#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f52 h ALA 2 N 0.00 0.86 0.11 -1.46 0.00 -2.00 -3.24 119.26 113.52 1f52 h ALA 2 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 1f52 h ALA 2 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1f52 h ALA 2 CO 0.00 0.00 -1.35 0.93 0.00 0.00 0.00 179.25 178.83 1f52 h GLU 3 N 0.00 0.23 -0.60 0.00 3.07 -1.99 -2.81 114.58 112.49 1f52 h GLU 3 Ca 0.00 -0.39 -0.04 0.00 -0.50 0.00 0.00 59.36 58.43 1f52 h GLU 3 Cb 0.87 0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.90 1f52 h GLU 3 CO 0.00 1.13 0.20 1.25 -1.40 0.00 0.00 179.01 180.20 1f52 h HIS 4 N 0.06 0.90 -0.08 4.33 6.17 -1.97 -1.97 115.15 122.59 1f52 h HIS 4 Ca -0.17 -0.07 -0.01 0.00 0.71 0.00 0.00 60.37 60.84 1f52 h HIS 4 Cb 1.97 -0.27 -0.00 0.00 2.52 0.00 0.00 27.41 31.63 1f52 h HIS 4 CO 0.06 0.72 0.01 0.28 0.71 0.00 0.00 177.93 179.70 1f52 h VAL 5 N 0.87 1.22 0.00 5.26 2.07 -1.58 -1.40 116.25 122.70 1f52 h VAL 5 Ca 0.20 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1f52 h VAL 5 Cb 0.22 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1f52 h VAL 5 CO -0.01 0.20 -0.02 -0.07 0.02 0.00 0.00 177.57 177.68 1f52 h LEU 6 N -0.12 0.00 0.02 2.57 3.38 -1.18 -1.05 115.31 118.93 1f52 h LEU 6 Ca 0.02 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.72 1f52 h LEU 6 Cb 0.30 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1f52 h LEU 6 CO 0.00 0.02 -1.50 0.71 0.09 0.00 0.00 178.44 177.76 1f52 h THR 7 N 0.00 1.11 -0.02 0.22 1.35 -1.10 -3.26 112.91 111.22 1f52 h THR 7 Ca -0.00 -2.90 -0.07 0.00 -0.55 0.00 0.00 66.41 62.89 1f52 h THR 7 Cb 0.11 2.58 -0.01 0.00 -1.73 0.00 0.00 68.15 69.09 1f52 h THR 7 CO 0.00 0.67 -0.31 0.24 -0.25 0.00 0.00 175.52 175.87 1f52 h MET 8 N 0.01 0.04 -0.59 4.72 2.86 -0.10 0.18 114.93 122.05 1f52 h MET 8 Ca -0.21 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.36 1f52 h MET 8 Cb 1.95 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.58 1f52 h MET 8 CO 0.10 0.35 0.12 -0.07 1.06 0.00 0.00 176.91 178.47 1f52 h LEU 9 N 0.04 0.88 0.15 1.22 3.38 -1.33 -2.08 115.31 117.57 1f52 h LEU 9 Ca 0.00 -0.18 -0.32 0.00 0.09 0.00 0.00 57.88 57.48 1f52 h LEU 9 Cb 0.57 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1f52 h LEU 9 CO 0.04 0.87 -1.54 0.78 0.09 0.00 0.00 178.44 178.68 1f52 h ASN 10 N 0.88 0.50 -0.49 -0.43 4.21 -1.49 -0.81 115.58 117.96 1f52 h ASN 10 Ca 0.19 -0.66 -0.05 0.00 1.21 0.00 0.00 56.30 56.98 1f52 h ASN 10 Cb 0.36 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.37 1f52 h ASN 10 CO 0.00 1.54 0.12 -0.08 -1.29 0.00 0.00 177.43 177.73 1f52 h GLU 11 N 0.09 0.84 -0.40 0.81 4.81 -0.94 -2.78 114.58 117.01 1f52 h GLU 11 Ca -0.26 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1f52 h GLU 11 Cb 2.05 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 31.31 1f52 h GLU 11 CO 0.18 0.76 0.00 0.72 -0.73 0.00 0.00 179.01 179.94 1f52 n HIS 12 N -4.27 0.52 -3.94 0.92 8.25 -0.79 -4.99 115.22 110.93 1f52 n HIS 12 Ca 0.04 -0.37 -0.27 0.00 -0.26 0.00 0.00 57.72 56.85 1f52 n HIS 12 Cb 0.23 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.31 1f52 n HIS 12 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1f52 n GLU 13 N 1.01 -2.71 -2.04 -0.41 1.02 -1.01 -4.85 120.64 111.64 1f52 n GLU 13 Ca 0.16 0.38 -0.42 0.00 -0.02 0.00 0.00 57.16 57.26 1f52 n GLU 13 Cb 0.49 -4.32 -0.03 0.00 -0.02 0.00 0.00 31.44 27.57 1f52 n GLU 13 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1f52 s VAL 14 N -3.90 2.80 -0.12 2.62 1.01 -0.34 -4.72 120.40 117.75 1f52 s VAL 14 Ca 0.09 0.64 0.17 0.00 0.00 0.00 0.00 61.98 62.88 1f52 s VAL 14 Cb -0.04 -3.41 -0.25 0.00 0.00 0.00 0.00 36.38 32.69 1f52 s VAL 14 CO 0.90 0.08 0.20 0.29 0.00 0.00 0.00 175.10 176.57 1f52 n LYS 15 N 2.91 0.89 -4.07 2.72 4.76 0.28 -4.70 118.16 120.97 1f52 n LYS 15 Ca 0.09 -0.07 -0.07 0.00 -2.87 0.00 0.00 58.31 55.38 1f52 n LYS 15 Cb 0.40 -1.46 -0.10 0.00 -1.84 0.00 0.00 35.03 32.04 1f52 n LYS 15 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1f52 s PHE 16 N -2.78 0.47 -0.13 2.13 0.40 -0.98 -0.79 117.98 116.29 1f52 s PHE 16 Ca -0.08 -0.98 0.01 0.00 -0.60 0.00 0.00 56.93 55.28 1f52 s PHE 16 Cb 0.08 -0.35 0.02 0.00 0.51 0.00 0.00 43.02 43.28 1f52 s PHE 16 CO 0.76 -0.36 -0.15 0.08 0.70 0.00 0.00 175.22 176.24 1f52 s VAL 17 N -3.59 1.59 -0.41 -0.44 1.01 0.65 -0.35 120.40 118.85 1f52 s VAL 17 Ca 0.04 -0.67 -0.13 0.00 0.00 0.00 0.00 61.98 61.22 1f52 s VAL 17 Cb 0.06 -1.47 0.04 0.00 0.00 0.00 0.00 36.38 35.01 1f52 s VAL 17 CO -0.09 0.46 0.29 -0.62 0.00 0.00 0.00 175.10 175.14 1f52 s ASP 18 N 1.23 5.95 -0.23 3.32 3.68 0.16 -1.18 116.67 129.60 1f52 s ASP 18 Ca -0.01 -1.09 -0.27 0.00 2.13 0.00 0.00 52.55 53.32 1f52 s ASP 18 Cb -0.14 -2.10 0.00 0.00 -1.45 0.00 0.00 42.92 39.23 1f52 s ASP 18 CO -0.06 -0.48 0.94 -0.76 0.13 0.00 0.00 175.17 174.94 1f52 s LEU 19 N 1.61 4.09 0.12 -1.34 1.02 0.66 -1.27 118.68 123.57 1f52 s LEU 19 Ca 0.04 1.22 0.10 0.00 0.02 0.00 0.00 54.13 55.51 1f52 s LEU 19 Cb -0.21 -3.38 -0.04 0.00 0.02 0.00 0.00 46.19 42.59 1f52 s LEU 19 CO 0.07 -0.59 -0.23 -0.13 0.02 0.00 0.00 176.35 175.48 1f52 s ARG 20 N 3.01 1.56 0.28 1.70 0.52 -0.48 -1.79 118.95 123.75 1f52 s ARG 20 Ca 0.40 -1.28 -0.18 0.00 -0.52 0.00 0.00 55.73 54.15 1f52 s ARG 20 Cb -0.15 -1.99 0.01 0.00 0.52 0.00 0.00 34.95 33.35 1f52 s ARG 20 CO 0.07 0.46 0.64 -0.59 0.02 0.00 0.00 175.30 175.90 1f52 s PHE 21 N -1.09 0.04 0.03 -0.53 -0.12 -0.53 -0.21 117.98 115.58 1f52 s PHE 21 Ca 0.15 -0.48 0.08 0.00 -0.05 0.00 0.00 56.93 56.63 1f52 s PHE 21 Cb -0.10 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.79 1f52 s PHE 21 CO 0.08 -1.19 -0.23 0.99 -0.05 0.00 0.00 175.22 174.82 1f52 s THR 22 N -3.80 2.41 0.74 -4.49 2.01 -1.26 0.19 115.64 111.44 1f52 s THR 22 Ca 0.15 -1.26 0.00 0.00 0.31 0.00 0.00 61.69 60.90 1f52 s THR 22 Cb -0.04 -1.96 0.14 0.00 0.01 0.00 0.00 72.50 70.66 1f52 s THR 22 CO 0.08 0.39 1.01 1.51 -0.69 0.00 0.00 174.62 176.93 1f52 s ASP 23 N -1.22 4.23 0.26 3.53 1.47 -0.92 -4.66 116.67 119.36 1f52 s ASP 23 Ca 0.13 -0.54 -0.03 0.00 1.18 0.00 0.00 52.55 53.28 1f52 s ASP 23 Cb -0.10 0.26 0.39 0.00 -0.34 0.00 0.00 42.92 43.13 1f52 s ASP 23 CO 0.03 -1.96 1.87 0.74 0.68 0.00 0.00 175.17 176.53 1f52 h THR 24 N -0.56 1.08 0.00 2.11 2.02 -1.85 -1.42 112.91 114.28 1f52 h THR 24 Ca -0.34 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 1f52 h THR 24 Cb 1.26 -0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1f52 h THR 24 CO 0.37 0.21 -0.08 0.11 0.37 0.00 0.00 175.52 176.50 1f52 h LYS 25 N 1.13 0.00 0.00 6.66 1.57 -1.94 -3.46 116.57 120.53 1f52 h LYS 25 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1f52 h LYS 25 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1f52 h LYS 25 CO -0.17 0.08 0.00 0.41 -0.57 0.00 0.00 179.45 179.19 1f52 n GLY 26 N -0.29 1.09 3.68 3.86 0.00 -0.54 -4.18 105.19 108.81 1f52 n GLY 26 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1f52 n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1f52 s LYS 27 N -0.36 4.27 0.28 1.61 2.47 -1.26 -4.76 119.74 121.99 1f52 s LYS 27 Ca 0.00 0.67 -0.29 0.00 -1.56 0.00 0.00 55.97 54.79 1f52 s LYS 27 Cb 0.00 -3.54 -0.10 0.00 -1.46 0.00 0.00 37.83 32.73 1f52 s LYS 27 CO 0.00 -0.16 1.42 -2.00 0.16 0.00 0.00 175.35 174.78 1f52 s GLU 28 N 1.61 4.26 0.30 4.03 2.12 -1.26 -2.15 118.70 127.61 1f52 s GLU 28 Ca 0.31 2.33 0.08 0.00 0.36 0.00 0.00 54.97 58.04 1f52 s GLU 28 Cb -0.16 -3.08 -0.06 0.00 0.26 0.00 0.00 34.13 31.09 1f52 s GLU 28 CO 0.12 -0.39 -0.08 -0.65 -0.54 0.00 0.00 175.26 173.71 1f52 s GLN 29 N -0.88 1.63 0.16 4.30 -1.52 0.51 -4.95 119.66 118.91 1f52 s GLN 29 Ca 0.57 -1.82 -0.21 0.00 -1.95 0.00 0.00 55.36 51.94 1f52 s GLN 29 Cb -0.42 -1.36 0.06 0.00 -0.22 0.00 0.00 33.01 31.07 1f52 s GLN 29 CO 0.48 0.09 0.56 -3.38 -0.25 0.00 0.00 175.29 172.79 1f52 s HIS 30 N -2.86 -0.45 -0.05 0.91 -3.43 -1.26 -1.45 115.29 106.70 1f52 s HIS 30 Ca 0.30 0.21 -0.14 0.00 -0.80 0.00 0.00 55.06 54.62 1f52 s HIS 30 Cb 0.03 0.50 0.03 0.00 -1.43 0.00 0.00 32.58 31.71 1f52 s HIS 30 CO 0.13 -0.84 0.33 0.54 -2.00 0.00 0.00 174.74 172.91 1f52 s VAL 31 N -3.77 0.04 0.03 -5.38 0.11 -0.74 -4.99 120.40 105.69 1f52 s VAL 31 Ca 0.02 -0.31 0.09 0.00 -2.93 0.00 0.00 61.98 58.84 1f52 s VAL 31 Cb -0.01 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.23 1f52 s VAL 31 CO -0.12 -0.17 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.34 1f52 s THR 32 N -0.84 2.19 0.05 5.04 2.01 -1.26 -0.24 115.64 122.59 1f52 s THR 32 Ca -0.09 -1.29 0.03 0.00 0.31 0.00 0.00 61.69 60.65 1f52 s THR 32 Cb -0.04 -1.83 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 1f52 s THR 32 CO 0.03 0.42 -0.10 0.27 -0.69 0.00 0.00 174.62 174.56 1f52 s ILE 33 N -0.76 0.75 0.60 1.82 -4.36 -0.33 -4.98 121.20 113.94 1f52 s ILE 33 Ca 0.12 -1.09 -0.19 0.00 -0.26 0.00 0.00 60.65 59.22 1f52 s ILE 33 Cb -0.10 -0.76 -0.03 0.00 1.25 0.00 0.00 42.46 42.81 1f52 s ILE 33 CO 0.01 -0.27 1.28 -2.84 0.24 0.00 0.00 174.94 173.36 1f52 s PRO 34 N -1.51 2.87 0.38 0.37 0.02 -1.26 -0.25 135.00 135.62 1f52 s PRO 34 Ca -0.06 2.03 0.09 0.00 0.02 0.00 0.00 61.00 63.08 1f52 s PRO 34 Cb -0.09 -2.00 0.84 0.00 0.02 0.00 0.00 34.50 33.27 1f52 s PRO 34 CO 0.01 -1.34 1.92 0.00 -0.33 0.00 0.00 177.00 177.27 1f52 h ALA 35 N 0.94 1.84 0.00 -1.55 0.00 -1.24 -1.41 119.26 117.84 1f52 h ALA 35 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1f52 h ALA 35 Cb 1.31 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1f52 h ALA 35 CO 0.55 -0.01 0.00 -2.39 0.00 0.00 0.00 179.25 177.40 1f52 n HIS 36 N -4.50 0.00 1.20 0.00 1.44 -1.26 -0.85 115.22 111.24 1f52 n HIS 36 Ca 0.13 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.97 1f52 n HIS 36 Cb 0.37 -0.21 0.27 0.00 0.12 0.00 0.00 29.99 30.54 1f52 n HIS 36 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1f52 n GLN 37 N -1.21 1.29 -3.07 -1.40 1.13 -0.53 -4.81 117.38 108.77 1f52 n GLN 37 Ca 0.03 -0.90 -0.43 0.00 -1.94 0.00 0.00 57.00 53.76 1f52 n GLN 37 Cb 0.03 