.02 0.00 0.00 175.26 175.51 1umf s GLU 316 N -3.59 3.95 -0.29 0.00 2.12 -1.26 -2.35 118.70 117.27 1umf s GLU 316 Ca 0.23 -0.29 -0.11 0.00 0.36 0.00 0.00 54.97 55.16 1umf s GLU 316 Cb -0.01 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 1umf s GLU 316 CO 0.12 0.34 0.18 0.00 -0.54 0.00 0.00 175.26 175.36 1umf s LEU 318 N 1.72 1.80 -0.77 0.00 1.98 -1.26 -0.67 118.68 121.47 1umf s LEU 318 Ca 0.06 -2.25 -0.26 0.00 -2.89 0.00 0.00 54.13 48.79 1umf s LEU 318 Cb -0.16 -0.71 0.03 0.00 0.66 0.00 0.00 46.19 46.01 1umf s LEU 318 CO 0.09 -0.31 1.29 -0.76 -1.89 0.00 0.00 176.35 174.77 1umf s LEU 319 N 0.90 3.24 0.69 -0.68 1.43 -1.26 -4.68 118.68 118.31 1umf s LEU 319 Ca 0.16 -0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 52.57 1umf s LEU 319 Cb -0.23 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.45 1umf s LEU 319 CO -0.04 -1.79 1.07 -0.54 0.23 0.00 0.00 176.35 175.28 1umf s LYS 320 N 5.60 2.85 0.00 1.70 3.01 -1.08 -3.68 119.74 128.14 1umf s LYS 320 Ca 0.36 1.09 0.00 0.00 -1.01 0.00 0.00 55.97 56.40 1umf s LYS 320 Cb -0.07 -1.97 0.00 0.00 -1.01 0.00 0.00 37.83 34.77 1umf s LYS 320 CO 0.12 -1.18 0.00 0.41 0.51 0.00 0.00 175.35 175.21 1umf n GLY 321 N -1.50 0.56 3.78 -3.33 0.00 -1.26 -3.38 105.19 100.05 1umf n GLY 321 Ca 0.08 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.66 2.45 0.13 1.61 3.00 -1.26 -4.68 118.95 117.53 1umf s ARG 322 Ca 0.00 1.17 -0.06 0.00 0.00 0.00 0.00 55.73 56.83 1umf s ARG 322 Cb 0.00 -1.92 -0.02 0.00 0.00 0.00 0.00 34.95 33.01 1umf s ARG 322 CO 0.00 -1.50 0.18 -1.01 0.00 0.00 0.00 175.30 172.98 1umf s HIS 323 N -2.84 0.47 -0.09 -0.53 3.76 -1.26 -4.96 115.29 109.83 1umf s HIS 323 Ca 0.61 -0.86 -0.29 0.00 -0.15 0.00 0.00 55.06 54.37 1umf s HIS 323 Cb -0.17 -0.19 -0.05 0.00 1.11 0.00 0.00 32.58 33.28 1umf s HIS 323 CO 0.54 -0.61 1.69 0.34 -0.85 0.00 0.00 174.74 175.85 1umf s ASP 324 N -2.96 6.54 0.37 1.40 -1.08 -1.26 -4.85 116.67 114.83 1umf s ASP 324 Ca 0.15 2.12 0.28 0.00 -0.52 0.00 0.00 52.55 54.57 1umf s ASP 324 Cb 0.05 -2.53 1.10 0.00 -1.46 0.00 0.00 42.92 40.08 1umf s ASP 324 CO -0.03 -1.05 1.82 1.55 0.52 0.00 0.00 175.17 177.98 1umf h PRO 325 N 10.08 0.00 -1.20 4.34 0.13 -1.94 -3.41 132.00 140.00 1umf h PRO 325 Ca -0.39 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.66 1umf h PRO 325 Cb 1.18 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 1umf h PRO 325 CO 0.96 0.00 -0.47 0.00 -0.23 0.00 0.00 178.00 178.26 1umf h ILE 327 N 5.42 0.31 -0.56 0.00 3.07 -1.79 -2.60 117.51 121.35 1umf h ILE 327 Ca 0.02 0.00 0.16 0.00 1.55 0.00 0.00 64.86 66.59 1umf h ILE 327 Cb 1.16 0.94 -0.02 0.00 -0.27 0.00 0.00 36.82 38.63 1umf h ILE 327 CO 0.14 0.00 0.40 0.00 -1.05 0.00 0.00 178.15 177.65 1umf h ALA 328 N 1.90 2.48 0.51 0.16 0.00 -1.88 -0.64 119.26 121.80 1umf h ALA 328 Ca 0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1umf h ALA 328 Cb 0.15 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1umf h ALA 328 CO -0.00 -0.64 -0.25 0.82 0.00 0.00 0.00 179.25 179.18 1umf h ILE 329 N 0.04 0.00 -0.33 0.00 2.04 -1.83 -1.13 117.51 116.29 1umf h ILE 329 Ca 0.27 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 66.08 1umf h ILE 329 Cb 1.02 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1umf h ILE 329 