#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j6o s HIS -3 N 0.00 2.74 -1.22 4.41 4.02 -1.26 -4.98 115.29 119.00 1j6o s HIS -3 Ca 0.00 1.47 -0.11 0.00 1.02 0.00 0.00 55.06 57.43 1j6o s HIS -3 Cb 0.00 -3.56 0.19 0.00 -1.02 0.00 0.00 32.58 28.19 1j6o s HIS -3 CO 0.00 -1.97 1.53 0.72 1.02 0.00 0.00 174.74 176.04 1j6o n HIS -2 N -0.41 4.29 -2.62 1.40 -0.00 -1.26 -4.79 115.22 111.83 1j6o n HIS -2 Ca 0.07 -3.21 -0.03 0.00 -0.00 0.00 0.00 57.72 54.55 1j6o n HIS -2 Cb 0.46 -2.03 0.01 0.00 -0.00 0.00 0.00 29.99 28.44 1j6o n HIS -2 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1j6o n HIS -1 N 4.62 -3.13 -3.64 4.41 -0.00 -1.26 -4.89 115.22 111.32 1j6o n HIS -1 Ca 0.36 -0.25 -0.04 0.00 -0.00 0.00 0.00 57.72 57.79 1j6o n HIS -1 Cb 0.40 -0.08 -0.07 0.00 -0.00 0.00 0.00 29.99 30.24 1j6o n HIS -1 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1j6o s VAL 1 N 0.15 0.00 -0.45 1.59 1.01 -1.26 -4.52 120.40 116.92 1j6o s VAL 1 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.89 1j6o s VAL 1 Cb -0.01 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.42 1j6o s VAL 1 CO 0.05 0.00 0.45 -0.62 0.00 0.00 0.00 175.10 174.98 1j6o s ASP 2 N 1.35 6.18 0.00 3.32 -1.08 -0.98 -4.30 116.67 121.17 1j6o s ASP 2 Ca -0.08 -0.91 0.16 0.00 -0.52 0.00 0.00 52.55 51.20 1j6o s ASP 2 Cb -0.04 -2.22 0.75 0.00 -1.46 0.00 0.00 42.92 39.94 1j6o s ASP 2 CO -0.16 -0.64 1.51 0.35 0.52 0.00 0.00 175.17 176.75 1j6o n THR 3 N 5.38 0.13 -3.27 1.71 -2.24 -0.58 -0.50 114.28 114.91 1j6o n THR 3 Ca -0.09 -0.18 -0.06 0.00 -2.27 0.00 0.00 64.05 61.45 1j6o n THR 3 Cb 0.46 0.05 -0.04 0.00 -2.10 0.00 0.00 70.33 68.70 1j6o n THR 3 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1j6o s HIS 4 N -1.87 -1.18 0.23 4.78 5.65 -1.23 -4.56 115.29 117.11 1j6o s HIS 4 Ca 0.25 -0.09 0.09 0.00 0.25 0.00 0.00 55.06 55.56 1j6o s HIS 4 Cb 0.13 0.03 -0.05 0.00 -1.18 0.00 0.00 32.58 31.51 1j6o s HIS 4 CO 0.20 -1.09 -0.16 0.00 -0.65 0.00 0.00 174.74 173.04 1j6o s ALA 5 N 1.78 2.22 -0.42 1.58 0.00 -0.39 0.27 121.76 126.79 1j6o s ALA 5 Ca 0.16 -1.72 0.10 0.00 0.00 0.00 0.00 51.96 50.49 1j6o s ALA 5 Cb -0.09 -0.13 0.32 0.00 0.00 0.00 0.00 23.12 23.22 1j6o s ALA 5 CO -0.08 0.13 0.72 0.72 0.00 0.00 0.00 175.76 177.25 1j6o n HIS 6 N -0.45 0.91 0.31 0.00 8.25 -0.37 -0.50 115.22 123.38 1j6o n HIS 6 Ca -0.07 -3.81 0.15 0.00 -0.26 0.00 0.00 57.72 53.73 1j6o n HIS 6 Cb 0.60 -0.43 0.69 0.00 1.12 0.00 0.00 29.99 31.98 1j6o n HIS 6 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1j6o h LEU 7 N 3.28 0.00 -0.38 2.41 3.38 -1.93 -2.12 115.31 119.96 1j6o h LEU 7 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1j6o h LEU 7 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1j6o h LEU 7 CO 0.56 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 179.01 1j6o n HIS 8 N -2.63 0.00 -1.62 1.13 1.44 -1.26 -4.66 115.22 107.62 1j6o n HIS 8 Ca 0.00 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.38 1j6o n HIS 8 Cb 0.19 -0.11 0.06 0.00 0.12 0.00 0.00 29.99 30.25 1j6o n HIS 8 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1j6o s PHE 9 N -2.31 2.52 0.65 -1.40 0.40 -0.80 -4.91 117.98 112.14 1j6o s PHE 9 Ca 0.33 1.56 0.40 0.00 -0.60 0.00 0.00 56.93 58.62 1j6o s PHE 9 Cb 0.20 -3.19 2.22 0.00 0.51 0.00 0.00 43.02 42.77 1j6o s PHE 9 CO 0.44 -1.84 2.30 1.12 0.70 0.00 0.00 175.22 177.94 1j6o h HIS 10 N -0.22 0.00 0.00 0.36 2.07 -1.90 -2.11 115.15 113.35 1j6o h HIS 10 Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 1j6o h HIS 10 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1j6o h HIS 10 CO 0.54 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 176.44 1j6o n GLN 11 N -3.24 0.06 -0.17 5.12 3.00 -1.26 -1.50 117.38 119.39 1j6o n GLN 11 Ca -0.03 0.42 0.06 0.00 -0.01 0.00 0.00 57.00 57.44 1j6o n GLN 11 Cb 0.11 -1.65 0.15 0.00 0.00 0.00 0.00 30.24 28.86 1j6o n GLN 11 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1j6o n PHE 12 N -1.77 0.46 -0.14 1.08 3.72 -0.79 -4.69 117.46 115.32 1j6o n PHE 12 Ca 0.01 -0.47 0.10 0.00 -0.05 0.00 0.00 57.45 57.04 1j6o n PHE 12 Cb 0.11 -0.02 0.43 0.00 -0.94 0.00 0.00 39.48 39.06 1j6o n PHE 12 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1j6o h ASP 13 N 2.14 0.51 1.35 4.37 3.32 -1.39 -1.19 116.42 125.52 1j6o h ASP 13 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1j6o h ASP 13 Cb 0.73 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1j6o h ASP 13 CO 0.00 0.31 -0.49 0.44 -1.72 0.00 0.00 179.24 177.78 1j6o h ASP 14 N 0.56 0.00 0.00 6.45 3.32 -1.83 -3.41 116.42 121.51 1j6o h ASP 14 Ca 0.31 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.28 1j6o h ASP 14 Cb 0.46 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.93 1j6o h ASP 14 CO -0.10 0.02 -0.54 -0.90 -1.72 0.00 0.00 179.24 176.00 1j6o n ASP 15 N -2.65 0.16 -0.21 6.45 5.75 -1.12 -4.91 116.55 120.01 1j6o n ASP 15 Ca 0.03 -1.88 0.01 0.00 -0.01 0.00 0.00 54.79 52.94 1j6o n ASP 15 Cb 0.51 -0.18 0.12 0.00 -1.03 0.00 0.00 41.12 40.54 1j6o n ASP 15 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1j6o h ARG 16 N 0.20 0.40 -0.53 0.11 2.43 -1.45 -0.66 114.38 114.88 1j6o h ARG 16 Ca -0.07 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.11 1j6o h ARG 16 Cb 1.45 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.87 1j6o h ARG 16 CO 0.01 0.26 0.30 -0.91 -1.51 0.00 0.00 179.97 178.12 1j6o h ASN 17 N 0.41 0.47 -0.65 -3.80 2.35 -1.91 -0.57 115.58 111.89 1j6o h ASN 17 Ca 0.33 0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 56.00 1j6o h ASN 17 Cb 0.42 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1j6o h ASN 17 CO -0.33 0.33 0.07 0.00 -1.65 0.00 0.00 177.43 175.85 1j6o h ALA 18 N 1.25 0.86 -0.34 -0.83 0.00 -1.74 0.87 119.26 119.33 1j6o h ALA 18 Ca 0.22 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1j6o h ALA 18 Cb 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1j6o h ALA 18 CO -0.12 0.66 0.12 0.28 0.00 0.00 0.00 179.25 180.19 1j6o h VAL 19 N 1.01 1.20 -0.16 0.00 2.07 -0.83 -1.87 116.25 117.67 1j6o h VAL 19 Ca 0.19 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 66.97 1j6o h VAL 19 Cb 0.48 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1j6o h VAL 19 CO 0.02 0.22 -0.27 0.40 0.02 0.00 0.00 177.57 177.96 1j6o h ILE 20 N 0.41 1.35 0.00 4.57 2.04 -0.99 -2.87 117.51 122.01 1j6o h ILE 20 Ca 0.11 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1j6o h ILE 20 Cb 0.23 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1j6o h ILE 20 CO -0.01 0.45 0.00 0.77 0.00 0.00 0.00 178.15 179.37 1j6o h SER 21 N 0.11 0.00 -0.57 1.72 4.64 -0.78 -2.05 113.55 116.62 1j6o h SER 21 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1j6o h SER 21 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1j6o h SER 21 CO 0.06 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.48 1j6o n SER 22 N -2.37 3.32 -0.13 4.97 3.41 -0.71 -4.44 113.62 117.68 1j6o n SER 22 Ca 0.00 -1.98 -0.05 0.00 -0.26 0.00 0.00 58.87 56.58 1j6o n SER 22 Cb 0.15 -0.38 0.04 0.00 -0.26 0.00 0.00 64.21 63.76 1j6o n SER 22 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1j6o h PHE 23 N 3.77 0.19 0.02 7.33 0.04 -1.39 -1.59 116.94 125.31 1j6o h PHE 23 Ca 0.00 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.81 1j6o h PHE 23 Cb 0.85 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.97 1j6o h PHE 23 CO 0.38 0.05 -0.09 1.49 -0.60 0.00 0.00 178.31 179.54 1j6o h GLU 24 N 0.25 -0.15 -0.17 1.51 4.81 -1.78 -0.79 114.58 118.26 1j6o h GLU 24 Ca 0.20 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.49 1j6o h GLU 24 Cb 0.22 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1j6o h GLU 24 CO -0.24 -0.10 0.14 0.93 -0.73 0.00 0.00 179.01 179.01 1j6o h GLU 25 N -0.16 0.00 -0.61 1.92 5.08 -1.78 -0.76 114.58 118.27 1j6o h GLU 25 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1j6o h GLU 25 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1j6o h GLU 25 CO -0.07 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.03 1j6o n ASN 26 N -4.23 3.60 -1.85 1.42 3.02 -0.52 -4.94 115.26 111.76 1j6o n ASN 26 Ca 0.01 -2.20 -0.17 0.00 -0.03 0.00 0.00 54.58 52.19 1j6o n ASN 26 Cb 0.26 -0.46 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 1j6o n ASN 26 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1j6o n ASN 27 N 1.03 -5.00 -4.49 6.41 5.03 -0.29 -4.92 115.26 113.03 1j6o n ASN 27 Ca 0.20 0.04 -0.43 0.00 0.87 0.00 0.00 54.58 55.26 1j6o n ASN 27 Cb 0.64 -4.09 -0.09 0.00 -1.02 0.00 0.00 39.78 35.22 1j6o n ASN 27 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1j6o s ILE 28 N -2.82 5.08 0.10 2.41 -1.09 -0.42 -4.52 121.20 119.95 1j6o s ILE 28 Ca 0.00 -0.33 -0.16 0.00 -2.23 0.00 0.00 60.65 57.93 1j6o s ILE 28 Cb 0.00 -4.04 -0.06 0.00 -1.58 0.00 0.00 42.46 36.79 1j6o s ILE 28 CO 0.00 -0.42 1.51 -0.08 -1.23 0.00 0.00 174.94 174.72 1j6o h GLU 29 N 8.72 0.63 -2.25 2.79 4.81 -1.91 -3.38 114.58 124.00 1j6o h GLU 29 Ca -0.26 -0.24 0.17 0.00 -0.13 0.00 0.00 59.36 58.89 1j6o h GLU 29 Cb 1.11 -0.04 -0.11 0.00 0.63 0.00 0.00 28.75 30.34 1j6o h GLU 29 CO 0.79 0.80 0.52 -0.59 -0.73 0.00 0.00 179.01 179.80 1j6o s PHE 30 N -4.79 -0.20 0.06 0.92 -0.71 -1.26 -4.80 117.98 107.20 1j6o s PHE 30 Ca -0.13 -0.03 0.02 0.00 -1.04 0.00 0.00 56.93 55.75 1j6o s PHE 30 Cb 0.09 0.60 -0.03 0.00 -1.21 0.00 0.00 43.02 42.46 1j6o s PHE 30 CO 0.79 -0.68 -0.07 0.14 -1.34 0.00 0.00 175.22 174.06 1j6o s VAL 31 N -3.16 0.58 -0.33 -2.49 -7.23 0.71 -2.31 120.40 106.18 1j6o s VAL 31 Ca 0.10 -1.44 -0.07 0.00 -1.81 0.00 0.00 61.98 58.76 1j6o s VAL 31 Cb -0.01 -1.05 0.03 0.00 0.56 0.00 0.00 36.38 35.91 1j6o s VAL 31 CO -0.02 -0.60 0.11 -0.69 -0.31 0.00 0.00 175.10 173.59 1j6o s VAL 32 N -2.34 3.89 -0.23 1.32 1.01 0.35 -1.41 120.40 122.98 1j6o s VAL 32 Ca -0.01 -1.03 -0.19 0.00 0.00 0.00 0.00 61.98 60.75 1j6o s VAL 32 Cb -0.03 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1j6o s VAL 32 CO -0.02 -0.14 0.56 0.21 0.00 0.00 0.00 175.10 175.72 1j6o s ASN 33 N 1.43 6.55 -0.17 3.32 2.47 0.67 -1.26 114.94 127.97 1j6o s ASN 33 Ca -0.01 0.67 -0.08 0.00 0.42 0.00 0.00 52.86 53.87 1j6o s ASN 33 Cb -0.19 -2.31 -0.04 0.00 -1.45 0.00 0.00 41.25 37.26 1j6o s ASN 33 CO 0.03 -0.27 0.10 -0.69 -3.72 0.00 0.00 177.10 172.55 1j6o s VAL 34 N 2.07 5.11 0.36 -5.21 1.01 0.35 -1.25 120.40 122.83 1j6o s VAL 34 Ca 0.25 0.