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 28.84 1f52 n GLN 37 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1f52 s VAL 38 N -2.33 4.80 0.10 5.09 1.01 -0.03 -4.86 120.40 124.19 1f52 s VAL 38 Ca 0.26 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.64 1f52 s VAL 38 Cb 0.19 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 1f52 s VAL 38 CO 0.47 -0.52 0.06 -0.46 0.00 0.00 0.00 175.10 174.65 1f52 n ASN 39 N 6.30 0.42 -0.15 3.32 0.23 -1.26 -5.04 115.26 119.08 1f52 n ASN 39 Ca -0.00 -1.61 -0.08 0.00 -0.53 0.00 0.00 54.58 52.35 1f52 n ASN 39 Cb 0.48 0.38 0.01 0.00 -2.08 0.00 0.00 39.78 38.57 1f52 n ASN 39 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1f52 h ALA 40 N 1.24 0.58 -0.22 -2.53 0.00 -2.00 -3.06 119.26 113.27 1f52 h ALA 40 Ca -0.08 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1f52 h ALA 40 Cb 0.34 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 1f52 h ALA 40 CO 0.12 0.10 -0.25 0.93 0.00 0.00 0.00 179.25 180.15 1f52 h GLU 41 N 0.59 -0.26 -0.76 0.00 5.08 -1.97 -2.75 114.58 114.51 1f52 h GLU 41 Ca 0.16 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.68 1f52 h GLU 41 Cb 0.04 0.06 -0.14 0.00 0.50 0.00 0.00 28.75 29.21 1f52 h GLU 41 CO -0.03 -0.17 -0.20 0.34 -1.00 0.00 0.00 179.01 177.95 1f52 n PHE 42 N -5.38 0.24 0.10 4.33 -0.00 -1.16 -0.33 117.46 115.26 1f52 n PHE 42 Ca -0.01 0.92 -0.04 0.00 -0.00 0.00 0.00 57.45 58.32 1f52 n PHE 42 Cb 0.29 -0.92 0.11 0.00 -0.00 0.00 0.00 39.48 38.96 1f52 n PHE 42 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 1f52 h PHE 43 N 0.00 0.20 0.06 -5.13 -1.00 -1.58 0.99 116.94 110.48 1f52 h PHE 43 Ca 0.35 -0.08 -0.31 0.00 2.81 0.00 0.00 57.97 60.74 1f52 h PHE 43 Cb 0.54 -0.03 -0.03 0.00 3.61 0.00 0.00 35.95 40.04 1f52 h PHE 43 CO -0.59 0.77 -1.69 0.93 -1.61 0.00 0.00 178.31 176.11 1f52 h GLU 44 N 0.11 0.13 -0.00 1.51 5.08 -0.89 -3.41 114.58 117.11 1f52 h GLU 44 Ca -0.01 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1f52 h GLU 44 Cb 1.18 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1f52 h GLU 44 CO 0.10 0.86 -0.01 -0.85 -1.00 0.00 0.00 179.01 178.11 1f52 n GLU 45 N -3.28 -0.19 0.00 2.33 0.28 0.55 -5.12 120.64 115.21 1f52 n GLU 45 Ca -0.20 -0.62 0.00 0.00 -0.16 0.00 0.00 57.16 56.19 1f52 n GLU 45 Cb 1.04 -1.02 0.00 0.00 1.43 0.00 0.00 31.44 32.89 1f52 n GLU 45 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1f52 n GLY 46 N 0.21 0.67 3.24 -1.84 0.00 0.34 -4.87 105.19 102.94 1f52 n GLY 46 Ca 0.01 -0.88 -0.22 0.00 0.00 0.00 0.00 46.02 44.94 1f52 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f52 s LYS 47 N 0.00 1.05 0.18 1.61 -0.14 -0.77 -4.62 119.74 117.05 1f52 s LYS 47 Ca 0.00 -1.06 -0.17 0.00 -1.36 0.00 0.00 55.97 53.38 1f52 s LYS 47 Cb 0.00 -1.21 -0.08 0.00 -1.68 0.00 0.00 37.83 34.86 1f52 s LYS 47 CO 0.00 0.28 0.63 -1.64 -0.76 0.00 0.00 175.35 173.86 1f52 s MET 48 N -1.76 4.10 0.15 1.68 -1.94 -1.26 -0.43 119.30 119.83 1f52 s MET 48 Ca 0.04 0.66 -0.17 0.00 -1.71 0.00 0.00 55.69 54.51 1f52 s MET 48 Cb -0.10 -2.90 0.03 0.00 2.01 0.00 0.00 34.83 33.88 1f52 s MET 48 CO 0.03 0.44 0.44 -0.59 -0.01 0.00 0.00 175.02 175.33 1f52 s PHE 49 N -1.50 -0.18 -0.27 -0.03 -0.12 -0.56 -4.94 117.98 110.38 1f52 s PHE 49 Ca 0.40 -0.14 -0.29 0.00 -0.05 0.00 0.00 56.93 56.86 1f52 s PHE 49 Cb -0.16 0.30 -0.00 0.00 -0.63 0.00 0.00 43.02 42.53 1f52 s PHE 49 CO 0.20 -0.76 1.33 0.34 -0.05 0.00 0.00 175.22 176.28 1f52 s ASP 50 N -2.82 6.69 0.01 1.98 2.15 -1.26 -1.75 116.67 121.67 1f52 s ASP 50 Ca 0.05 1.34 -0.22 0.00 0.43 0.00 0.00 52.55 54.15 1f52 s ASP 50 Cb 0.01 -2.54 -0.17 0.00 -0.30 0.00 0.00 42.92 39.92 1f52 s ASP 50 CO -0.10 -1.04 1.27 1.23 -0.17 0.00 0.00 175.17 176.36 1f52 h GLY 51 N 10.75 0.30 0.84 2.66 0.00 0.05 -3.29 103.07 114.38 1f52 h GLY 51 Ca -0.27 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1f52 h GLY 51 CO 1.02 0.31 0.41 -1.14 0.00 0.00 0.00 176.54 177.14 1f52 n SER 52 N -4.57 0.21 0.11 0.19 3.41 -1.25 -1.95 113.62 109.77 1f52 n SER 52 Ca -0.07 0.43 -0.01 0.00 -0.26 0.00 0.00 58.87 58.95 1f52 n SER 52 Cb 0.39 -0.33 0.03 0.00 -0.26 0.00 0.00 64.21 64.04 1f52 n SER 52 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1f52 h SER 53 N 0.00 0.00 -3.37 4.04 4.64 -1.87 -3.45 113.55 113.54 1f52 h SER 53 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1f52 h SER 53 Cb 0.82 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.87 1f52 h SER 53 CO 0.00 0.70 0.06 -0.63 -0.87 0.00 0.00 176.83 176.10 1f52 s ILE 54 N -3.05 4.63 0.24 0.95 -1.09 -0.82 -5.03 121.20 117.03 1f52 s ILE 54 Ca 0.01 1.44 -0.30 0.00 -2.23 0.00 0.00 60.65 59.57 1f52 s ILE 54 Cb 0.10 -4.01 -0.11 0.00 -1.58 0.00 0.00 42.46 36.86 1f52 s ILE 54 CO 0.77 0.50 1.54 -0.83 -1.23 0.00 0.00 174.94 175.69 1f52 s GLY 55 N -0.87 2.00 -0.43 6.18 0.00 -1.26 -2.75 107.32 110.20 1f52 s GLY 55 Ca 0.33 1.43 0.00 0.00 0.00 0.00 0.00 44.72 46.48 1f52 s GLY 55 CO 0.22 2.49 0.00 0.61 0.00 0.00 0.00 173.10 176.42 1f52 n GLY 56 N 2.67 0.69 0.00 0.20 