CO -0.01 0.00 0.11 0.03 0.00 0.00 0.00 178.15 178.27 1umf h ARG 330 N -0.71 0.48 -0.97 2.37 3.08 -1.76 -2.67 114.38 114.19 1umf h ARG 330 Ca -0.07 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.03 1umf h ARG 330 Cb 0.53 -0.09 -0.08 0.00 0.08 0.00 0.00 29.97 30.41 1umf h ARG 330 CO 0.12 0.42 0.61 0.78 -1.07 0.00 0.00 179.97 180.82 1umf h GLY 331 N 0.66 1.57 0.30 0.04 0.00 -0.90 -2.50 103.07 102.25 1umf h GLY 331 Ca 0.12 -0.41 0.10 0.00 0.00 0.00 0.00 47.33 47.14 1umf h GLY 331 CO -0.01 0.17 0.20 1.48 0.00 0.00 0.00 176.54 178.38 1umf h SER 332 N 0.98 0.15 -0.60 0.19 4.64 -0.84 0.11 113.55 118.19 1umf h SER 332 Ca 0.47 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1umf h SER 332 Cb 0.43 0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 1umf h SER 332 CO -0.25 0.09 0.39 0.58 -0.87 0.00 0.00 176.83 176.76 1umf h VAL 333 N 0.35 1.16 -0.73 0.95 2.07 -1.59 -0.45 116.25 118.02 1umf h VAL 333 Ca 0.31 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1umf h VAL 333 Cb 0.42 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1umf h VAL 333 CO -0.34 0.16 0.33 0.58 0.02 0.00 0.00 177.57 178.32 1umf h VAL 334 N 0.81 1.24 -0.72 2.57 2.07 -1.09 -1.16 116.25 119.97 1umf h VAL 334 Ca 0.22 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1umf h VAL 334 Cb -0.08 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1umf h VAL 334 CO -0.05 0.29 0.39 0.00 0.02 0.00 0.00 177.57 178.23 1umf h GLU 336 N 1.00 0.85 -0.26 0.00 4.81 -0.34 0.05 114.58 120.70 1umf h GLU 336 Ca 0.25 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1umf h GLU 336 Cb 0.02 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1umf h GLU 336 CO -0.04 0.68 0.04 0.77 -0.73 0.00 0.00 179.01 179.73 1umf h SER 337 N 0.81 0.42 -0.77 1.04 0.02 -0.49 -2.39 113.55 112.19 1umf h SER 337 Ca 0.21 -0.26 0.05 0.00 -0.84 0.00 0.00 61.79 60.94 1umf h SER 337 Cb 0.10 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.48 1umf h SER 337 CO -0.03 0.58 0.47 -0.07 -1.14 0.00 0.00 176.83 176.64 1umf h LEU 338 N 0.24 0.75 -1.06 5.07 3.38 -0.73 -0.70 115.31 122.27 1umf h LEU 338 Ca 0.08 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1umf h LEU 338 Cb 0.34 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1umf h LEU 338 CO 0.01 0.49 0.22 0.25 0.09 0.00 0.00 178.44 179.50 1umf h LEU 339 N 0.88 0.82 -0.52 1.67 5.85 -0.84 -1.14 115.31 122.04 1umf h LEU 339 Ca 0.33 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1umf h LEU 339 Cb 0.11 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1umf h LEU 339 CO -0.15 0.75 0.05 0.00 -0.34 0.00 0.00 178.44 178.75 1umf h ALA 340 N 1.37 0.69 -0.28 1.25 0.00 -0.73 -0.11 119.26 121.45 1umf h ALA 340 Ca 0.20 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1umf h ALA 340 Cb 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1umf h ALA 340 CO -0.02 0.46 0.01 -0.07 0.00 0.00 0.00 179.25 179.64 1umf h LEU 341 N 0.75 0.47 -0.20 0.00 3.38 -0.82 -0.52 115.31 118.37 1umf h LEU 341 Ca 0.15 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1umf h LEU 341 Cb 0.45 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1umf h LEU 341 CO 0.02 0.65 0.10 0.58 0.09 0.00 0.00 178.44 179.87 1umf h VAL 342 N 0.27 1.13 -0.72 1.22 2.07 -1.12 -1.36 116.25 