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.25 1j6o s VAL 34 Cb -0.16 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1j6o s VAL 34 CO 0.09 0.49 0.64 -0.83 0.00 0.00 0.00 175.10 175.50 1j6o s GLY 35 N 0.00 1.69 0.00 4.51 0.00 -0.33 -4.72 107.32 108.47 1j6o s GLY 35 Ca 0.08 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.26 1j6o s GLY 35 CO 0.00 -0.43 0.47 3.33 0.00 0.00 0.00 173.10 176.47 1j6o n VAL 36 N -1.46 0.00 -3.90 1.40 0.24 -1.25 -1.93 118.33 111.43 1j6o n VAL 36 Ca -0.01 -0.49 -0.03 0.00 -2.04 0.00 0.00 64.34 61.77 1j6o n VAL 36 Cb 0.55 1.03 0.02 0.00 -1.47 0.00 0.00 33.84 33.97 1j6o n VAL 36 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1j6o s ASN 37 N -0.33 0.01 0.10 -1.34 2.20 -0.53 -0.64 114.94 114.41 1j6o s ASN 37 Ca 0.02 -0.65 -0.22 0.00 -0.94 0.00 0.00 52.86 51.07 1j6o s ASN 37 Cb 0.01 0.48 -0.11 0.00 -2.00 0.00 0.00 41.25 39.63 1j6o s ASN 37 CO 0.03 -0.95 1.74 -0.07 -2.94 0.00 0.00 177.10 174.91 1j6o h LEU 38 N 2.00 -0.02 -0.49 3.54 4.07 -1.99 0.19 115.31 122.62 1j6o h LEU 38 Ca -0.27 0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.64 1j6o h LEU 38 Cb 1.21 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.96 1j6o h LEU 38 CO 0.36 0.00 0.08 -0.33 -1.08 0.00 0.00 178.44 177.47 1j6o h GLU 39 N 0.03 0.81 -0.32 1.13 3.07 -1.97 -2.29 114.58 115.03 1j6o h GLU 39 Ca 0.03 -0.22 -0.10 0.00 -0.50 0.00 0.00 59.36 58.57 1j6o h GLU 39 Cb 0.03 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 1j6o h GLU 39 CO -0.05 0.81 -0.24 0.22 -1.40 0.00 0.00 179.01 178.35 1j6o h ASP 40 N 0.68 0.62 -0.27 1.42 3.58 -1.93 -2.65 116.42 117.87 1j6o h ASP 40 Ca 0.15 -0.22 -0.08 0.00 0.42 0.00 0.00 57.03 57.31 1j6o h ASP 40 Cb 0.39 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 1j6o h ASP 40 CO 0.01 0.85 -0.08 0.28 -2.88 0.00 0.00 179.24 177.42 1j6o h SER 41 N 0.54 0.63 -0.70 2.28 0.02 -0.46 -0.64 113.55 115.21 1j6o h SER 41 Ca 0.08 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.81 1j6o h SER 41 Cb 0.70 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 1j6o h SER 41 CO 0.05 0.75 0.23 0.50 -1.14 0.00 0.00 176.83 177.22 1j6o h LYS 42 N 0.60 1.09 -0.53 3.45 3.11 -1.14 0.34 116.57 123.49 1j6o h LYS 42 Ca 0.11 -0.23 -0.10 0.00 -2.81 0.00 0.00 60.65 57.62 1j6o h LYS 42 Cb 0.49 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.54 1j6o h LYS 42 CO 0.03 0.94 -0.05 0.87 -2.81 0.00 0.00 179.45 178.42 1j6o h LYS 43 N 1.03 0.95 -0.25 1.90 1.57 -1.09 -0.83 116.57 119.85 1j6o h LYS 43 Ca 0.23 -0.31 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1j6o h LYS 43 Cb 0.29 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1j6o h LYS 43 CO -0.01 0.97 0.09 1.03 -0.57 0.00 0.00 179.45 180.96 1j6o h SER 44 N 0.86 0.36 -0.57 0.86 0.87 -0.78 -1.11 113.55 114.04 1j6o h SER 44 Ca 0.15 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1j6o h SER 44 Cb 0.58 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 1j6o h SER 44 CO 0.03 0.44 0.32 0.25 -0.53 0.00 0.00 176.83 177.34 1j6o h LEU 45 N 0.25 0.72 -1.08 2.23 5.85 -0.65 -0.54 115.31 122.08 1j6o h LEU 45 Ca 0.08 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1j6o h LEU 45 Cb 0.20 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1j6o h LEU 45 CO -0.01 0.60 0.45 0.44 -0.34 0.00 0.00 178.44 179.59 1j6o h ASP 46 N 0.78 0.97 -0.32 1.25 3.32 -1.00 -1.89 116.42 119.53 1j6o h ASP 46 Ca 0.20 -0.07 -0.17 0.00 0.02 0.00 0.00 57.03 57.02 1j6o h ASP 46 Cb 0.04 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 1j6o h ASP 46 CO -0.03 0.76 -0.45 0.25 -1.72 0.00 0.00 179.24 178.05 1j6o h LEU 47 N 1.10 0.95 -1.79 1.55 5.85 -0.71 -2.96 115.31 119.30 1j6o h LEU 47 Ca 0.28 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1j6o h LEU 47 Cb -0.01 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1j6o h LEU 47 CO -0.05 1.27 0.13 0.77 -0.34 0.00 0.00 178.44 180.22 1j6o h SER 48 N 0.65 0.24 0.40 1.25 4.64 -0.67 -0.33 113.55 119.73 1j6o h SER 48 Ca 0.03 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1j6o h SER 48 Cb 1.05 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1j6o h SER 48 CO 0.11 0.18 0.00 0.29 -0.87 0.00 0.00 176.83 176.53 1j6o n LYS 49 N -4.50 0.06 0.00 4.77 5.02 -0.75 -2.64 118.16 120.12 1j6o n LYS 49 Ca 0.00 0.24 0.12 0.00 -2.02 0.00 0.00 58.31 56.65 1j6o n LYS 49 Cb 0.08 -1.50 0.21 0.00 -0.02 0.00 0.00 35.03 33.80 1j6o n LYS 49 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1j6o n THR 50 N -1.44 0.00 -3.81 -0.18 -2.24 -0.13 -4.91 114.28 101.57 1j6o n THR 50 Ca 0.04 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1j6o n THR 50 Cb 0.14 0.81 -0.13 0.00 -2.10 0.00 0.00 70.33 69.05 1j6o n THR 50 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1j6o s SER 51 N -2.45 -0.11 0.37 3.42 0.15 -1.08 -5.00 113.70 109.00 1j6o s SER 51 Ca 0.23 0.25 0.28 0.00 0.70 0.00 0.00 55.95 57.40 1j6o s SER 51 Cb 0.19 0.22 1.20 0.00 -1.71 0.00 0.00 66.02 65.91 1j6o s SER 51 CO 0.52 -0.07 1.82 0.44 1.20 0.00 0.00 173.24 177.15 1j6o h ASP 52 N 6.36 0.00 -0.29 5.45 3.32 -1.91 -2.81 116.42 126.54 1j6o h ASP 52 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1j6o h ASP 52 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1j6o h ASP 52 CO 0.43 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.49 1j6o n ARG 53 N -2.53 2.25 -4.88 3.56 1.74 -1.26 -4.89 116.66 110.65 1j6o n ARG 53 Ca 0.01 -1.89 -0.33 0.00 -0.77 0.00 0.00 57.85 54.88 1j6o n ARG 53 Cb 0.22 -1.47 -0.16 0.00 -1.02 0.00 0.00 32.46 30.03 1j6o n ARG 53 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j6o s ILE 54 N -1.64 2.45 0.36 0.55 1.01 -1.06 -0.20 121.20 122.67 1j6o s ILE 54 Ca 0.36 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 60.23 1j6o s ILE 54 Cb 0.21 -1.99 -0.06 0.00 0.01 0.00 0.00 42.46 40.63 1j6o s ILE 54 CO 0.30 0.54 0.04 -0.36 0.00 0.00 0.00 174.94 175.46 1j6o s PHE 55 N 0.51 2.55 0.12 3.97 0.40 -0.50 -4.72 117.98 120.30 1j6o s PHE 55 Ca -0.12 -0.50 0.09 0.00 -0.60 0.00 0.00 56.93 55.79 1j6o s PHE 55 Cb -0.17 -1.62 -0.04 0.00 0.51 0.00 0.00 43.02 41.71 1j6o s PHE 55 CO 0.05 0.42 -0.22 0.00 0.70 0.00 0.00 175.22 176.17 1j6o s SER 57 N -2.07 2.07 0.01 0.00 0.15 -0.38 -0.25 113.70 113.22 1j6o s SER 57 Ca 0.10 -0.35 0.08 0.00 0.70 0.00 0.00 55.95 56.48 1j6o s SER 57 Cb -0.09 -0.77 -0.03 0.00 -1.71 0.00 0.00 66.02 63.42 1j6o s SER 57 CO 0.05 0.10 -0.23 0.68 1.20 0.00 0.00 173.24 175.04 1j6o s VAL 58 N 0.33 2.32 -1.22 4.45 -7.23 -1.03 -1.19 120.40 116.83 1j6o s VAL 58 Ca -0.10 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 58.90 1j6o s VAL 58 Cb -0.14 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 34.92 1j6o s VAL 58 CO 0.04 0.47 0.00 0.61 -0.31 0.00 0.00 175.10 175.91 1j6o n GLY 59 N 2.06 -1.41 2.96 2.32 0.00 -1.05 -0.32 105.19 109.75 1j6o n GLY 59 Ca -0.16 -1.00 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 1j6o n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j6o s VAL 60 N -2.48 1.27 0.58 1.61 1.01 -1.08 -1.45 120.40 119.87 1j6o s VAL 60 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 1j6o s VAL 60 Cb 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1j6o s VAL 60 CO 0.00 0.41 1.19 -2.28 0.00 0.00 0.00 175.10 174.42 1j6o s HIS 61 N 1.61 2.44 0.52 5.22 2.46 0.19 -4.31 115.29 123.41 1j6o s HIS 61 Ca 0.05 1.52 0.19 0.00 0.47 0.00 0.00 55.06 57.29 1j6o s HIS 61 Cb -0.13 -3.45 1.29 0.00 -0.13 0.00 0.00 32.58 30.17 1j6o s HIS 61 CO -0.09 -2.09 2.08 -1.00 -2.47 0.00 0.00 174.74 171.17 1j6o h PRO 62 N 0.94 0.04 -0.63 2.88 0.13 -1.84 -0.63 132.00 132.88 1j6o h PRO 62 Ca -0.50 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1j6o h PRO 62 Cb 1.29 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.38 1j6o h PRO 62 CO 0.55 0.02 0.39 0.45 -0.23 0.00 0.00 178.00 179.19 1j6o h HIS 63 N 0.04 0.82 -0.27 1.56 3.86 -1.94 -1.39 115.15 117.82 1j6o h HIS 63 Ca 0.11 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1j6o h HIS 63 Cb 0.39 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1j6o h HIS 63 CO -0.00 0.53 0.00 -0.25 0.86 0.00 0.00 177.93 179.07 1j6o n ASP 64 N -4.42 1.59 -0.20 2.45 9.92 -0.26 -4.21 116.55 121.43 1j6o n ASP 64 Ca 0.06 -1.93 0.03 0.00 -0.53 0.00 0.00 54.79 52.42 1j6o n ASP 64 Cb 0.06 -0.18 0.30 0.00 -0.64 0.00 0.00 41.12 40.66 1j6o n ASP 64 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1j6o h ALA 65 N 3.65 1.57 0.00 2.24 0.00 -1.05 -1.88 119.26 123.79 1j6o h ALA 65 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1j6o h ALA 65 Cb 0.41 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1j6o h ALA 65 CO 0.00 0.35 0.00 0.36 0.00 0.00 0.00 179.25 179.96 1j6o n LYS 66 N -4.45 0.07 0.00 0.00 2.85 -1.26 -3.28 118.16 112.08 1j6o n LYS 66 Ca 0.09 0.11 0.11 0.00 -1.05 0.00 0.00 58.31 57.58 1j6o n LYS 66 Cb 0.12 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.06 1j6o n LYS 66 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1j6o n GLU 67 N -1.46 1.00 -2.04 -1.58 -0.58 -0.71 -5.01 120.64 110.28 1j6o n GLU 67 Ca 0.06 -0.79 -0.41 0.00 -0.42 0.00 0.00 57.16 55.60 1j6o n GLU 67 Cb 0.24 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.61 1j6o n GLU 67 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1j6o s VAL 68 N -2.54 2.62 0.74 2.62 -7.23 -1.20 -5.00 120.40 110.40 1j6o s VAL 68 Ca 0.18 0.58 -0.11 0.00 -1.81 0.00 0.00 61.98 60.82 1j6o s VAL 68 Cb 0.18 -3.37 0.03 0.00 0.56 0.00 0.00 36.38 33.79 1j6o s VAL 68 CO 0.59 0.12 1.07 -2.84 -0.31 0.00 0.00 175.10 173.74 1j6o s PRO 69 N -1.18 2.59 0.49 4.82 0.02 -1.26 -4.94 135.00 135.54 1j6o s PRO 69 Ca 0.54 0.85 0.15 0.00 0.02 0.00 0.00 61.00 62.56 1j6o s PRO 69 Cb -0.41 -1.96 1.17 0.00 0.02 0.00 0.00 34.50 33.31 1j6o s PRO 69 CO 0.50 -1.32 2.08 1.05 -0.33 0.00 0.00 177.00 178.98 1j6o h GLU 70 N -0.87 0.18 -0.74 5.54 9.09 -2.03 -2.17 114.58 123.57 1j6o h GLU 70 Ca -0.45 -0.01 -0.25 0.00 0.05 0.00 0.00 59.36 58.70 1j6o h GLU 70 Cb 1.23 -0.04 -0.15 0.00 -1.65 0.00 0.00 28.75 28.14 1j6o h GLU 70 CO 0.57 0.12 0.30 -0.40 0.05 0.00 0.00 179.01 179.65 1j6o n ASP 71 N -4.49 4.48 -0.15 3.06 5.75 -1.26 -4.68 116.55 119.27 1j6o n ASP 71 Ca 0.02 -3.32 0.08 0.00 -0.01 0.00 0.00 54.79 51.57 1j6o n ASP 71 Cb 0.22 -0.75 0.40 0.00 -1.03 0.00 0.00 41.12 39.96 1j6o n ASP 71 CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 1j6o h PHE 72 N 2.26 0.66 -0.34 2.11 -0.00 -1.75 -1.64 116.94 118.23 1j6o h PHE 72 Ca 0.31 0.02 -0.14 0.00 -0.00 0.00 0.00 57.97 58.16 1j6o h PHE 72 Cb 2.35 -0.22 -0.01 0.00 -0.00 0.00 0.00 35.95 38.07 1j6o h PHE 72 CO 1.29 0.34 -0.34 0.82 -0.00 0.00 0.00 178.31 180.43 1j6o h ILE 73 N 0.65 1.28 -0.49 0.88 1.08 -1.86 -1.30 117.51 117.75 1j6o h ILE 73 Ca 0.30 -1.49 -0.08 0.00 -0.39 0.00 0.00 64.86 63.19 1j6o h ILE 73 Cb 0.33 1.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 1j6o h ILE 73 CO -0.10 0.49 -0.02 -0.33 -0.69 0.00 0.00 178.15 177.50 1j6o h GLU 74 N 0.64 0.83 -0.55 2.37 5.08 -1.74 0.01 114.58 121.23 1j6o h GLU 74 Ca 0.07 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 1j6o h GLU 74 Cb 0.88 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 1j6o h GLU 74 CO 0.08 0.85 -0.05 1.25 -1.00 0.00 0.00 179.01 180.14 1j6o h HIS 75 N 0.77 1.09 -0.34 4.33 2.76 -1.01 -0.76 115.15 122.00 1j6o h HIS 75 Ca 0.14 -0.20 -0.15 0.00 -2.20 0.00 0.00 60.37 57.96 1j6o h HIS 75 Cb 0.50 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1j6o h HIS 75 CO 0.03 0.99 -0.39 -0.07 -1.30 0.00 0.00 177.93 177.19 1j6o h LEU 76 N 0.90 0.86 -1.25 0.26 3.38 -0.88 -2.40 115.31 116.19 1j6o h LEU 76 Ca 0.15 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1j6o h LEU 76 Cb 0.59 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1j6o h LEU 76 CO 0.04 1.15 0.23 -0.08 0.09 0.00 0.00 178.44 179.86 1j6o h GLU 77 N 0.66 0.75 -0.47 1.13 4.81 -0.76 -0.42 114.58 120.29 1j6o h GLU 77 Ca 0.06 -0.10 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 1j6o h GLU 77 Cb 0.95 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1j6o h GLU 77 CO 0.09 0.60 -0.13 -0.22 -0.73 0.00 0.00 179.01 178.62 1j6o h LYS 78 N 0.75 0.89 -0.34 1.92 3.64 -0.83 -2.81 116.57 119.78 1j6o h LYS 78 Ca 0.18 -0.32 -0.04 0.00 -1.27 0.00 0.00 60.65 59.21 1j6o h LYS 78 Cb 0.12 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1j6o h LYS 78 CO -0.02 0.96 0.07 0.74 -2.27 0.00 0.00 179.45 178.93 1j6o h PHE 79 N 0.79 0.58 0.00 1.91 0.04 -0.84 -2.63 116.94 116.78 1j6o h PHE 79 Ca 0.12 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1j6o h PHE 79 Cb 0.66 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1j6o h PHE 79 CO 0.04 0.60 0.00 0.00 -0.60 0.00 0.00 178.31 178.35 1j6o n ALA 80 N -2.34 1.26 0.17 2.45 0.00 -0.25 -1.05 120.51 120.76 1j6o n ALA 80 Ca -0.02 -0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.45 1j6o n ALA 80 Cb 0.21 -1.02 0.31 0.00 0.00 0.00 0.00 19.45 18.95 1j6o n ALA 80 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1j6o h LYS 81 N 0.00 0.00 -6.63 0.00 1.79 -1.35 -3.43 116.57 106.95 1j6o h LYS 81 Ca 0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 1j6o h LYS 81 Cb 0.01 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.70 1j6o h LYS 81 CO 0.00 0.44 0.75 0.34 -1.08 0.00 0.00 179.45 179.90 1j6o s ASP 82 N -6.68 6.76 0.58 0.86 -1.08 -0.21 -4.90 116.67 112.00 1j6o s ASP 82 Ca -0.01 2.47 0.39 0.00 -0.52 0.00 0.00 52.55 54.87 1j6o s ASP 82 Cb 0.12 -2.60 1.98 0.00 -1.46 0.00 0.00 42.92 40.96 1j6o s ASP 82 CO 0.72 -0.67 2.17 1.05 0.52 0.00 0.00 175.17 178.96 1j6o h GLU 83 N 6.12 0.00 0.00 4.34 9.09 -1.88 -1.88 114.58 130.37 1j6o h GLU 83 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.97 1j6o h GLU 83 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 1j6o h GLU 83 CO 0.84 0.00 0.00 0.87 0.05 0.00 0.00 179.01 180.77 1j6o h LYS 84 N 0.00 0.00 -6.07 1.06 1.79 -1.93 -3.42 116.57 107.99 1j6o h LYS 84 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 1j6o h LYS 84 Cb 0.14 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.71 1j6o h LYS 84 CO 0.00 0.00 0.67 0.08 -1.08 0.00 0.00 179.45 179.12 1j6o s VAL 85 N -3.45 4.64 -0.54 0.50 1.01 -0.71 -0.16 120.40 121.68 1j6o s VAL 85 Ca 0.03 1.59 0.05 0.00 0.00 0.00 0.00 61.98 63.65 1j6o s VAL 85 Cb 0.09 -4.30 0.08 0.00 0.00 0.00 0.00 36.38 32.25 1j6o s VAL 85 CO 0.50 -0.34 0.83 1.33 0.00 0.00 0.00 175.10 177.41 1j6o n VAL 86 N 5.65 0.38 -3.68 2.92 0.24 0.65 -4.93 118.33 119.57 1j6o n VAL 86 Ca 0.09 -0.69 -0.05 0.00 -2.04 0.00 0.00 64.34 61.65 1j6o n VAL 86 Cb 0.47 0.87 -0.02 0.00 -1.47 0.00 0.00 33.84 33.70 1j6o n VAL 86 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1j6o s ALA 87 N -0.64 -1.70 -0.16 2.33 0.00 -1.21 -4.15 121.76 116.23 1j6o s ALA 87 Ca 0.08 0.38 -0.00 0.00 0.00 0.00 0.00 51.96 52.41 1j6o s ALA 87 Cb 0.05 0.58 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 1j6o s ALA 87 CO 0.07 -0.94 -0.14 0.42 0.00 0.00 0.00 175.76 175.17 1j6o s ILE 88 N -3.24 2.74 0.00 0.00 -1.09 -0.65 -2.53 121.20 116.43 1j6o s ILE 88 Ca 0.10 -0.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.78 1j6o s ILE 88 Cb -0.01 -2.17 0.00 0.00 -1.58 0.00 0.00 42.46 38.70 1j6o s ILE 88 CO -0.01 0.51 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 1j6o n GLY 89 N 4.17 1.87 3.73 6.18 0.00 0.56 -0.95 105.19 120.75 1j6o n GLY 89 Ca -0.19 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 1j6o n GLY 89 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j6o s GLU 90 N -1.86 4.28 0.00 1.61 2.12 -0.81 -2.47 118.70 121.56 1j6o s GLU 90 Ca 0.00 2.25 -0.12 0.00 0.36 0.00 0.00 54.97 57.46 1j6o s GLU 90 Cb 0.00 -3.15 0.01 0.00 0.26 0.00 0.00 34.13 31.25 1j6o s GLU 90 CO 0.00 -0.45 0.25 -0.08 -0.54 0.00 0.00 175.26 174.44 1j6o s THR 91 N 0.48 0.07 -3.56 -1.70 -1.32 -1.06 -2.55 115.64 106.00 1j6o s THR 91 Ca 0.63 -0.62 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 1j6o s THR 91 Cb -0.41 -0.64 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 1j6o s THR 91 CO 0.37 -0.34 0.00 0.61 -2.21 0.00 0.00 174.62 173.06 1j6o n GLY 92 N 1.16 -0.30 2.94 6.08 0.00 -1.26 -0.64 105.19 113.18 1j6o n GLY 92 Ca -0.21 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.84 1j6o n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j6o s LEU 93 N 0.00 2.01 -0.32 0.99 1.43 -0.67 -4.41 118.68 117.70 1j6o s LEU 93 Ca 0.00 -0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1j6o s LEU 93 Cb 0.00 -0.21 0.11 0.00 0.03 0.00 0.00 46.19 46.11 1j6o s LEU 93 CO 0.00 0.05 0.13 -0.62 0.23 0.00 0.00 176.35 176.14 1j6o s ASP 94 N -0.10 3.78 -0.05 2.29 -1.08 -1.26 -1.33 116.67 118.91 1j6o s ASP 94 Ca 0.02 -1.70 0.17 0.00 -0.52 0.00 0.00 52.55 50.52 1j6o s ASP 94 Cb -0.02 -0.71 0.59 0.00 -1.46 0.00 0.00 42.92 41.32 1j6o s ASP 94 CO -0.00 -0.40 1.49 0.49 0.52 0.00 0.00 175.17 177.27 1j6o n PHE 95 N 4.74 1.08 -0.10 -5.34 3.72 -0.66 -3.05 117.46 117.85 1j6o n PHE 95 Ca -0.01 -0.47 -0.17 0.00 -0.05 0.00 0.00 57.45 56.75 1j6o n