0.00 -1.26 -4.62 105.19 102.87 1f52 n GLY 56 Ca 0.09 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1f52 n GLY 56 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1f52 n TRP 57 N -2.84 0.00 -1.84 1.61 7.02 -1.11 -4.92 117.44 115.36 1f52 n TRP 57 Ca -0.04 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.06 1f52 n TRP 57 Cb 0.15 0.00 0.04 0.00 -2.42 0.00 0.00 31.31 29.08 1f52 n TRP 57 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1f52 s LYS 58 N 4.86 3.19 0.00 -0.99 -0.14 -1.26 -4.97 119.74 120.43 1f52 s LYS 58 Ca 0.00 2.17 0.00 0.00 -1.36 0.00 0.00 55.97 56.78 1f52 s LYS 58 Cb 0.00 -2.25 0.00 0.00 -1.68 0.00 0.00 37.83 33.90 1f52 s LYS 58 CO 0.00 -1.13 0.00 0.41 -0.76 0.00 0.00 175.35 173.87 1f52 n GLY 59 N 0.69 1.63 0.37 -3.33 0.00 -1.26 -4.00 105.19 99.29 1f52 n GLY 59 Ca 0.10 -1.71 0.14 0.00 0.00 0.00 0.00 46.02 44.56 1f52 n GLY 59 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1f52 h ILE 60 N 0.00 0.82 0.00 -0.61 -2.65 -1.98 -3.36 117.51 109.74 1f52 h ILE 60 Ca 0.00 -0.14 -0.26 0.00 1.03 0.00 0.00 64.86 65.49 1f52 h ILE 60 Cb 0.00 0.38 -0.05 0.00 -2.05 0.00 0.00 36.82 35.10 1f52 h ILE 60 CO 0.00 0.07 -1.96 0.59 0.03 0.00 0.00 178.15 176.88 1f52 n ASN 61 N -4.47 2.04 -2.68 2.16 4.13 -1.26 -4.74 115.26 110.44 1f52 n ASN 61 Ca 0.13 -0.04 -0.35 0.00 1.68 0.00 0.00 54.58 56.00 1f52 n ASN 61 Cb 0.48 0.38 0.03 0.00 -1.54 0.00 0.00 39.78 39.13 1f52 n ASN 61 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1f52 n GLU 62 N -2.72 2.98 0.02 3.52 4.71 -1.26 -4.89 120.64 123.00 1f52 n GLU 62 Ca -0.26 -3.80 -0.10 0.00 -0.01 0.00 0.00 57.16 52.99 1f52 n GLU 62 Cb 0.90 -2.27 -0.03 0.00 -1.01 0.00 0.00 31.44 29.03 1f52 n GLU 62 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1f52 h SER 63 N 2.72 -0.51 -3.50 1.62 4.64 -1.85 -3.45 113.55 113.21 1f52 h SER 63 Ca 0.49 0.09 -0.52 0.00 -0.47 0.00 0.00 61.79 61.38 1f52 h SER 63 Cb 0.45 0.23 0.02 0.00 -0.31 0.00 0.00 62.40 62.80 1f52 h SER 63 CO 1.26 -0.22 0.58 -1.81 -0.87 0.00 0.00 176.83 175.77 1f52 s ASP 64 N -5.02 7.04 0.23 4.97 1.11 -1.26 0.79 116.67 124.53 1f52 s ASP 64 Ca -0.15 2.30 -0.01 0.00 0.18 0.00 0.00 52.55 54.88 1f52 s ASP 64 Cb 0.10 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 1f52 s ASP 64 CO 0.67 -0.40 0.21 -0.32 1.18 0.00 0.00 175.17 176.51 1f52 s MET 65 N -0.38 1.37 -0.11 8.23 1.75 -0.72 -4.63 119.30 124.82 1f52 s MET 65 Ca 0.53 -1.67 -0.01 0.00 -1.25 0.00 0.00 55.69 53.29 1f52 s MET 65 Cb -0.34 0.31 -0.03 0.00 2.84 0.00 0.00 34.83 37.61 1f52 s MET 65 CO 0.38 -0.48 -0.06 0.08 -0.65 0.00 0.00 175.02 174.29 1f52 s VAL 66 N -3.97 3.73 -0.43 10.11 1.01 -0.59 -1.50 120.40 128.77 1f52 s VAL 66 Ca 0.37 -0.44 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 1f52 s VAL 66 Cb 0.05 -2.57 0.04 0.00 0.00 0.00 0.00 36.38 33.90 1f52 s VAL 66 CO 0.15 0.56 0.36 -0.76 0.00 0.00 0.00 175.10 175.40 1f52 s LEU 67 N -0.29 5.22 -0.43 3.92 1.43 0.43 -0.74 118.68 128.21 1f52 s LEU 67 Ca 0.04 -0.99 -0.13 0.00 -1.03 0.00 0.00 54.13 52.02 1f52 s LEU 67 Cb -0.13 -2.21 0.06 0.00 0.03 0.00 0.00 46.19 43.95 1f52 s LEU 67 CO 0.02 -0.54 0.32 -0.32 0.23 0.00 0.00 176.35 176.06 1f52 s MET 68 N 1.76 2.86 0.28 1.70 1.75 0.43 -1.85 119.30 126.24 1f52 s MET 68 Ca 0.06 -1.27 -0.30 0.00 -1.25 0.00 0.00 55.69 52.93 1f52 s MET 68 Cb -0.20 -3.96 -0.11 0.00 2.84 0.00 0.00 34.83 33.40 1f52 s MET 68 CO 0.10 -0.91 1.60 -1.25 -0.65 0.00 0.00 175.02 173.91 1f52 s PRO 69 N 1.58 4.13 -0.53 4.11 0.04 -1.26 -1.09 135.00 141.98 1f52 s PRO 69 Ca 0.04 2.57 -0.10 0.00 0.04 0.00 0.00 61.00 63.54 1f52 s PRO 69 Cb -0.22 -3.03 0.14 0.00 0.04 0.00 0.00 34.50 31.42 1f52 s PRO 69 CO 0.06 -0.64 0.42 0.34 0.04 0.00 0.00 177.00 177.23 1f52 s ASP 70 N 0.56 5.85 0.48 6.66 -1.08 -0.31 -4.89 116.67 123.95 1f52 s ASP 70 Ca 0.64 -2.06 0.25 0.00 -0.52 0.00 0.00 52.55 50.86 1f52 s ASP 70 Cb -0.48 -2.05 1.35 0.00 -1.46 0.00 0.00 42.92 40.29 1f52 s ASP 70 CO 0.46 -0.68 1.73 0.00 0.52 0.00 0.00 175.17 177.20 1f52 h ALA 71 N 8.32 1.17 0.00 3.66 0.00 -1.88 -1.14 119.26 129.40 1f52 h ALA 71 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1f52 h ALA 71 Cb 1.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1f52 h ALA 71 CO 0.87 -0.17 -0.10 0.66 0.00 0.00 0.00 179.25 180.51 1f52 h SER 72 N 0.00 0.00 0.08 0.00 4.64 -1.93 -3.26 113.55 113.08 1f52 h SER 72 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1f52 h SER 72 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1f52 h SER 72 CO 0.00 0.10 -0.05 0.35 -0.87 0.00 0.00 176.83 176.36 1f52 n THR 73 N -3.18 0.00 -1.68 2.95 -2.24 -0.43 -4.96 114.28 104.75 1f52 n THR 73 Ca 0.02 -0.16 -0.49 0.00 -2.27 0.00 0.00 64.05 61.15 1f52 n THR 73 Cb 0.44 0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.83 1f52 n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f52 n ALA 74 N -0.32 0.77 -3.38 6.98 0.00 -1.23 -4.55 120.51 118.78 1f52 n ALA 74 Ca 0.18 0.34 -0.14 0.00 0.00 0.00 0.00 53.44 53.82 1f52 n ALA 74 Cb 0.30 -2.42 -0.09 0.00 0.00 0.00 0.00 19.45 17.24 1f52 n ALA 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1f52 s VAL 75 N 3.24 0.01 0.30 0.00 0.11 -0.56 -4.98 120.40 118.52 1f52 s VAL 75 Ca 0.90 -0.04 -0.29 0.00 -2.93 0.00 0.00 61.98 59.62 1f52 s VAL 75 Cb -0.74 -0.69 -0.10 0.00 -1.53 0.00 0.00 36.38 33.31 1f52 s VAL 75 CO 0.50 -0.02 1.23 -0.63 -3.33 0.00 0.00 175.10 172.84 1f52 s ILE 76 N 0.02 3.06 -0.12 7.04 -1.09 -1.26 0.62 121.20 129.47 1f52 s ILE 76 Ca -0.02 1.05 -0.26 0.00 -2.23 0.00 0.00 60.65 59.19 1f52 s ILE 76 Cb -0.03 -3.67 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1f52 s ILE 76 CO 0.02 0.24 0.86 -0.62 -1.23 0.00 0.00 174.94 174.20 1f52 s ASP 77 N -0.57 7.06 0.00 3.58 2.15 -0.38 -4.84 116.67 123.66 1f52 s ASP 77 Ca 0.48 1.29 0.30 0.00 0.43 0.00 0.00 52.55 55.05 1f52 s ASP 77 Cb -0.36 -2.48 1.41 0.00 -0.30 0.00 0.00 42.92 41.19 1f52 s ASP 77 CO 0.47 -0.34 1.95 -0.81 -0.17 0.00 0.00 175.17 176.27 1f52 n PRO 78 N 4.79 1.09 -0.06 4.34 -0.04 -1.26 -4.26 135.00 139.60 1f52 n PRO 78 Ca 0.04 -0.37 -0.09 0.00 -0.04 0.00 0.00 63.50 63.05 1f52 n PRO 78 Cb 0.49 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 1f52 n PRO 78 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1f52 n PHE 79 N -0.63 0.00 -1.64 0.54 3.72 -1.26 -5.03 117.46 113.16 1f52 n PHE 79 Ca 0.19 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.19 1f52 n PHE 79 Cb 0.24 -0.45 0.02 0.00 -0.94 0.00 0.00 39.48 38.35 1f52 n PHE 79 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1f52 n PHE 80 N -2.89 1.37 -0.02 1.38 0.99 -1.26 -4.92 117.46 112.10 1f52 n PHE 80 Ca -0.21 0.50 -0.07 0.00 -0.00 0.00 0.00 57.45 57.67 1f52 n PHE 80 Cb 0.72 -2.25 0.11 0.00 -1.00 0.00 0.00 39.48 37.06 1f52 n PHE 80 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1f52 h ALA 81 N 1.39 0.87 -2.91 4.37 0.00 -1.95 -3.43 119.26 117.60 1f52 h ALA 81 Ca -0.47 -0.42 -0.66 0.00 0.00 0.00 0.00 54.91 53.36 1f52 h ALA 81 Cb 1.33 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.90 1f52 h ALA 81 CO 0.56 0.63 -0.52 -0.51 0.00 0.00 0.00 179.25 179.41 1f52 s ASP 82 N -6.83 6.01 -0.22 0.00 1.01 -1.26 -5.03 116.67 110.35 1f52 s ASP 82 Ca -0.08 0.34 -0.36 0.00 0.71 0.00 0.00 52.55 53.16 1f52 s ASP 82 Cb 0.13 -1.90 -0.12 0.00 1.01 0.00 0.00 42.92 42.03 1f52 s ASP 82 CO 0.82 0.37 1.94 -0.24 0.21 0.00 0.00 175.17 178.28 1f52 n SER 83 N 2.23 2.81 -3.90 0.27 2.88 -1.26 -4.87 113.62 111.78 1f52 n SER 83 Ca -0.19 0.82 -0.12 0.00 -1.33 0.00 0.00 58.87 58.05 1f52 n SER 83 Cb 0.54 -1.29 -0.14 0.00 -0.75 0.00 0.00 64.21 62.58 1f52 n SER 83 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1f52 s THR 84 N 4.96 0.09 -0.18 2.46 -1.32 -1.26 -0.55 115.64 119.83 1f52 s THR 84 Ca 0.99 -0.17 -0.07 0.00 -1.21 0.00 0.00 61.69 61.23 1f52 s THR 84 Cb -0.83 -0.10 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1f52 s THR 84 CO 0.54 -0.05 0.05 -0.22 -2.21 0.00 0.00 174.62 172.73 1f52 s LEU 85 N -0.23 3.72 -0.05 9.08 2.96 0.52 -1.25 118.68 133.42 1f52 s LEU 85 Ca -0.02 0.03 -0.17 0.00 -0.22 0.00 0.00 54.13 53.75 1f52 s LEU 85 Cb -0.02 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 1f52 s LEU 85 CO -0.00 0.16 0.46 -0.63 -1.32 0.00 0.00 176.35 175.02 1f52 s ILE 86 N 0.47 5.07 -0.12 6.68 1.01 0.20 0.41 121.20 134.93 1f52 s ILE 86 Ca 0.02 0.95 -0.02 0.00 0.00 0.00 0.00 60.65 61.60 1f52 s ILE 86 Cb -0.13 -3.79 0.04 0.00 0.01 0.00 0.00 42.46 38.59 1f52 s ILE 86 CO 0.01 0.44 0.03 -0.63 0.00 0.00 0.00 174.94 174.79 1f52 s ILE 87 N -0.18 0.30 0.49 2.92 1.01 -0.40 -1.49 121.20 123.85 1f52 s ILE 87 Ca 0.25 -0.07 -0.21 0.00 0.00 0.00 0.00 60.65 60.62 1f52 s ILE 87 Cb -0.16 -0.64 -0.07 0.00 0.01 0.00 0.00 42.46 41.60 1f52 s ILE 87 CO 0.12 0.05 1.12 -0.60 0.00 0.00 0.00 174.94 175.64 1f52 s ARG 88 N 1.98 3.67 0.12 2.79 3.52 -1.26 -1.38 118.95 128.39 1f52 s ARG 88 Ca 0.03 1.64 0.04 0.00 -0.13 0.00 0.00 55.73 57.31 1f52 s ARG 88 Cb -0.14 -2.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.97 1f52 s ARG 88 CO -0.06 -0.60 -0.10 0.00 -0.81 0.00 0.00 175.30 173.73 1f52 s ASP 90 N -2.75 5.41 -0.30 0.00 1.01 -0.25 -4.66 116.67 115.13 1f52 s ASP 90 Ca 0.10 -0.34 -0.08 0.00 0.71 0.00 0.00 52.55 52.94 1f52 s ASP 90 Cb -0.01 -1.26 -0.00 0.00 1.01 0.00 0.00 42.92 42.66 1f52 s ASP 90 CO 0.00 -0.12 0.12 -0.63 0.21 0.00 0.00 175.17 174.75 1f52 s ILE 91 N -2.19 4.34 0.14 0.77 -1.09 -1.26 -0.43 121.20 121.47 1f52 s ILE 91 Ca 0.35 -0.52 0.07 0.00 -2.23 0.00 0.00 60.65 58.32 1f52 s ILE 91 Cb -0.07 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 1f52 s ILE 91 CO 0.25 0.08 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.26 1f52 s LEU 92 N 1.57 3.30 0.21 2.97 1.43 0.08 -0.74 118.68 127.50 1f52 s LEU 92 Ca 0.04 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 1f52 s LEU 92 Cb -0.17 -2.00 -0.08 0.00 0.03 0.00 0.00 46.19 43.97 1f52 s LEU 92 CO 0.05 0.13 1.13 -0.70 0.23 0.00 0.00 176.35 177.18 1f52 s GLU 93 N -2.63 4.58 0.49 1.70 2.56 -1.26 -1.53 118.70 122.60 1f52 s