117.74 1umf h VAL 342 Ca 0.08 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1umf h VAL 342 Cb 0.40 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1umf h VAL 342 CO 0.01 0.13 0.33 0.25 0.02 0.00 0.00 177.57 178.31 1umf h LEU 343 N 0.20 0.96 -0.80 2.57 5.85 -0.98 -1.38 115.31 121.73 1umf h LEU 343 Ca 0.07 -0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 1umf h LEU 343 Cb 0.12 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1umf h LEU 343 CO -0.01 0.83 -0.10 0.00 -0.34 0.00 0.00 178.44 178.82 1umf h ALA 344 N 1.16 0.99 -0.26 1.25 0.00 -0.95 -0.31 119.26 121.13 1umf h ALA 344 Ca 0.25 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1umf h ALA 344 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1umf h ALA 344 CO -0.03 0.60 0.16 0.22 0.00 0.00 0.00 179.25 180.21 1umf h ASP 345 N 0.72 0.28 -0.41 0.00 -0.00 -0.79 -2.19 116.42 114.04 1umf h ASP 345 Ca 0.12 -0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 57.11 1umf h ASP 345 Cb 0.59 -0.07 -0.02 0.00 -0.00 0.00 0.00 39.33 39.83 1umf h ASP 345 CO 0.04 0.20 0.14 0.24 -0.00 0.00 0.00 179.24 179.86 1umf h MET 346 N 0.34 0.69 -0.79 0.28 2.86 -0.87 -0.52 114.93 116.92 1umf h MET 346 Ca 0.10 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1umf h MET 346 Cb -0.03 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.48 1umf h MET 346 CO -0.03 0.61 0.45 0.28 1.06 0.00 0.00 176.91 179.27 1umf h VAL 347 N 0.68 1.23 -0.09 -2.22 2.07 -0.55 -1.29 116.25 116.07 1umf h VAL 347 Ca 0.16 -0.55 -0.10 0.00 0.82 0.00 0.00 66.70 67.03 1umf h VAL 347 Cb 0.21 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1umf h VAL 347 CO -0.01 0.25 -0.34 -0.07 0.02 0.00 0.00 177.57 177.42 1umf h LEU 348 N 1.10 0.47 -1.61 2.57 3.38 -0.79 -3.27 115.31 117.16 1umf h LEU 348 Ca 0.28 -0.62 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1umf h LEU 348 Cb 0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1umf h LEU 348 CO -0.05 1.01 -0.21 -0.07 0.09 0.00 0.00 178.44 179.21 1umf h LEU 349 N -0.05 0.00 -1.21 1.67 3.38 -0.90 -2.73 115.31 115.46 1umf h LEU 349 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1umf h LEU 349 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1umf h LEU 349 CO 0.07 0.21 0.00 -1.13 0.09 0.00 0.00 178.44 177.68 1umf h ASN 350 N 0.00 0.00 0.07 -0.43 -1.24 -1.28 -3.18 115.58 109.52 1umf h ASN 350 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1umf h ASN 350 Cb 0.41 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.46 1umf h ASN 350 CO 0.03 0.00 0.00 -0.07 -1.29 0.00 0.00 177.43 176.10 1umf h LEU 351 N 0.00 0.00 -1.50 0.34 3.38 -1.59 -1.47 115.31 114.47 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 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1umf h LEU 351 CO 0.00 0.00 -0.03 0.35 0.09 0.00 0.00 178.44 178.85 1umf n THR 352 N -2.46 0.00 -0.19 0.22 -2.24 -1.20 -4.62 114.28 103.79 1umf n THR 352 Ca -0.02 -0.39 -0.04 0.00 -2.27 0.00 0.00 64.05 61.34 1umf n THR 352 Cb 0.06 1.10 0.06 0.00 -2.10 0.00 0.00 70.33 69.45 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 3.65 0.49 -4.19 3.42 0.02 -1.50 -3.44 113.55 112.00 1umf h SER 353 Ca 0.00 0.02 -0.67 0.00 -0.84 0.00 0.00 61.79 60.30 1umf h SER 353 Cb 0.79 -0.08 -0.25 0.00 0.14 0.00 0.00 