PHE 95 Cb 0.41 -0.12 -0.08 0.00 -0.94 0.00 0.00 39.48 38.75 1j6o n PHE 95 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1j6o n PHE 96 N 1.13 0.80 0.09 1.38 7.35 -1.25 -4.57 117.46 122.39 1j6o n PHE 96 Ca 0.22 0.35 -0.18 0.00 -0.76 0.00 0.00 57.45 57.07 1j6o n PHE 96 Cb 0.67 -0.96 -0.14 0.00 0.35 0.00 0.00 39.48 39.39 1j6o n PHE 96 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1j6o h ARG 97 N -1.00 0.31 -6.59 -4.13 2.47 -1.93 -3.49 114.38 100.03 1j6o h ARG 97 Ca -0.28 -0.53 -0.52 0.00 -1.26 0.00 0.00 59.98 57.39 1j6o h ARG 97 Cb 1.10 0.20 -0.07 0.00 -1.65 0.00 0.00 29.97 29.55 1j6o h ARG 97 CO -0.17 1.21 -0.90 0.09 0.56 0.00 0.00 179.97 180.76 1j6o n ASN 98 N -3.53 -0.26 0.09 7.04 4.13 -1.17 -4.84 115.26 116.72 1j6o n ASN 98 Ca -0.14 -1.05 -0.04 0.00 1.68 0.00 0.00 54.58 55.02 1j6o n ASN 98 Cb 1.05 -2.82 0.17 0.00 -1.54 0.00 0.00 39.78 36.64 1j6o n ASN 98 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 1j6o h ILE 99 N -1.84 1.35 -3.95 2.41 1.08 -1.87 -3.42 117.51 111.27 1j6o h ILE 99 Ca -0.64 -1.76 -0.68 0.00 -0.39 0.00 0.00 64.86 61.39 1j6o h ILE 99 Cb 1.38 1.84 -0.22 0.00 -3.07 0.00 0.00 36.82 36.75 1j6o h ILE 99 CO 0.63 0.52 -0.80 -0.44 -0.69 0.00 0.00 178.15 177.37 1j6o s SER 100 N -6.89 3.81 0.55 1.72 0.01 -1.26 -4.97 113.70 106.67 1j6o s SER 100 Ca -0.04 -0.43 -0.22 0.00 1.31 0.00 0.00 55.95 56.57 1j6o s SER 100 Cb 0.13 -0.61 -0.05 0.00 0.21 0.00 0.00 66.02 65.70 1j6o s SER 100 CO 0.79 0.25 1.37 -2.84 0.41 0.00 0.00 173.24 173.22 1j6o s PRO 101 N -1.49 3.11 0.16 12.44 0.02 -1.26 -4.79 135.00 143.19 1j6o s PRO 101 Ca 0.15 2.26 -0.17 0.00 0.02 0.00 0.00 61.00 63.26 1j6o s PRO 101 Cb -0.10 -2.25 0.08 0.00 0.02 0.00 0.00 34.50 32.24 1j6o s PRO 101 CO 0.06 -1.22 1.67 0.00 -0.33 0.00 0.00 177.00 177.18 1j6o h ALA 102 N 1.43 0.25 0.00 -1.55 0.00 -1.95 -0.83 119.26 116.61 1j6o h ALA 102 Ca -0.51 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1j6o h ALA 102 Cb 1.30 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 1j6o h ALA 102 CO 0.57 -0.45 -0.21 0.93 0.00 0.00 0.00 179.25 180.09 1j6o h GLU 103 N 0.01 0.00 -0.21 0.00 4.39 -1.99 -0.17 114.58 116.61 1j6o h GLU 103 Ca 0.18 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.71 1j6o h GLU 103 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1j6o h GLU 103 CO -0.38 0.21 -0.51 0.28 -1.16 0.00 0.00 179.01 177.45 1j6o h VAL 104 N 0.00 1.31 -0.25 3.13 2.07 -1.80 -1.92 116.25 118.78 1j6o h VAL 104 Ca -0.00 -1.73 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 1j6o h VAL 104 Cb 0.39 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1j6o h VAL 104 CO 0.03 0.55 0.14 1.56 0.02 0.00 0.00 177.57 179.86 1j6o h GLN 105 N 0.43 0.35 -0.57 1.57 4.20 -0.52 -2.51 115.11 118.07 1j6o h GLN 105 Ca -0.00 -0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.72 1j6o h GLN 105 Cb 1.13 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.79 1j6o h GLN 105 CO 0.11 0.32 0.28 0.87 -0.67 0.00 0.00 178.83 179.74 1j6o h LYS 106 N 0.29 0.52 -0.58 1.46 1.57 -0.97 -0.34 116.57 118.52 1j6o h LYS 106 Ca 0.09 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 1j6o h LYS 106 Cb 0.07 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1j6o h LYS 106 CO -0.01 0.34 -0.03 0.07 -0.57 0.00 0.00 179.45 179.25 1j6o h ARG 107 N 0.54 1.05 -0.39 3.15 0.11 -1.19 -0.17 114.38 117.48 1j6o h ARG 107 Ca 0.26 -0.35 -0.08 0.00 0.10 0.00 0.00 59.98 59.91 1j6o h ARG 107 Cb 0.19 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.17 1j6o h ARG 107 CO -0.19 1.05 -0.10 0.28 0.10 0.00 0.00 179.97 181.11 1j6o h VAL 108 N 0.94 1.25 -0.08 0.08 2.07 -1.22 -0.48 116.25 118.81 1j6o h VAL 108 Ca 0.16 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1j6o h VAL 108 Cb 0.59 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1j6o h VAL 108 CO 0.04 0.37 -0.06 0.15 0.02 0.00 0.00 177.57 178.08 1j6o h PHE 109 N 0.62 0.22 -0.75 1.57 3.57 -0.87 -2.56 116.94 118.73 1j6o h PHE 109 Ca 0.11 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1j6o h PHE 109 Cb 0.53 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 1j6o h PHE 109 CO 0.02 0.60 0.48 0.28 -2.23 0.00 0.00 178.31 177.46 1j6o h VAL 110 N -0.23 1.13 -0.13 1.41 2.07 -0.83 -0.97 116.25 118.72 1j6o h VAL 110 Ca 0.01 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 1j6o h VAL 110 Cb 0.55 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1j6o h VAL 110 CO 0.02 0.17 -0.11 -0.33 0.02 0.00 0.00 177.57 177.34 1j6o h GLU 111 N 0.96 0.19 0.08 1.57 5.08 -1.03 -0.73 114.58 120.70 1j6o h GLU 111 Ca 0.30 -0.04 -0.25 0.00 -1.00 0.00 0.00 59.36 58.37 1j6o h GLU 111 Cb -0.02 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1j6o h GLU 111 CO -0.10 0.32 -1.12 1.96 -1.00 0.00 0.00 179.01 179.07 1j6o h GLN 112 N 0.19 0.25 -0.52 2.33 4.20 -0.95 -1.80 115.11 118.80 1j6o h GLN 112 Ca 0.04 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.35 1j6o h GLN 112 Cb 0.32 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 1j6o h GLN 112 CO 0.02 1.14 0.20 0.82 -0.67 0.00 0.00 178.83 180.34 1j6o h ILE 113 N 0.09 1.22 -0.65 2.54 2.04 -0.83 0.51 117.51 122.43 1j6o h ILE 113 Ca -0.10 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1j6o h ILE 113 Cb 1.82 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 1j6o h ILE 113 CO 0.18 0.25 0.26 -0.33 0.00 0.00 0.00 178.15 178.51 1j6o h GLU 114 N 0.69 0.95 -0.42 2.37 5.08 -1.06 -1.21 114.58 120.99 1j6o h GLU 114 Ca 0.17 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1j6o h GLU 114 Cb 0.20 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1j6o h GLU 114 CO -0.01 0.78 -0.06 1.25 -1.00 0.00 0.00 179.01 179.96 1j6o h LEU 115 N 0.94 0.78 -1.03 1.33 5.85 -0.77 -1.53 115.31 120.88 1j6o h LEU 115 Ca 0.22 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1j6o h LEU 115 Cb 0.18 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1j6o h LEU 115 CO -0.02 0.94 0.54 0.00 -0.34 0.00 0.00 178.44 179.57 1j6o h ALA 116 N 0.87 1.28 -0.37 1.25 0.00 -0.53 -0.53 119.26 121.22 1j6o h ALA 116 Ca 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1j6o h ALA 116 Cb 0.58 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1j6o h ALA 116 CO 0.03 0.63 0.17 0.78 0.00 0.00 0.00 179.25 180.86 1j6o h GLY 117 N 1.24 0.58 0.97 0.00 0.00 -1.00 0.43 103.07 105.28 1j6o h GLY 117 Ca 0.32 -0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.37 1j6o h GLY 117 CO -0.06 0.28 0.30 1.70 0.00 0.00 0.00 176.54 178.76 1j6o h LYS 118 N 0.46 0.60 -0.00 4.80 3.64 -0.67 -2.67 116.57 122.72 1j6o h LYS 118 Ca 0.13 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1j6o h LYS 118 Cb 0.14 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1j6o h LYS 118 CO -0.01 0.40 -0.21 1.28 -2.27 0.00 0.00 179.45 178.64 1j6o n LEU 119 N -4.78 0.44 -3.03 5.20 4.77 -0.26 -4.93 117.00 114.41 1j6o n LEU 119 Ca 0.02 0.08 -0.21 0.00 -0.03 0.00 0.00 56.01 55.87 1j6o n LEU 119 Cb 0.04 -0.26 0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1j6o n LEU 119 CO 0.34 0.09 0.10 -3.20 -1.33 0.00 0.00 177.39 173.39 1j6o n ASN 120 N -1.18 -5.91 -4.76 -1.43 5.15 0.14 -5.01 115.26 102.27 1j6o n ASN 120 Ca 0.10 -0.36 -0.33 0.00 -0.60 0.00 0.00 54.58 53.39 1j6o n ASN 120 Cb 0.31 -4.65 -0.08 0.00 -0.53 0.00 0.00 39.78 34.84 1j6o n ASN 120 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1j6o s LEU 121 N -6.45 3.81 0.69 1.20 1.43 -0.51 -4.81 118.68 114.03 1j6o s LEU 121 Ca 0.39 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.48 1j6o s LEU 121 Cb -0.17 -2.16 0.01 0.00 0.03 0.00 0.00 46.19 43.90 1j6o s LEU 121 CO 0.48 0.29 1.11 -2.16 0.23 0.00 0.00 176.35 176.30 1j6o s PRO 122 N -1.57 2.65 -0.05 1.29 0.04 -1.25 -4.59 135.00 131.52 1j6o s PRO 122 Ca 0.21 1.35 -0.04 0.00 0.04 0.00 0.00 61.00 62.56 1j6o s PRO 122 Cb -0.12 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1j6o s PRO 122 CO 0.11 -1.36 0.14 -0.51 0.04 0.00 0.00 177.00 175.42 1j6o s LEU 123 N -5.13 4.25 -0.41 -3.56 1.43 -0.00 -1.64 118.68 113.62 1j6o s LEU 123 Ca 0.66 0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 54.05 1j6o s LEU 123 Cb -0.20 -2.35 0.10 0.00 0.03 0.00 0.00 46.19 43.77 1j6o s LEU 123 CO 0.45 0.32 0.21 -0.69 0.23 0.00 0.00 176.35 176.87 1j6o s VAL 124 N -1.19 3.53 -0.15 -1.59 1.01 -0.12 -1.16 120.40 120.74 1j6o s VAL 124 Ca 0.22 -1.86 -0.09 0.00 0.00 0.00 0.00 61.98 60.26 1j6o s VAL 124 Cb -0.12 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1j6o s VAL 124 CO 0.13 -0.62 0.15 -0.69 0.00 0.00 0.00 175.10 174.06 1j6o s VAL 125 N 1.23 5.45 -0.18 2.92 1.01 -0.08 -2.58 120.40 128.17 1j6o s VAL 125 Ca 0.06 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.24 1j6o s VAL 125 Cb -0.23 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1j6o s VAL 125 CO -0.02 0.54 -0.06 -2.28 0.00 0.00 0.00 175.10 173.27 1j6o s HIS 126 N -0.46 2.94 -0.06 5.22 5.65 0.19 -0.62 115.29 128.15 1j6o s HIS 126 Ca 0.13 -0.71 -0.01 0.00 0.25 0.00 0.00 55.06 54.72 1j6o s HIS 126 Cb -0.12 -2.01 0.03 0.00 -1.18 0.00 0.00 32.58 29.30 1j6o s HIS 126 CO 0.02 -0.34 -0.00 0.42 -0.65 0.00 0.00 