GLU 93 Ca 0.26 1.79 -0.23 0.00 0.00 0.00 0.00 54.97 56.79 1f52 s GLU 93 Cb -0.10 -3.24 -0.06 0.00 2.00 0.00 0.00 34.13 32.72 1f52 s GLU 93 CO 0.18 0.07 1.28 -2.14 -0.56 0.00 0.00 175.26 174.08 1f52 s PRO 94 N -0.66 3.52 0.00 4.30 0.02 -1.26 0.16 135.00 141.07 1f52 s PRO 94 Ca 0.49 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1f52 s PRO 94 Cb -0.31 -2.40 0.00 0.00 0.02 0.00 0.00 34.50 31.81 1f52 s PRO 94 CO 0.37 -0.83 0.00 0.41 -0.33 0.00 0.00 177.00 176.62 1f52 n GLY 95 N 0.60 2.02 0.26 0.52 0.00 -1.26 -4.27 105.19 103.07 1f52 n GLY 95 Ca 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.14 1f52 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f52 h THR 96 N 0.00 1.09 -6.35 2.61 1.03 -1.99 -3.45 112.91 105.83 1f52 h THR 96 Ca 0.00 -0.31 -0.49 0.00 -0.01 0.00 0.00 66.41 65.60 1f52 h THR 96 Cb 0.00 0.95 -0.08 0.00 -1.07 0.00 0.00 68.15 67.94 1f52 h THR 96 CO 0.00 0.11 -0.76 0.18 -0.01 0.00 0.00 175.52 175.03 1f52 n LEU 97 N -4.44 -2.27 -0.06 0.00 4.32 0.12 -4.91 117.00 109.76 1f52 n LEU 97 Ca -0.01 -0.81 -0.08 0.00 -0.02 0.00 0.00 56.01 55.10 1f52 n LEU 97 Cb 0.14 -2.42 -0.06 0.00 -1.62 0.00 0.00 43.42 39.46 1f52 n LEU 97 CO 0.36 0.40 0.13 -0.61 -1.22 0.00 0.00 177.39 176.45 1f52 h GLN 98 N -1.87 0.00 0.00 3.23 5.75 -1.89 -3.45 115.11 116.88 1f52 h GLN 98 Ca -0.57 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 57.93 1f52 h GLN 98 Cb 1.37 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.92 1f52 h GLN 98 CO 0.69 0.49 0.00 0.41 -2.65 0.00 0.00 178.83 177.78 1f52 n GLY 99 N 1.68 2.74 3.63 2.39 0.00 -1.26 -4.86 105.19 109.51 1f52 n GLY 99 Ca -0.06 -0.44 -0.48 0.00 0.00 0.00 0.00 46.02 45.04 1f52 n GLY 99 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1f52 n TYR 100 N 0.00 1.87 -0.19 1.61 9.36 0.08 -4.75 117.16 125.15 1f52 n TYR 100 Ca 0.00 0.48 0.10 0.00 3.32 0.00 0.00 57.90 61.81 1f52 n TYR 100 Cb 0.00 -2.42 0.41 0.00 -0.63 0.00 0.00 39.34 36.70 1f52 n TYR 100 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1f52 h ASP 101 N 4.62 0.57 -0.02 2.98 3.45 -1.98 -1.81 116.42 124.24 1f52 h ASP 101 Ca -0.45 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.03 1f52 h ASP 101 Cb 1.30 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 1f52 h ASP 101 CO 0.79 0.33 0.00 0.54 -1.57 0.00 0.00 179.24 179.33 1f52 n ARG 102 N -4.50 1.80 -2.60 3.56 1.74 -1.26 -4.75 116.66 110.66 1f52 n ARG 102 Ca 0.13 -1.17 -0.43 0.00 -0.77 0.00 0.00 57.85 55.61 1f52 n ARG 102 Cb 0.37 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.32 1f52 n ARG 102 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1f52 s ASP 103 N -2.00 6.74 0.55 0.55 2.15 -0.68 -4.74 116.67 119.24 1f52 s ASP 103 Ca 0.36 0.74 0.24 0.00 0.43 0.00 0.00 52.55 54.32 1f52 s ASP 103 Cb 0.21 -2.55 1.47 0.00 -0.30 0.00 0.00 42.92 41.75 1f52 s ASP 103 CO 0.33 -1.11 2.11 -0.65 -0.17 0.00 0.00 175.17 175.68 1f52 h PRO 104 N 8.84 0.00 0.14 4.34 0.11 -1.87 -0.39 132.00 143.17 1f52 h PRO 104 Ca -0.22 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.60 1f52 h PRO 104 Cb 1.06 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.19 1f52 h PRO 104 CO 1.09 0.00 -1.27 -0.09 -0.21 0.00 0.00 178.00 177.52 1f52 h ARG 105 N 0.00 0.40 -0.64 1.05 2.43 -1.91 -2.44 114.38 113.28 1f52 h ARG 105 Ca 0.09 -0.63 -0.04 0.00 -0.81 0.00 0.00 59.98 58.60 1f52 h ARG 105 Cb 0.41 0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 1f52 h ARG 105 CO -0.00 1.28 0.26 0.77 -1.51 0.00 0.00 179.97 180.77 1f52 h SER 106 N 0.14 0.88 -0.93 -3.80 0.02 -1.54 -0.87 113.55 107.45 1f52 h SER 106 Ca -0.17 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1f52 h SER 106 Cb 1.97 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 64.23 1f52 h SER 106 CO 0.22 0.81 0.57 0.40 -1.14 0.00 0.00 176.83 177.69 1f52 h ILE 107 N 0.90 1.25 -0.24 3.27 2.04 -1.14 0.14 117.51 123.73 1f52 h ILE 107 Ca 0.21 -0.54 -0.15 0.00 1.00 0.00 0.00 64.86 65.38 1f52 h ILE 107 Cb 0.21 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1f52 h ILE 107 CO -0.02 0.26 -0.47 0.00 0.00 0.00 0.00 178.15 177.93 1f52 h ALA 108 N 1.31 0.73 -0.34 1.87 0.00 -1.03 -2.15 119.26 119.65 1f52 h ALA 108 Ca 0.33 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1f52 h ALA 108 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1f52 h ALA 108 CO -0.06 0.67 -0.02 0.87 0.00 0.00 0.00 179.25 180.70 1f52 h LYS 109 N 0.50 0.62 -0.92 0.00 1.57 -0.45 -2.39 116.57 115.50 1f52 h LYS 109 Ca 0.03 -0.21 0.10 0.00 -1.87 0.00 0.00 60.65 58.70 1f52 h LYS 109 Cb 1.01 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 33.20 1f52 h LYS 109 CO 0.09 0.76 0.59 0.00 -0.57 0.00 0.00 179.45 180.33 1f52 h ARG 110 N 0.43 0.88 -0.14 3.15 3.08 -0.61 0.70 114.38 121.86 1f52 h ARG 110 Ca 0.09 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 1f52 h ARG 110 Cb 0.49 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1f52 h ARG 110 CO 0.02 0.58 -0.42 0.00 -1.07 0.00 0.00 179.97 179.09 1f52 h ALA 111 N 1.55 1.03 -0.05 