62.40 63.00 1umf h SER 353 CO 0.00 0.34 -0.87 -0.54 -1.14 0.00 0.00 176.83 174.62 1umf s LYS 354 N -6.12 1.59 0.36 3.45 1.02 -1.26 -5.03 119.74 113.75 1umf s LYS 354 Ca -0.13 -1.15 0.04 0.00 0.02 0.00 0.00 55.97 54.75 1umf s LYS 354 Cb 0.14 -1.84 0.69 0.00 -0.52 0.00 0.00 37.83 36.30 1umf s LYS 354 CO 0.75 0.46 2.01 0.97 -0.92 0.00 0.00 175.35 178.62 1umf h ILE 355 N 4.15 1.15 -0.16 2.17 6.09 -1.96 -1.75 117.51 127.20 1umf h ILE 355 Ca -0.47 -0.32 0.05 0.00 -1.37 0.00 0.00 64.86 62.75 1umf h ILE 355 Cb 1.15 0.37 -0.01 0.00 0.47 0.00 0.00 36.82 38.81 1umf h ILE 355 CO 0.42 0.15 0.15 1.05 -3.07 0.00 0.00 178.15 176.85 1umf h GLU 356 N 0.75 0.00 -0.39 2.19 4.11 -1.99 -0.50 114.58 118.75 1umf h GLU 356 Ca 0.20 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.51 1umf h GLU 356 Cb -0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1umf h GLU 356 CO -0.04 0.00 -0.23 1.88 0.07 0.00 0.00 179.01 180.69 1umf h TYR 357 N 0.00 0.90 -0.19 2.06 0.99 -1.64 -1.19 116.97 117.90 1umf h TYR 357 Ca 0.08 -0.21 -0.13 0.00 2.00 0.00 0.00 58.73 60.47 1umf h TYR 357 Cb 0.37 -0.21 0.00 0.00 1.00 0.00 0.00 36.73 37.89 1umf h TYR 357 CO 0.00 0.94 -0.38 -0.07 -0.00 0.00 0.00 178.16 178.66 1umf h LEU 358 N 0.69 0.66 -0.75 3.88 4.07 -1.21 -2.64 115.31 120.01 1umf h LEU 358 Ca 0.09 -0.55 -0.04 0.00 0.08 0.00 0.00 57.88 57.47 1umf h LEU 358 Cb 0.75 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 42.27 1umf h LEU 358 CO 0.06 1.09 0.33 0.11 -1.08 0.00 0.00 178.44 178.95 1umf h LYS 359 N 0.26 1.10 -0.26 1.13 1.57 -1.27 -0.17 116.57 118.94 1umf h LYS 359 Ca 0.01 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1umf h LYS 359 Cb 0.98 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1umf h LYS 359 CO 0.08 0.88 0.12 1.15 -0.57 0.00 0.00 179.45 181.12 1umf h THR 360 N 1.07 1.15 -0.08 -0.16 2.02 -1.21 -0.64 112.91 115.06 1umf h THR 360 Ca 0.25 -0.43 -0.20 0.00 0.77 0.00 0.00 66.41 66.80 1umf h THR 360 Cb 0.17 0.96 0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1umf h THR 360 CO -0.03 0.15 -0.74 0.40 0.37 0.00 0.00 175.52 175.67 1umf h ILE 361 N 0.28 1.32 0.05 3.11 2.04 -1.33 -0.97 117.51 122.02 1umf h ILE 361 Ca 0.09 -2.01 -0.21 0.00 1.00 0.00 0.00 64.86 63.72 1umf h ILE 361 Cb 0.13 2.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 1umf h ILE 361 CO -0.01 0.62 -1.11 1.88 0.00 0.00 0.00 178.15 179.53 1umf h TYR 362 N 0.29 0.20 -0.08 1.37 0.05 -1.07 -2.22 116.97 115.51 1umf h TYR 362 Ca -0.07 -0.15 0.00 0.00 0.05 0.00 0.00 58.73 58.56 1umf h TYR 362 Cb 1.39 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.13 1umf h TYR 362 CO 0.11 1.43 0.00 0.09 -1.05 0.00 0.00 178.16 178.74 1umf n ASN 363 N -4.22 0.77 0.00 3.88 3.02 -0.25 -4.48 115.26 113.98 1umf n ASN 363 Ca -0.25 -1.59 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 1umf n ASN 363 Cb 0.75 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1umf n ASN 363 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1umf n GLU 364 N -0.26 0.00 0.00 3.52 1.02 -1.19 -5.00 120.64 118.74 1umf n GLU 364 Ca 0.14 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.38 1umf n GLU 364 Cb 0.18 -0.21 0.08 0.00 -0.02 0.00 0.00 31.44 31.47 1umf n GLU 364 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60