174.74 174.18 1j6o s ILE 127 N 0.93 0.34 -0.16 0.89 1.01 -1.26 -1.67 121.20 121.28 1j6o s ILE 127 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 60.65 60.73 1j6o s ILE 127 Cb -0.15 -0.47 0.04 0.00 0.01 0.00 0.00 42.46 41.90 1j6o s ILE 127 CO 0.01 0.23 -0.05 -0.60 0.00 0.00 0.00 174.94 174.53 1j6o s ARG 128 N 1.65 1.35 -1.65 2.79 6.06 -0.44 -4.77 118.95 123.93 1j6o s ARG 128 Ca -0.00 -0.46 -0.16 0.00 -2.50 0.00 0.00 55.73 52.61 1j6o s ARG 128 Cb -0.13 -1.92 0.13 0.00 0.06 0.00 0.00 34.95 33.09 1j6o s ARG 128 CO -0.04 -0.42 0.78 -0.25 -2.50 0.00 0.00 175.30 172.87 1j6o n ASP 129 N 4.91 -3.21 -1.19 -2.12 8.00 -1.26 -1.65 116.55 120.02 1j6o n ASP 129 Ca -0.11 -0.98 -0.02 0.00 0.71 0.00 0.00 54.79 54.39 1j6o n ASP 129 Cb 0.48 -2.96 -0.03 0.00 -0.02 0.00 0.00 41.12 38.59 1j6o n ASP 129 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j6o n ALA 130 N -4.43 3.12 -0.16 2.24 0.00 -1.26 -4.44 120.51 115.57 1j6o n ALA 130 Ca 0.03 -1.38 -0.06 0.00 0.00 0.00 0.00 53.44 52.03 1j6o n ALA 130 Cb 0.52 -0.50 0.03 0.00 0.00 0.00 0.00 19.45 19.50 1j6o n ALA 130 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1j6o h TYR 131 N 0.42 0.51 -0.59 0.00 0.05 -1.92 0.84 116.97 116.28 1j6o h TYR 131 Ca -0.41 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.37 1j6o h TYR 131 Cb 1.61 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 39.16 1j6o h TYR 131 CO -0.03 0.29 0.28 1.03 -1.05 0.00 0.00 178.16 178.68 1j6o h SER 132 N 0.55 0.78 -0.52 3.88 0.87 -1.99 0.85 113.55 117.97 1j6o h SER 132 Ca 0.20 -0.14 -0.12 0.00 -1.23 0.00 0.00 61.79 60.51 1j6o h SER 132 Cb 0.04 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1j6o h SER 132 CO -0.10 0.70 -0.12 -0.33 -0.53 0.00 0.00 176.83 176.44 1j6o h GLU 133 N 0.81 1.01 -0.33 2.24 3.07 -1.87 -1.96 114.58 117.55 1j6o h GLU 133 Ca 0.20 -0.38 -0.09 0.00 -0.50 0.00 0.00 59.36 58.58 1j6o h GLU 133 Cb 0.13 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 1j6o h GLU 133 CO -0.02 1.07 -0.16 0.00 -1.40 0.00 0.00 179.01 178.49 1j6o h ALA 134 N 0.91 0.47 -0.10 3.43 0.00 -0.66 -2.47 119.26 120.84 1j6o h ALA 134 Ca 0.13 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1j6o h ALA 134 Cb 0.69 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1j6o h ALA 134 CO 0.05 0.38 -0.16 -0.92 0.00 0.00 0.00 179.25 178.60 1j6o h TYR 135 N 0.46 -0.41 -0.62 0.00 3.20 -0.70 0.25 116.97 119.16 1j6o h TYR 135 Ca 0.07 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.07 1j6o h TYR 135 Cb 0.69 0.20 -0.08 0.00 1.54 0.00 0.00 36.73 39.08 1j6o h TYR 135 CO 0.06 -0.23 0.20 0.93 -1.64 0.00 0.00 178.16 177.48 1j6o h GLU 136 N -0.21 0.35 -0.05 1.82 4.39 -1.29 -0.83 114.58 118.76 1j6o h GLU 136 Ca 0.09 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 1j6o h GLU 136 Cb 0.34 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1j6o h GLU 136 CO -0.23 0.23 0.01 0.82 -1.16 0.00 0.00 179.01 178.69 1j6o h ILE 137 N 0.36 1.18 -0.35 3.13 2.04 -0.90 -2.39 117.51 120.59 1j6o h ILE 137 Ca 0.32 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1j6o h ILE 137 Cb 0.44 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 1j6o h ILE 137 CO -0.35 0.15 0.21 -0.07 0.00 0.00 0.00 178.15 178.09 1j6o h LEU 138 N -0.13 0.42 -1.47 1.44 3.38 -0.61 -2.13 115.31 116.21 1j6o h LEU 138 Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1j6o h LEU 138 Cb 0.23 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1j6o h LEU 138 CO -0.00 0.35 0.00 0.08 0.09 0.00 0.00 178.44 178.96 1j6o h ARG 139 N 0.45 0.00 -0.23 1.13 0.11 -1.19 -2.94 114.38 111.71 1j6o h ARG 139 Ca 0.12 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 60.07 1j6o h ARG 139 Cb 0.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 1j6o h ARG 139 CO -0.02 0.00 -0.44 1.15 0.10 0.00 0.00 179.97 180.76 1j6o h THR 140 N 0.00 1.30 -4.38 0.08 2.02 -0.83 -3.47 112.91 107.63 1j6o h THR 140 Ca 0.00 -1.62 -0.22 0.00 0.77 0.00 0.00 66.41 65.34 1j6o h THR 140 Cb 0.36 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 1j6o h THR 140 CO 0.00 0.51 -0.16 -1.84 0.37 0.00 0.00 175.52 174.40 1j6o n GLU 141 N -4.01 1.56 -2.24 6.66 0.28 -1.11 -5.06 120.64 116.71 1j6o n GLU 141 Ca -0.02 -1.26 -0.36 0.00 -0.16 0.00 0.00 57.16 55.36 1j6o n GLU 141 Cb 0.54 0.32 -0.04 0.00 1.43 0.00 0.00 31.44 33.69 1j6o n GLU 141 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1j6o s SER 142 N -1.96 5.63 0.51 -1.84 0.15 -1.26 -5.01 113.70 109.92 1j6o s SER 142 Ca 0.01 -0.40 -0.12 0.00 0.70 0.00 0.00 55.95 56.13 1j6o s SER 142 Cb -0.00 -2.55 -0.06 0.00 -1.71 0.00 0.00 66.02 61.70 1j6o s SER 142 CO 0.00 -2.22 0.93 -0.76 1.20 0.00 0.00 173.24 172.39 1j6o s LEU 143 N 7.96 3.57 0.71 3.45 1.43 -1.26 -4.54 118.68 129.99 1j6o s LEU 143 Ca 0.58 1.36 -0.15 0.00 -1.03 0.00 0.00 54.13 54.89 1j6o s LEU 143 Cb -0.08 -4.32 0.03 0.00 0.03 0.00 0.00 46.19 41.85 1j6o s LEU 143 CO 0.09 -0.62 1.17 -2.84 0.23 0.00 0.00 176.35 174.38 1j6o s PRO 144 N -4.39 2.34 0.15 1.29 0.02 -1.26 -4.91 135.00 128.25 1j6o s PRO 144 Ca 0.55 1.62 -0.29 0.00 0.02 0.00 0.00 61.00 62.89 1j6o s PRO 144 Cb -0.10 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 1j6o s PRO 144 CO 0.39 -1.65 1.56 0.93 -0.33 0.00 0.00 177.00 177.89 1j6o h GLU 145 N -0.23 -0.27 -5.21 5.54 5.08 -1.91 -2.97 114.58 114.60 1j6o h GLU 145 Ca -0.47 0.02 -0.65 0.00 -1.00 0.00 0.00 59.36 57.25 1j6o h GLU 145 Cb 1.28 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 30.43 1j6o h GLU 145 CO 0.51 -0.18 0.38 0.15 -1.00 0.00 0.00 179.01 178.87 1j6o s LYS 146 N -5.73 3.11 0.14 2.33 -0.14 -1.26 -4.93 119.74 113.26 1j6o s LYS 146 Ca -0.14 -0.94 -0.25 0.00 -1.36 0.00 0.00 55.97 53.27 1j6o s LYS 146 Cb 0.11 -4.22 -0.02 0.00 -1.68 0.00 0.00 37.83 32.03 1j6o s LYS 146 CO 0.64 -1.67 1.61 0.00 -0.76 0.00 0.00 175.35 175.17 1j6o h ARG 147 N 9.40 -0.36 0.00 1.68 2.47 -1.71 -3.33 114.38 122.52 1j6o h ARG 147 Ca -0.29 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.46 1j6o h ARG 147 Cb 1.08 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.48 1j6o h ARG 147 CO 1.14 -0.24 0.00 0.41 0.56 0.00 0.00 179.97 181.83 1j6o n GLY 148 N -1.40 0.51 2.99 0.04 0.00 -1.26 -0.82 105.19 105.24 1j6o n GLY 148 Ca -0.03 -1.66 -0.15 0.00 0.00 0.00 0.00 46.02 44.18 1j6o n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j6o s VAL 149 N -2.72 0.46 -0.52 1.61 1.01 -0.30 -1.33 120.40 118.61 1j6o s VAL 149 Ca 0.00 -0.44 -0.16 0.00 0.00 0.00 0.00 61.98 61.38 1j6o s VAL 149 Cb 0.00 -0.43 0.10 0.00 0.00 0.00 0.00 36.38 36.06 1j6o s VAL 149 CO 0.00 0.00 0.48 -0.63 0.00 0.00 0.00 175.10 174.95 1j6o s ILE 150 N -0.43 5.18 0.55 2.22 -1.09 -0.30 -0.90 121.20 126.43 1j6o s ILE 150 Ca -0.01 -1.26 -0.19 0.00 -2.23 0.00 0.00 60.65 56.96 1j6o s ILE 150 Cb -0.04 -4.27 -0.06 0.00 -1.58 0.00 0.00 42.46 36.52 1j6o s ILE 150 CO -0.00 -0.78 1.09 -1.38 -1.23 0.00 0.00 174.94 172.64 1j6o s HIS 151 N 1.73 2.80 -1.49 3.97 -3.43 0.21 -1.14 115.29 117.93 1j6o s HIS 151 Ca 0.04 1.55 -0.02 0.00 -0.80 0.00 0.00 55.06 55.83 1j6o s HIS 151 Cb -0.27 -3.18 0.02 0.00 -1.43 0.00 0.00 32.58 27.72 1j6o s HIS 151 CO 0.05 -1.32 0.31 0.00 -2.00 0.00 0.00 174.74 171.78 1j6o n ALA 152 N -1.44 -1.93 -1.64 -1.38 0.00 -1.04 -4.61 120.51 108.46 1j6o n ALA 152 Ca 0.10 -0.30 -0.54 0.00 0.00 0.00 0.00 53.44 52.71 1j6o n ALA 152 Cb 0.52 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.48 1j6o n ALA 152 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1j6o n PHE 153 N -4.45 1.75 -1.94 0.00 7.35 -0.43 -4.89 117.46 114.84 1j6o n PHE 153 Ca -0.28 0.58 0.05 0.00 -0.76 0.00 0.00 57.45 57.04 1j6o n PHE 153 Cb 0.67 -2.39 0.11 0.00 0.35 0.00 0.00 39.48 38.22 1j6o n PHE 153 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1j6o n SER 154 N 3.73 1.35 -0.38 -2.13 3.41 -1.26 -4.97 113.62 113.37 1j6o n SER 154 Ca 0.22 -2.93 0.00 0.00 -0.26 0.00 0.00 58.87 55.90 1j6o n SER 154 Cb 0.17 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 1j6o n SER 154 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1j6o n SER 155 N -0.41 1.29 -4.41 4.04 2.88 -1.26 -5.00 113.62 110.74 1j6o n SER 155 Ca 0.12 -0.19 -0.16 0.00 -1.33 0.00 0.00 58.87 57.31 1j6o n SER 155 Cb 0.87 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.39 1j6o n SER 155 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1j6o n ASP 156 N -0.33 1.72 -0.23 -3.46 5.68 -1.26 -4.86 116.55 113.81 1j6o n ASP 156 Ca 0.00 -2.26 -0.00 0.00 -0.50 0.00 0.00 54.79 52.03 1j6o n ASP 156 Cb 0.00 -0.35 0.11 0.00 -1.14 0.00 0.00 41.12 39.74 1j6o n ASP 156 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 1j6o h TYR 157 N 0.07 0.61 -0.63 2.11 3.20 -1.93 -1.08 116.97 119.32 1j6o h TYR 157 Ca -0.22 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.75 1j6o h TYR 157 Cb 1.02 -0.18 -0.06 0.00 1.54 0.00 0.00 36.73 39.05 1j6o h TYR 157 CO 0.00 0.25 0.29 1.49 -1.64 0.00 0.00 178.16 178.55 1j6o h GLU 158 N 0.60 0.50 -0.18 1.82 4.81 -1.99 0.93 114.58 121.07 1j6o h GLU 158 Ca 0.31 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.36 1j6o h GLU 158 Cb 0.28 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1j6o h GLU 158 CO -0.23 0.33 -0.53 -1.49 -0.73 0.00 0.00 179.01 176.37 1j6o h TRP 159 N 0.52 0.64 -0.26 0.92 -0.00 -1.87 -2.24 115.95 113.66 1j6o h TRP 159 Ca 0.30 -0.22 0.01 0.00 -0.00 0.00 0.00 58.89 58.99 1j6o h TRP 159 Cb 0.31 -0.12 -0.02 0.00 -0.00 0.00 0.00 29.16 29.33 1j6o h TRP 159 CO -0.13 0.93 0.13 0.00 -0.00 0.00 0.00 178.44 179.37 1j6o h ALA 160 N 1.03 0.31 -0.91 1.49 0.00 -0.18 -1.46 119.26 119.53 1j6o h ALA 160 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1j6o h ALA 160 Cb 1.05 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1j6o h ALA 160 CO 0.10 -0.26 0.54 -0.22 0.00 0.00 0.00 179.25 179.40 1j6o h LYS 161 N 0.28 1.24 -0.77 0.00 3.64 -0.73 0.83 116.57 121.06 1j6o h LYS 161 Ca 0.10 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1j6o h LYS 161 Cb 0.02 -0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 31.55 1j6o h LYS 161 CO -0.07 0.87 0.49 0.87 -2.27 0.00 0.00 179.45 179.35 1j6o h LYS 162 N 1.25 1.03 -0.04 1.90 1.79 -0.76 0.13 116.57 121.87 1j6o h LYS 162 Ca 0.33 -0.08 -0.24 0.00 -2.18 0.00 0.00 60.65 58.48 1j6o h LYS 162 Cb -0.04 -0.23 0.01 0.00 -1.58 0.00 0.00 32.23 30.39 1j6o h LYS 162 CO -0.06 0.71 -0.93 0.74 -1.08 0.00 0.00 179.45 178.83 1j6o h PHE 163 N 1.05 0.91 -0.79 -1.35 0.04 -0.90 -2.59 116.94 113.32 1j6o h PHE 163 Ca 0.28 -0.46 -0.01 0.00 2.80 0.00 0.00 57.97 60.57 1j6o h PHE 163 Cb -0.08 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 1j6o h PHE 163 CO -0.01 1.29 0.44 0.82 -0.60 0.00 0.00 178.31 180.25 1j6o h ILE 164 N 0.38 1.23 0.00 -0.55 2.04 -0.59 -0.90 117.51 119.13 1j6o h ILE 164 Ca -0.09 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1j6o h ILE 164 Cb 1.57 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1j6o h ILE 164 CO 0.18 0.25 -0.14 0.44 0.00 0.00 0.00 178.15 178.89 1j6o h ASP 165 N 1.09 0.00 1.25 1.72 3.32 -0.67 0.42 116.42 123.54 1j6o h ASP 165 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1j6o h ASP 165 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1j6o h ASP 165 CO -0.05 0.14 0.00 -0.11 -1.72 0.00 0.00 179.24 177.50 1j6o n LEU 166 N -3.82 0.69 0.00 1.55 7.94 -0.40 -4.90 117.00 118.06 1j6o n LEU 166 Ca -0.02 0.59 0.00 0.00 -1.11 0.00 0.00 56.01 55.47 1j6o n LEU 166 Cb 0.24 -0.39 0.00 0.00 0.53 0.00 0.00 43.42 43.79 1j6o n LEU 166 CO 0.32 -0.25 0.00 0.61 -1.11 0.00 0.00 177.39 176.96 1j6o n GLY 167 N 1.02 1.09 3.94 -3.96 0.00 0.14 -4.96 105.19 102.46 1j6o n GLY 167 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1j6o n GLY 167 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j6o s PHE 168 N -2.00 3.51 0.31 1.61 0.40 -0.86 -4.30 117.98 116.64 1j6o s PHE 168 Ca 0.00 0.42 0.08 0.00 -0.60 0.00 0.00 56.93 56.83 1j6o s PHE 168 Cb 0.00 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.54 1j6o s PHE 168 CO 0.00 0.08 0.19 -0.51 0.70 0.00 0.00 175.22 175.68 1j6o s LEU 169 N -4.30 3.49 -0.13 -0.37 1.02 -0.44 -4.13 118.68 113.82 1j6o s LEU 169 Ca 0.41 -0.55 -0.01 0.00 0.02 0.00 0.00 54.13 54.01 1j6o s LEU 169 Cb -0.10 -2.03 -0.02 0.00 0.02 0.00 0.00 46.19 44.06 1j6o s LEU 169 CO 0.37 -0.22 -0.11 -0.76 0.02 0.00 0.00 176.35 175.65 1j6o s LEU 170 N -3.87 2.86 -0.16 1.79 1.43 0.05 -1.15 118.68 119.61 1j6o s LEU 170 Ca 0.37 -0.26 -0.23 0.00 -1.03 0.00 0.00 54.13 52.98 1j6o s LEU 170 Cb -0.05 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1j6o s LEU 170 CO 0.24 0.19 0.73 -0.83 0.23 0.00 0.00 176.35 176.91 1j6o s GLY 171 N 0.23 2.18 -0.16 -3.19 0.00 -0.30 -1.66 107.32 104.43 1j6o s GLY 171 Ca -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 44.72 44.58 1j6o s GLY 171 CO 0.05 1.44 -0.13 -0.42 0.00 0.00 0.00 173.10 174.03 1j6o s ILE 172 N 1.80 2.90 0.00 0.90 -1.09 -0.55 -1.31 121.20 123.85 1j6o s ILE 172 Ca 0.34 -0.69 0.00 0.00 -2.23 0.00 0.00 60.65 58.07 1j6o s ILE 172 Cb -0.16 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1j6o s ILE 172 CO 0.13 0.51 0.00 0.61 -1.23 0.00 0.00 174.94 174.95 1j6o n GLY 173 N 3.98 5.35 0.34 6.18 0.00 -1.26 -1.79 105.19 117.99 1j6o n GLY 173 Ca -0.19 -1.51 0.04 0.00 0.00 0.00 0.00 46.02 44.36 1j6o n GLY 173 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1j6o h GLY 174 N 0.00 0.62 0.96 -0.02 0.00 -1.71 -2.19 103.07 100.74 1j6o h GLY 174 Ca 0.00 0.32 0.09 0.00 0.00 0.00 0.00 47.33 47.73 1j6o h GLY 174 CO 0.00 -0.34 0.43 -2.55 0.00 0.00 0.00 176.54 174.08 1j6o h PRO 175 N -0.00 0.00 0.00 4.80 0.11 -1.82 -1.36 132.00 133.73 1j6o h PRO 175 Ca 0.43 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.54 1j6o h PRO 175 Cb 0.67 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.77 1j6o h PRO 175 CO -0.94 0.00 -0.02 -0.24 -0.21 0.00 0.00 178.00 176.58 1j6o h VAL 176 N 0.00 0.25 -0.01 3.15 3.04 -1.76 -1.76 116.25 119.17 1j6o h VAL 176 Ca 0.14 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 1j6o h VAL 176 Cb 1.01 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 1j6o h VAL 176 CO -0.00 0.02 -0.34 0.35 -1.01 0.00 0.00 177.57 176.59 1j6o n THR 177 N -3.40 0.00 -2.22 3.17 -2.24 -0.51 -4.78 114.28 104.31 1j6o n THR 177 Ca -0.02 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 1j6o n THR 177 Cb 0.13 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 1j6o n THR 177 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1j6o s TYR 178 N -2.66 2.85 0.41 4.78 2.02 -0.66 -4.57 117.35 119.51 1j6o s TYR 178 Ca 0.20 0.81 0.16 0.00 -0.37 0.00 0.00 57.07 57.87 1j6o s TYR 178 Cb 0.19 -3.67 1.04 0.00 -0.40 0.00 0.00 41.96 39.12 1j6o s TYR 178 CO 0.58 -2.47 1.86 -1.00 -1.57 0.00 0.00 175.55 172.95 1j6o h PRO 179 N 7.83 0.43 0.00 -1.71 0.13 -1.91 -0.55 132.00 136.22 1j6o h PRO 179 Ca -0.38 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.67 1j6o h PRO 179 Cb 1.18 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1j6o h PRO 179 CO 0.90 0.29 -0.27 0.87 -0.23 0.00 0.00 178.00 179.56 1j6o h LYS 180 N 0.45 0.00 -2.65 0.86 1.79 -1.94 -3.36 116.57 111.72 1j6o h LYS 180 Ca 0.46 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 58.39 1j6o h LYS 180 Cb 1.09 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.72 1j6o h LYS 180 CO -0.18 0.27 2.43 0.09 -1.08 0.00 0.00 179.45 180.97 1j6o n ASN 181 N -3.60 7.67 -0.34 0.86 3.02 -0.21 -4.60 115.26 118.07 1j6o n ASN 181 Ca -0.01 -2.65 -0.04 0.00 -0.03 0.00 0.00 54.58 51.86 1j6o n ASN 181 Cb 0.40 -1.48 0.09 0.00 -0.61 0.00 0.00 39.78 38.18 1j6o n ASN 181 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1j6o h GLU 182 N 4.34 1.24 0.02 3.52 4.39 -1.79 -3.01 114.58 123.29 1j6o h GLU 182 Ca 0.66 -0.12 0.02 0.00 0.34 0.00 0.00 59.36 60.25 1j6o h GLU 182 Cb 0.62 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1j6o h GLU 182 CO 1.31 0.88 -0.15 0.00 -1.16 0.00 0.00 179.01 179.89 1j6o h ALA 183 N 1.29 -0.20 -0.59 3.43 0.00 -1.96 -2.18 119.26 119.06 1j6o h ALA 183 Ca 0.32 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.29 1j6o h ALA 183 Cb -0.02 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1j6o h ALA 183 CO -0.06 -0.65 0.29 1.25 0.00 0.00 0.00 179.25 180.08 1j6o h LEU 184 N -0.26 0.39 -1.07 0.00 5.85 -1.86 -1.40 115.31 116.96 1j6o h LEU 184 Ca 0.04 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1j6o h LEU 184 Cb 0.31 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1j6o h LEU 184 CO -0.13 0.25 0.63 0.03 -0.34 0.00 0.00 178.44 178.88 1j6o h ARG 185 N 0.53 1.21 -0.39 1.25 3.08 -1.39 -0.45 114.38 118.23 1j6o h ARG 185 Ca 0.27 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 1j6o h ARG 185 Cb 0.22 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1j6o h ARG 185 CO -0.20 0.80 -0.02 1.49 -1.07 0.00 0.00 179.97 180.96 1j6o h GLU 186 N 1.25 0.63 -0.23 0.04 4.57 -0.66 -0.62 114.58 119.56 1j6o h GLU 186 Ca 0.36 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1j6o h GLU 186 Cb -0.08 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.42 1j6o h GLU 186 CO -0.09 0.67 0.04 0.28 -1.18 0.00 0.00 179.01 178.72 1j6o h VAL 187 N 0.59 1.23 -0.98 0.32 2.07 -0.18 -1.60 116.25 117.70 1j6o h VAL 187 Ca 0.12 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.91 1j6o h VAL 187 Cb 0.41 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1j6o h VAL 187 CO 0.02 0.24 0.65 0.58 0.02 0.00 0.00 177.57 179.07 1j6o h VAL 188 N 0.18 1.22 -0.80 2.57 2.07 -0.80 -0.16 116.25 120.52 1j6o h VAL 188 Ca 0.07 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1j6o h VAL 188 Cb 0.32 -0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 29.86 1j6o h VAL 188 CO 0.00 0.24 0.48 0.50 0.02 0.00 0.00 177.57 178.81 1j6o h LYS 189 N 1.30 1.10 -0.02 1.57 3.64 -0.72 -1.66 116.57 121.77 1j6o h LYS 189 Ca 0.37 -0.10 -0.23 0.00 -1.27 0.00 0.00 60.65 59.41 1j6o h LYS 189 Cb -0.10 -0.23 0.01 0.00 -0.41 0.00 0.00 32.23 31.50 1j6o h LYS 189 CO -0.09 0.78 -0.93 0.00 -2.27 0.00 0.00 179.45 176.94 1j6o h ARG 190 N 1.10 0.52 0.06 1.90 2.47 -0.75 -3.35 114.38 116.33 1j6o h ARG 190 Ca 0.29 -0.53 -0.24 0.00 -1.26 0.00 0.00 59.98 58.24 1j6o h ARG 190 Cb -0.03 0.14 0.02 0.00 -1.65 0.00 0.00 29.97 28.46 1j6o h ARG 190 CO -0.05 1.16 -0.97 0.28 0.56 0.00 0.00 179.97 180.95 1j6o h VAL 191 N 0.31 1.35 0.00 2.04 2.07 -0.96 -3.51 116.25 117.55 1j6o h VAL 191 Ca -0.08 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1j6o h VAL 191 Cb 1.56 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.97 1j6o h VAL 191 CO 0.17 0.69 0.00 0.61 0.02 0.00 0.00 177.57 179.06 1j6o n GLY 192 N 1.24 -1.22 0.28 2.17 0.00 -0.63 -4.59 105.19 102.44 1j6o n GLY 192 Ca -0.12 -1.61 0.18 0.00 0.00 0.00 0.00 46.02 44.47 1j6o n GLY 192 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1j6o h LEU 193 N 0.00 0.00 -1.26 0.99 3.38 -1.95 -3.17 115.31 113.29 1j6o h LEU 193 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1j6o h LEU 193 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1j6o h LEU 193 CO 0.00 0.00 0.00 -0.08 0.09 0.00 0.00 178.44 178.45 1j6o h GLU 194 N 0.00 0.00 -0.01 1.13 4.81 -1.95 -3.25 114.58 115.31 1j6o h GLU 194 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1j6o h GLU 194 Cb 0.40 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 1j6o h GLU 194 CO 0.00 0.00 -0.03 0.66 -0.73 0.00 0.00 179.01 178.91 1j6o n TYR 195 N -2.71 0.03 -4.18 0.92 4.01 -1.20 -5.04 117.16 108.99 1j6o n TYR 195 Ca 0.01 -1.03 -0.17 0.00 -0.16 0.00 0.00 57.90 56.55 1j6o n TYR 195 Cb 0.25 -0.16 -0.11 0.00 -0.31 0.00 0.00 39.34 39.00 1j6o n TYR 195 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 1j6o s ILE 196 N -2.90 1.09 0.14 -0.72 -4.36 -1.23 -0.77 121.20 112.45 1j6o s ILE 196 Ca 0.33 -1.47 0.05 0.00 -0.26 0.00 0.00 60.65 59.30 1j6o s ILE 196 Cb 0.29 -1.22 -0.04 0.00 1.25 0.00 0.00 42.46 42.74 1j6o s ILE 196 CO 0.03 -0.36 -0.11 0.68 0.24 0.00 0.00 174.94 175.42 1j6o s VAL 197 N -1.75 1.21 0.30 8.37 -7.23 -0.66 -4.51 120.40 116.12 1j6o s VAL 197 Ca 0.02 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 1j6o s VAL 197 Cb -0.07 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 1j6o s VAL 197 CO 0.02 -0.68 0.49 -0.76 -0.31 0.00 0.00 175.10 173.86 1j6o s LEU 198 N -3.03 4.10 0.11 1.32 1.43 -1.26 -1.48 118.68 119.87 1j6o s LEU 198 Ca 0.15 0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 53.42 1j6o s LEU 198 Cb 0.01 -3.25 0.08 0.00 0.03 0.00 0.00 46.19 43.06 1j6o s LEU 198 CO 0.01 -0.20 0.67 -1.83 0.23 0.00 0.00 176.35 175.23 1j6o s GLU 199 N -3.98 1.17 -0.05 1.70 -1.05 -0.74 -1.53 118.70 114.22 1j6o s GLU 199 Ca 0.39 -0.37 0.04 0.00 -0.15 0.00 0.00 54.97 54.88 1j6o s GLU 199 Cb -0.10 0.54 -0.06 0.00 -0.44 0.00 0.00 34.13 34.07 1j6o s GLU 199 CO 0.33 -0.50 0.01 0.25 0.95 0.00 0.00 175.26 176.30 1j6o n THR 200 N -0.23 0.36 -2.07 1.83 -2.24 -1.24 -4.01 114.28 106.69 1j6o n THR 200 Ca -0.16 -0.21 -0.18 0.00 -2.27 0.00 0.00 64.05 61.23 1j6o n THR 200 Cb 0.64 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1j6o n THR 200 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1j6o n ASP 201 N -2.27 -5.30 -4.65 3.42 2.03 0.14 -4.63 116.55 105.30 1j6o n ASP 201 Ca -0.09 0.15 -0.39 0.00 0.52 0.00 0.00 54.79 54.98 1j6o n ASP 201 Cb 0.66 -4.38 0.04 0.00 -0.72 0.00 0.00 41.12 36.72 1j6o n ASP 201 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1j6o n PRO 203 N -0.64 0.88 -1.87 0.00 -0.04 -1.26 -1.23 135.00 130.83 1j6o n PRO 203 Ca 0.11 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.27 1j6o n PRO 203 Cb 0.44 -1.39 0.04 0.00 -0.04 0.00 0.00 33.50 32.55 1j6o n PRO 203 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1j6o s PHE 204 N -2.00 3.35 -0.79 0.54 0.08 0.09 -1.48 117.98 117.77 1j6o s PHE 204 Ca 0.33 1.08 -0.01 0.00 0.12 0.00 0.00 56.93 58.45 1j6o s PHE 204 Cb 0.15 -3.03 0.00 0.00 -0.57 0.00 0.00 43.02 39.57 1j6o s PHE 204 CO 0.25 -1.14 0.58 1.28 -0.10 0.00 0.00 175.22 176.10 1j6o n LEU 205 N -2.99 -1.73 -4.76 -0.37 4.77 -1.26 -4.60 117.00 106.05 1j6o n LEU 205 Ca 0.07 -0.94 -0.34 0.00 -0.03 0.00 0.00 56.01 54.77 1j6o n LEU 205 Cb 0.57 -1.54 0.04 0.00 -2.33 0.00 0.00 43.42 40.16 1j6o n LEU 205 CO 0.58 0.40 0.77 -2.16 -1.33 0.00 0.00 177.39 175.64 1j6o s PRO 206 N -4.83 2.92 0.75 3.23 0.04 -1.26 -3.98 135.00 131.87 1j6o s PRO 206 Ca 0.01 1.54 -0.11 0.00 0.04 0.00 0.00 61.00 62.48 1j6o s PRO 206 Cb -0.00 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.63 1j6o s PRO 206 CO 0.87 -1.18 1.08 -1.25 0.04 0.00 0.00 177.00 176.56 1j6o s PRO 207 N -3.75 2.44 0.12 0.56 0.04 -1.26 -4.65 135.00 128.49 1j6o s PRO 207 Ca 0.70 1.02 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 1j6o s PRO 207 Cb -0.23 -1.93 0.07 0.00 0.04 0.00 0.00 34.50 32.45 1j6o s PRO 207 CO 0.37 -1.47 0.88 0.94 0.04 0.00 0.00 177.00 177.75 1j6o n GLN 208 N -3.39 -0.18 0.00 4.56 -0.06 -1.26 -0.08 117.38 116.97 1j6o n GLN 208 Ca 0.08 0.87 0.01 0.00 -2.00 0.00 0.00 57.00 55.96 1j6o n GLN 208 Cb 0.54 -1.28 0.04 0.00 -4.06 0.00 0.00 30.24 25.47 1j6o n GLN 208 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1j6o n PRO 209 N -4.79 0.00 -1.19 3.69 -0.04 -1.26 -2.46 135.00 128.96 1j6o n PRO 209 Ca 0.04 0.46 -0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1j6o n PRO 209 Cb 0.20 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.28 1j6o n PRO 209 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1j6o n PHE 210 N -1.49 0.57 -1.78 0.54 3.72 0.89 -5.07 117.46 114.84 1j6o n PHE 210 Ca 0.00 -1.47 -0.39 0.00 -0.05 0.00 0.00 57.45 55.55 1j6o n PHE 210 Cb 0.02 -0.24 0.04 0.00 -0.94 0.00 0.00 39.48 38.35 1j6o n PHE 210 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1j6o s ARG 211 N -2.68 3.25 0.00 -1.08 1.81 -1.03 -1.57 118.95 117.65 1j6o s ARG 211 Ca 0.39 2.28 0.00 0.00 -1.72 0.00 0.00 55.73 56.68 1j6o s ARG 211 Cb 0.38 -2.34 0.00 0.00 -0.45 0.00 0.00 34.95 32.54 1j6o s ARG 211 CO -0.07 -1.12 0.00 0.41 -0.68 0.00 0.00 175.30 173.85 1j6o n GLY 212 N 0.69 0.77 3.49 -3.53 0.00 -1.26 -5.02 105.19 100.33 1j6o n GLY 212 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 1j6o n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j6o s LYS 213 N -0.01 1.76 0.29 1.61 -0.14 -0.61 -5.10 119.74 117.54 1j6o s LYS 213 Ca 0.00 -1.70 -0.29 0.00 -1.36 0.00 0.00 55.97 52.62 1j6o s LYS 213 Cb 0.00 -1.83 -0.10 0.00 -1.68 0.00 0.00 37.83 34.22 1j6o s LYS 213 CO 0.00 0.34 1.37 0.50 -0.76 0.00 0.00 175.35 176.80 1j6o s ARG 214 N -3.47 4.31 0.34 1.68 3.52 -1.26 -4.60 118.95 119.48 1j6o s ARG 214 Ca 0.30 2.26 -0.07 0.00 -0.13 0.00 0.00 55.73 58.08 1j6o s ARG 214 Cb -0.05 -3.09 -0.06 0.00 -1.56 0.00 0.00 34.95 30.19 1j6o s ARG 214 CO 0.15 -0.30 0.65 1.21 -0.81 0.00 0.00 175.30 176.20 1j6o s ASN 215 N -0.07 6.48 0.15 -2.12 2.47 -0.55 -4.96 114.94 116.34 1j6o s ASN 215 Ca 0.54 0.91 -0.17 0.00 0.42 0.00 0.00 52.86 54.55 1j6o s ASN 215 Cb -0.41 -2.23 0.04 0.00 -1.45 0.00 0.00 41.25 37.20 1j6o s ASN 215 CO 0.49 -0.29 0.46 -1.83 -3.72 0.00 0.00 177.10 172.21 1j6o s GLU 216 N -3.69 1.18 0.29 0.43 -1.05 -1.26 -4.31 118.70 110.28 1j6o s GLU 216 Ca 0.47 -0.72 0.03 0.00 -0.15 0.00 0.00 54.97 54.60 1j6o s GLU 216 Cb -0.10 0.50 0.70 0.00 -0.44 0.00 0.00 34.13 34.78 1j6o s GLU 216 CO 0.31 -0.48 1.70 -1.35 0.95 0.00 0.00 175.26 176.38 1j6o h PRO 217 N 2.27 0.38 0.00 -4.83 0.11 -1.98 -1.54 132.00 126.41 1j6o h PRO 217 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1j6o h PRO 217 Cb 1.27 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1j6o h PRO 217 CO 0.43 0.25 0.00 1.57 -0.21 0.00 0.00 178.00 180.04 1j6o h LYS 218 N 0.39 0.00 -0.00 1.05 2.10 -1.95 -0.59 116.57 117.56 1j6o h LYS 218 Ca 0.54 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.19 1j6o h LYS 218 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1j6o h LYS 218 CO -0.53 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.58 1j6o n TYR 219 N -2.47 0.00 0.29 0.07 4.01 -0.58 -3.36 117.16 115.12 1j6o n TYR 219 Ca -0.01 -0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.88 1j6o n TYR 219 Cb 0.10 0.00 0.86 0.00 -0.31 0.00 0.00 39.34 39.99 1j6o n TYR 219 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1j6o h LEU 220 N 0.14 0.00 -1.57 7.72 5.85 -1.26 -2.74 115.31 123.45 1j6o h LEU 220 Ca 0.00 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.87 1j6o h LEU 220 Cb 0.03 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1j6o h LEU 220 CO 0.00 0.05 0.50 0.07 -0.34 0.00 0.00 178.44 178.72 1j6o h LYS 221 N 0.00 0.41 -0.02 1.25 2.10 -1.80 -0.24 116.57 118.27 1j6o h LYS 221 Ca -0.00 -0.02 -0.12 0.00 -2.00 0.00 0.00 60.65 58.51 1j6o h LYS 221 Cb 0.15 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.37 1j6o h LYS 221 CO 0.01 0.27 -0.53 1.88 -2.00 0.00 0.00 179.45 179.08 1j6o h TYR 222 N 0.43 0.08 -0.21 0.07 0.05 -1.79 -0.73 116.97 114.87 1j6o h TYR 222 Ca 0.37 -0.03 -0.11 0.00 0.05 0.00 0.00 58.73 59.01 1j6o h TYR 222 Cb 0.83 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 38.56 1j6o h TYR 222 CO -0.00 0.58 -0.30 0.28 -1.05 0.00 0.00 178.16 177.67 1j6o h VAL 223 N 0.05 1.33 -0.50 -2.88 2.07 -1.20 -2.03 116.25 113.09 1j6o h VAL 223 Ca -0.00 -1.50 -0.03 0.00 0.82 0.00 0.00 66.70 65.98 1j6o h VAL 223 Cb 0.95 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 1j6o h VAL 223 CO 0.07 0.46 0.19 0.58 0.02 0.00 0.00 177.57 178.89 1j6o h VAL 224 N 0.26 1.22 -0.14 2.57 2.07 -1.24 -1.42 116.25 119.57 1j6o h VAL 224 Ca 0.02 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.90 1j6o h VAL 224 Cb 0.88 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 1j6o h VAL 224 CO 0.07 0.26 -0.16 -0.08 0.02 0.00 0.00 177.57 177.68 1j6o h GLU 225 N 0.66 -0.19 -0.33 1.57 4.81 -1.03 0.15 114.58 120.23 1j6o h GLU 225 Ca 0.16 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1j6o h GLU 225 Cb 0.22 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1j6o h GLU 225 CO -0.01 -0.12 0.20 1.15 -0.73 0.00 0.00 179.01 179.50 1j6o h THR 226 N -0.19 1.10 -0.69 0.32 2.02 -1.23 -1.17 112.91 113.07 1j6o h THR 226 Ca 0.10 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 67.09 1j6o h THR 226 Cb 0.33 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.36 1j6o h THR 226 CO -0.25 0.10 0.43 0.40 0.37 0.00 0.00 175.52 176.57 1j6o h ILE 227 N 0.43 1.07 -0.66 3.11 2.04 -0.73 0.71 117.51 123.49 1j6o h ILE 227 Ca 0.12 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 1j6o h ILE 227 Cb -0.01 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 1j6o h ILE 227 CO -0.02 0.15 0.24 0.77 0.00 0.00 0.00 178.15 179.29 1j6o h SER 228 N 0.83 0.92 -0.26 1.72 4.64 -0.37 -1.40 113.55 119.63 1j6o h SER 228 Ca 0.28 -0.14 -0.12 0.00 -0.47 0.00 0.00 61.79 61.34 1j6o h SER 228 Cb 0.05 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1j6o h SER 228 CO -0.12 0.84 -0.32 1.56 -0.87 0.00 0.00 176.83 177.92 1j6o h GLN 229 N 0.97 0.67 -0.15 4.77 4.20 -0.36 0.63 115.11 125.84 1j6o h GLN 229 Ca 0.22 -0.38 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 1j6o h GLN 229 Cb 0.23 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1j6o h GLN 229 CO -0.01 0.99 -0.20 0.28 -0.67 0.00 0.00 178.83 179.22 1j6o h VAL 230 N 0.40 1.21 -0.01 -0.54 2.07 -0.70 -2.72 116.25 115.97 1j6o h VAL 230 Ca 0.03 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1j6o h VAL 230 Cb 0.89 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1j6o h VAL 230 CO 0.08 0.30 -0.45 0.18 0.02 0.00 0.00 177.57 177.69 1j6o n LEU 231 N -4.21 1.05 -3.06 2.57 4.77 -0.54 -4.87 117.00 112.71 1j6o n LEU 231 Ca -0.01 -0.30 -0.20 0.00 -0.03 0.00 0.00 56.01 55.47 1j6o n LEU 231 Cb 0.32 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.36 1j6o n LEU 231 CO 0.39 0.21 0.20 0.61 -1.33 0.00 0.00 177.39 177.48 1j6o n GLY 232 N 1.42 -0.29 3.27 -0.72 0.00 0.11 -5.02 105.19 103.95 1j6o n GLY 232 Ca 0.09 0.10 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 1j6o n GLY 232 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j6o s VAL 233 N -3.26 1.14 0.68 1.61 -7.23 -0.58 -5.04 120.40 107.71 1j6o s VAL 233 Ca 0.49 -2.06 -0.17 0.00 -1.81 0.00 0.00 61.98 58.43 1j6o s VAL 233 Cb -0.21 -1.98 0.01 0.00 0.56 0.00 0.00 36.38 34.76 1j6o s VAL 233 CO 0.60 -0.63 1.23 -2.84 -0.31 0.00 0.00 175.10 173.14 1j6o s PRO 234 N -3.78 2.43 0.47 4.82 0.02 -1.26 -4.57 135.00 133.14 1j6o s PRO 234 Ca 0.20 1.85 0.19 0.00 0.02 0.00 0.00 61.00 63.26 1j6o s PRO 234 Cb 0.03 -1.86 1.17 0.00 0.02 0.00 0.00 34.50 33.87 1j6o s PRO 234 CO 0.03 -1.63 2.02 0.93 -0.33 0.00 0.00 177.00 178.02 1j6o h GLU 235 N 0.18 0.00 -0.25 5.54 5.08 -1.93 -0.27 114.58 122.93 1j6o h GLU 235 Ca -0.49 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.84 1j6o h GLU 235 Cb 1.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 1j6o h GLU 235 CO 0.52 0.17 0.02 0.00 -1.00 0.00 0.00 179.01 178.71 1j6o h ALA 236 N 1.83 1.58 -0.24 3.43 0.00 -1.98 -0.66 119.26 123.22 1j6o h ALA 236 Ca -0.00 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 1j6o h ALA 236 Cb 0.33 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1j6o h ALA 236 CO 0.02 0.31 -0.55 0.87 0.00 0.00 0.00 179.25 179.91 1j6o h LYS 237 N 0.35 0.72 -0.22 0.00 1.57 -1.39 -1.35 116.57 116.25 1j6o h LYS 237 Ca 0.08 -0.46 -0.05 0.00 -1.87 0.00 0.00 60.65 58.35 1j6o h LYS 237 Cb 0.21 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1j6o h LYS 237 CO 0.00 1.08 -0.06 0.28 -0.57 0.00 0.00 179.45 180.18 1j6o h VAL 238 N 0.55 1.29 -0.26 0.50 2.07 -1.25 -2.47 116.25 116.68 1j6o h VAL 238 Ca 0.01 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1j6o h VAL 238 Cb 1.13 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 1j6o h VAL 238 CO 0.11 0.33 0.14 0.44 0.02 0.00 0.00 177.57 178.62 1j6o h ASP 239 N 0.17 0.32 0.16 0.57 3.32 -1.11 -1.05 116.42 118.79 1j6o h ASP 239 Ca 0.06 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1j6o h ASP 239 Cb 0.53 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1j6o h ASP 239 CO 0.02 0.31 -0.08 -0.08 -1.72 0.00 0.00 179.24 177.69 1j6o h GLU 240 N 0.31 -0.21 -0.03 3.56 4.81 -1.27 -1.62 114.58 120.12 1j6o h GLU 240 Ca 0.09 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1j6o h GLU 240 Cb 0.06 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 1j6o h GLU 240 CO -0.02 -0.13 0.02 0.00 -0.73 0.00 0.00 179.01 178.16 1j6o h ALA 241 N 0.61 0.04 -0.35 2.92 0.00 -1.42 -0.95 119.26 120.11 1j6o h ALA 241 Ca -0.02 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1j6o h ALA 241 Cb 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1j6o h ALA 241 CO 0.04 -0.43 -0.20 1.79 0.00 0.00 0.00 179.25 180.44 1j6o h THR 242 N -0.01 1.26 -0.41 0.00 1.35 -1.21 -0.55 112.91 113.35 1j6o h THR 242 Ca 0.01 -1.26 -0.09 0.00 -0.55 0.00 0.00 66.41 64.52 1j6o h THR 242 Cb 0.05 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 1j6o h THR 242 CO -0.00 0.42 -0.11 0.74 -0.25 0.00 0.00 175.52 176.32 1j6o h THR 243 N 0.60 1.28 -0.53 6.82 2.02 -1.25 0.31 112.91 122.15 1j6o h THR 243 Ca 0.09 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.04 1j6o h THR 243 Cb 0.67 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1j6o h THR 243 CO 0.05 0.41 0.26 -0.08 0.37 0.00 0.00 175.52 176.52 1j6o h GLU 244 N 0.61 0.76 -0.47 6.66 4.81 -0.98 0.24 114.58 126.21 1j6o h GLU 244 Ca 0.10 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1j6o h GLU 244 Cb 0.64 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1j6o h GLU 244 CO 0.04 0.62 0.29 -0.91 -0.73 0.00 0.00 179.01 178.32 1j6o h ASN 245 N 0.71 0.47 -0.47 1.04 2.35 -0.88 -0.53 115.58 118.26 1j6o h ASN 245 Ca 0.18 -0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 1j6o h ASN 245 Cb 0.11 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1j6o h ASN 245 CO -0.02 0.34 -0.08 0.00 -1.65 0.00 0.00 177.43 176.01 1j6o h ALA 246 N 1.20 0.88 -0.33 -0.83 0.00 -0.45 -2.06 119.26 117.67 1j6o h ALA 246 Ca 0.18 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1j6o h ALA 246 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1j6o h ALA 246 CO -0.07 0.64 0.12 0.00 0.00 0.00 0.00 179.25 179.94 1j6o h ARG 247 N 0.84 0.51 -0.52 0.00 3.08 -0.22 -1.71 114.38 116.36 1j6o h ARG 247 Ca 0.14 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1j6o h ARG 247 Cb 0.61 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1j6o h ARG 247 CO 0.04 0.52 0.29 -0.09 -1.07 0.00 0.00 179.97 179.67 1j6o h ARG 248 N 0.39 0.73 0.02 0.04 2.43 -1.01 0.21 114.38 117.19 1j6o h ARG 248 Ca 0.11 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1j6o h ARG 248 Cb 0.22 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1j6o h ARG 248 CO -0.01 0.56 -0.01 0.82 -1.51 0.00 0.00 179.97 179.82 1j6o h ILE 249 N 0.70 1.28 0.02 1.20 2.04 -1.24 -3.31 117.51 118.20 1j6o h ILE 249 Ca 0.18 -0.96 -0.33 0.00 1.00 0.00 0.00 64.86 64.76 1j6o h ILE 249 Cb 0.04 1.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 1j6o h ILE 249 CO -0.03 0.24 -1.94 0.49 0.00 0.00 0.00 178.15 176.91 1j6o n PHE 250 N -4.91 0.79 0.38 1.37 3.72 -0.66 -4.64 117.46 113.52 1j6o n PHE 250 Ca -0.08 0.25 0.11 0.00 -0.05 0.00 0.00 57.45 57.68 1j6o n PHE 250 Cb 0.22 -1.13 -0.15 0.00 -0.94 0.00 0.00 39.48 37.48 1j6o n PHE 250 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1j6o n LEU 251 N -3.08 0.39 -4.75 4.37 4.77 0.04 -4.85 117.00 113.88 1j6o n LEU 251 Ca -0.25 -0.18 -0.41 0.00 -0.03 0.00 0.00 56.01 55.14 1j6o n LEU 251 Cb 1.07 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.13 1j6o n LEU 251 CO 0.43 0.09 1.06 -0.70 -1.33 0.00 0.00 177.39 176.94 1j6o s GLU 252 N -3.32 4.30 0.13 3.23 2.12 -1.05 -4.91 118.70 119.20 1j6o s GLU 252 Ca -0.02 2.26 -0.31 0.00 0.36 0.00 0.00 54.97 57.27 1j6o s GLU 252 Cb 0.15 -3.10 -0.10 0.00 0.26 0.00 0.00 34.13 31.34 1j6o s GLU 252 CO 0.89 -0.34 1.66 0.08 -0.54 0.00 0.00 175.26 177.01 1j6o s VAL 253 N -0.35 2.70 0.06 3.70 1.01 -1.26 -4.99 120.40 121.27 1j6o s VAL 253 Ca 0.56 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.93 1j6o s VAL 253 Cb -0.41 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1j6o s VAL 253 CO 0.46 0.01 -0.01 -0.54 0.00 0.00 0.00 175.10 175.03 1j6o s LYS 254 N 1.99 2.59 0.00 2.72 1.02 -1.26 -5.22 119.74 121.57 1j6o s LYS 254 Ca 0.74 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.94 1j6o s LYS 254 Cb -0.43 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 1j6o s LYS 254 CO 0.33 0.56 0.37 0.39 -0.92 0.00 0.00 175.35 176.08