0.04 0.00 -1.13 -0.46 119.26 120.24 1f52 h ALA 111 Ca 0.44 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1f52 h ALA 111 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1f52 h ALA 111 CO -0.20 0.61 -0.70 0.93 0.00 0.00 0.00 179.25 179.90 1f52 h GLU 112 N 0.26 0.24 0.51 0.00 5.08 -0.42 -2.75 114.58 117.50 1f52 h GLU 112 Ca 0.02 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 1f52 h GLU 112 Cb 0.85 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1f52 h GLU 112 CO 0.07 0.84 -0.24 -0.44 -1.00 0.00 0.00 179.01 178.24 1f52 h ASP 113 N 0.17 -0.58 -0.68 1.42 3.32 -0.81 -2.81 116.42 116.45 1f52 h ASP 113 Ca -0.02 -0.06 0.20 0.00 0.02 0.00 0.00 57.03 57.17 1f52 h ASP 113 Cb 1.24 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.92 1f52 h ASP 113 CO 0.11 -0.27 0.54 0.22 -1.72 0.00 0.00 179.24 178.11 1f52 h TYR 114 N -0.89 0.00 0.33 4.55 5.03 -1.10 0.39 116.97 125.28 1f52 h TYR 114 Ca -0.07 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.22 1f52 h TYR 114 Cb 0.60 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.88 1f52 h TYR 114 CO -0.00 0.00 -0.16 1.25 -1.32 0.00 0.00 178.16 177.93 1f52 h LEU 115 N 0.00 -0.37 -0.92 2.82 6.46 -1.24 -1.76 115.31 120.30 1f52 h LEU 115 Ca 0.33 -0.14 0.03 0.00 -0.12 0.00 0.00 57.88 57.97 1f52 h LEU 115 Cb 1.39 0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 41.37 1f52 h LEU 115 CO -0.00 -0.05 0.60 0.03 -0.62 0.00 0.00 178.44 178.40 1f52 h ARG 116 N -0.72 1.16 -0.01 1.25 3.08 -0.90 -2.84 114.38 115.40 1f52 h ARG 116 Ca -0.05 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1f52 h ARG 116 Cb 0.49 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1f52 h ARG 116 CO 0.07 0.77 -0.07 0.00 -1.07 0.00 0.00 179.97 179.67 1f52 h ALA 117 N 1.37 -0.06 0.00 0.04 0.00 -0.89 -0.03 119.26 119.69 1f52 h ALA 117 Ca 0.36 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1f52 h ALA 117 Cb -0.05 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1f52 h ALA 117 CO -0.10 -0.56 0.00 0.25 0.00 0.00 0.00 179.25 178.84 1f52 n THR 118 N -5.19 0.99 -0.89 0.00 -2.24 -0.67 -4.81 114.28 101.46 1f52 n THR 118 Ca -0.06 0.58 0.00 0.00 -2.27 0.00 0.00 64.05 62.31 1f52 n THR 118 Cb 0.12 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.78 1f52 n THR 118 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f52 n GLY 119 N -0.91 0.36 0.30 3.38 0.00 -0.03 -4.86 105.19 103.44 1f52 n GLY 119 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1f52 n GLY 119 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1f52 h ILE 120 N 0.00 1.13 -2.33 -0.61 2.04 -1.80 -3.46 117.51 112.48 1f52 h ILE 120 Ca 0.00 -0.33 0.18 0.00 1.00 0.00 0.00 64.86 65.71 1f52 h ILE 120 Cb 0.28 0.60 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 1f52 h ILE 120 CO 0.00 0.14 0.49 0.00 0.00 0.00 0.00 178.15 178.78 1f52 s ALA 121 N -5.37 -1.66 -0.43 1.87 0.00 -1.26 -4.95 121.76 109.96 1f52 s ALA 121 Ca -0.08 0.13 0.12 0.00 0.00 0.00 0.00 51.96 52.13 1f52 s ALA 121 Cb 0.17 0.64 -0.14 0.00 0.00 0.00 0.00 23.12 23.79 1f52 s ALA 121 CO 0.74 -1.04 0.44 -0.40 0.00 0.00 0.00 175.76 175.50 1f52 n ASP 122 N -0.47 0.93 -3.71 0.00 5.68 0.96 -3.51 116.55 116.44 1f52 n ASP 122 Ca -0.06 -0.60 -0.14 0.00 -0.50 0.00 0.00 54.79 53.49 1f52 n ASP 122 Cb 0.61 1.12 -0.09 0.00 -1.14 0.00 0.00 41.12 41.62 1f52 n ASP 122 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1f52 s THR 123 N -2.26 0.02 -0.09 2.12 -4.23 -1.04 -4.76 115.64 105.39 1f52 s THR 123 Ca 0.02 -0.15 -0.01 0.00 -1.18 0.00 0.00 61.69 60.37 1f52 s THR 123 Cb 0.09 -0.68 -0.03 0.00 1.34 0.00 0.00 72.50 73.22 1f52 s THR 123 CO 0.48 -0.08 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.75 1f52 s VAL 124 N -0.45 3.99 -0.19 2.29 1.01 -1.26 -1.88 120.40 123.91 1f52 s VAL 124 Ca -0.06 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 1f52 s VAL 124 Cb -0.03 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 1f52 s VAL 124 CO 0.03 0.58 -0.07 -0.76 0.00 0.00 0.00 175.10 174.88 1f52 s LEU 125 N -0.64 2.87 -0.11 3.92 1.02 -0.10 -1.69 118.68 123.95 1f52 s LEU 125 Ca 0.10 -0.34 0.03 0.00 0.02 0.00 0.00 54.13 53.93 1f52 s LEU 125 Cb -0.12 -1.70 -0.00 0.00 0.02 0.00 0.00 46.19 44.39 1f52 s LEU 125 CO 0.02 0.06 -0.21 -0.36 0.02 0.00 0.00 176.35 175.87 1f52 s PHE 126 N 1.01 2.63 -0.56 0.29 0.40 -0.59 -2.57 117.98 118.58 1f52 s PHE 126 Ca -0.00 -0.98 0.04 0.00 -0.60 0.00 0.00 56.93 55.39 1f52 s PHE 126 Cb -0.15 -1.75 0.17 0.00 0.51 0.00 0.00 43.02 41.80 1f52 s PHE 126 CO -0.00 -0.39 0.42 0.20 0.70 0.00 0.00 175.22 176.15 1f52 s GLY 127 N 0.39 2.11 0.45 4.36 0.00 0.35 -2.12 107.32 112.85 1f52 s GLY 127 Ca -0.16 -3.18 -0.19 0.00 0.00 0.00 0.00 44.72 41.19 1f52 s GLY 127 CO 0.07 1.58 0.95 2.56 0.00 0.00 0.00 173.10 178.27 1f52 s PRO 128 N -0.73 4.14 -0.63 2.90 0.04 -1.26 -1.66 135.00 137.79 1f52 s PRO 128 Ca 0.29 1.05 0.05 0.00 0.04 0.00 0.00 61.00 62.43 1f52 s PRO 128 Cb -0.01 -2.18 0.20 0.00 0.04 0.00 0.00 34.50 32.56 1f52 s PRO 128 CO -0.18 -0.09 0.57 0.39 0.04 0.00 0.00 177.00 177.73 1f52 n GLU 129 N -0.91 1.85 -2.43 4.56 1.02 0.54 -4.71 120.64 120.56 1f52 n GLU 129 Ca 0.07 -4.34 -0.41 0.00 -0.02 0.00 0.00 57.16 52.46 1f52 n GLU 129 Cb 0.54 -2.14 -0.04 0.00 -0.02 0.00 0.00 31.44 29.79 1f52 n GLU 129 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1f52 s PRO 130 N -1.67 4.53 0.28 3.49 0.04 -1.26 -3.74 135.00 136.67 1f52 s PRO 130 Ca 0.32 1.82 0.07 0.00 0.04 0.00 0.00 61.00 63.25 1f52 s PRO 130 Cb 0.05 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 31.31 1f52 s PRO 130 CO -0.11 -0.02 0.21 -1.21 0.04 0.00 0.00 177.00 175.91 1f52 s GLU 131 N -0.36 2.79 0.28 4.56 2.02 -0.97 -4.41 118.70 122.61 1f52 s GLU 131 Ca 0.51 -1.18 -0.17 0.00 0.02 0.00 0.00 54.97 54.15 1f52 s GLU 131 Cb -0.31 -2.49 0.02 0.00 0.10 0.00 0.00 34.13 31.44 1f52 s GLU 131 CO 0.36 0.29 0.64 -0.59 0.02 0.00 0.00 175.26 175.99 1f52 s PHE 132 N -2.22 0.06 0.05 1.61 -0.71 -0.61 -4.75 117.98 111.42 1f52 s PHE 132 Ca 0.35 -0.51 0.08 0.00 -1.04 0.00 0.00 56.93 55.82 1f52 s PHE 132 Cb -0.07 0.53 -0.03 0.00 -1.21 0.00 0.00 43.02 42.24 1f52 s PHE 132 CO 0.25 -1.20 -0.22 -0.06 -1.34 0.00 0.00 175.22 172.65 1f52 s PHE 133 N -3.74 2.45 -0.23 3.49 0.40 -0.76 -0.08 117.98 119.50 1f52 s PHE 133 Ca 0.16 -0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1f52 s PHE 133 Cb -0.04 -1.42 0.04 0.00 0.51 0.00 0.00 43.02 42.11 1f52 s PHE 133 CO 0.09 0.21 -0.13 -0.51 0.70 0.00 0.00 175.22 175.58 1f52 s LEU 134 N -1.41 2.98 0.47 -0.37 1.43 0.60 -1.32 118.68 121.06 1f52 s LEU 134 Ca 0.13 -1.06 0.05 0.00 -1.03 0.00 0.00 54.13 52.22 1f52 s LEU 134 Cb -0.10 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.54 1f52 s LEU 134 CO 0.04 -0.12 0.15 -0.36 0.23 0.00 0.00 176.35 176.30 1f52 s PHE 135 N 1.21 2.13 -0.16 0.29 2.99 0.01 -4.30 117.98 120.14 1f52 s PHE 135 Ca -0.03 -0.78 0.08 0.00 0.00 0.00 0.00 56.93 56.20 1f52 s PHE 135 Cb -0.17 -1.82 -0.15 0.00 0.00 0.00 0.00 43.02 40.88 1f52 s PHE 135 CO -0.07 0.08 -0.05 -0.25 -0.00 0.00 0.00 175.22 174.92 1f52 n ASP 136 N -1.34 1.94 -3.77 1.36 10.43 0.35 -1.06 116.55 124.47 1f52 n ASP 136 Ca -0.08 -0.05 -0.13 0.00 2.57 0.00 0.00 54.79 57.11 1f52 n ASP 136 Cb 0.66 0.32 -0.14 0.00 1.84 0.00 0.00 41.12 43.80 1f52 n ASP 136 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1f52 s ASP 137 N -5.27 -0.14 -0.05 -2.24 2.15 -0.46 -4.78 116.67 105.88 1f52 s ASP 137 Ca -0.16 0.33 -0.01 0.00 0.43 0.00 0.00 52.55 53.14 1f52 s ASP 137 Cb 0.05 0.25 0.03 0.00 -0.30 0.00 0.00 42.92 42.95 1f52 s ASP 137 CO 0.52 -0.12 0.02 -0.51 -0.17 0.00 0.00 175.17 174.91 1f52 s ILE 138 N 0.86 0.13 -0.02 4.11 1.10 -1.26 -0.76 121.20 125.36 1f52 s ILE 138 Ca -0.06 0.24 0.03 0.00 -0.51 0.00 0.00 60.65 60.34 1f52 s ILE 138 Cb -0.08 -0.31 -0.00 0.00 0.15 0.00 0.00 42.46 42.21 1f52 s ILE 138 CO -0.04 0.20 -0.10 -0.13 -2.11 0.00 0.00 174.94 172.76 1f52 s ARG 139 N 1.81 0.92 0.15 3.50 0.52 -0.70 -5.01 118.95 120.14 1f52 s ARG 139 Ca 0.01 -0.35 -0.24 0.00 -0.52 0.00 0.00 55.73 54.63 1f52 s ARG 139 Cb -0.12 -0.87 0.06 0.00 0.52 0.00 0.00 34.95 34.54 1f52 s ARG 139 CO -0.03 0.17 0.78 -0.59 0.02 0.00 0.00 175.30 175.64 1f52 s PHE 140 N -0.03 -0.32 -0.09 -0.53 -0.12 -1.26 -0.15 117.98 115.48 1f52 s PHE 140 Ca 0.00 0.05 -0.32 0.00 -0.05 0.00 0.00 56.93 56.61 1f52 s PHE 140 Cb -0.06 0.61 0.14 0.00 -0.63 0.00 0.00 43.02 43.07 1f52 s PHE 140 CO 0.00 -0.86 1.38 0.20 -0.05 0.00 0.00 175.22 175.89 1f52 s GLY 141 N -2.77 -0.44 -0.29 1.99 0.00 -0.72 -4.97 107.32 100.12 1f52 s GLY 141 Ca 0.07 0.96 -0.15 0.00 0.00 0.00 0.00 44.72 45.60 1f52 s GLY 141 CO -0.04 0.20 0.76 0.00 0.00 0.00 0.00 173.10 174.02 1f52 s ALA 142 N -2.18 -2.03 0.21 3.20 0.00 -1.26 -1.18 121.76 118.52 1f52 s ALA 142 Ca 0.14 2.35 0.01 0.00 0.00 0.00 0.00 51.96 54.47 1f52 s ALA 142 Cb 0.06 -1.57 -0.00 0.00 0.00 0.00 0.00 23.12 21.61 1f52 s ALA 142 CO -0.05 -0.48 0.25 -1.13 0.00 0.00 0.00 175.76 174.34 1f52 n SER 143 N 4.39 -0.67 -0.20 0.00 3.41 -0.02 -4.99 113.62 115.54 1f52 n SER 143 Ca -0.18 -2.22 0.04 0.00 -0.26 0.00 0.00 58.87 56.25 1f52 n SER 143 Cb 0.57 1.34 0.30 0.00 -0.26 0.00 0.00 64.21 66.16 1f52 n SER 143 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1f52 h ILE 144 N 1.63 1.10 -0.18 -1.33 2.10 -2.05 -2.47 117.51 116.29 1f52 h ILE 144 Ca -0.16 -0.30 0.00 0.00 1.08 0.00 0.00 64.86 65.48 1f52 h ILE 144 Cb 0.72 0.14 0.00 0.00 -1.09 0.00 0.00 36.82 36.60 1f52 h ILE 144 CO 0.22 0.16 0.00 -1.54 -1.08 0.00 0.00 178.15 175.91 1f52 n SER 145 N -4.46 1.34 0.00 2.19 3.41 -1.26 -4.99 113.62 109.85 1f52 n SER 145 Ca 0.10 -1.78 0.00 0.00 -0.26 0.00 0.00 58.87 56.93 1f52 n SER 145 Cb 0.14 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1f52 n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f52 n GLY 146 N 1.01 -0.46 3.58 5.00 0.00 -0.93 -5.16 105.19 108.23 1f52 n GLY 146 Ca 0.13 -1.33 -0.06 0.00 0.00 0.00 0.00 46.02 44.77 1f52 n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f52 s SER 147 N -4.00 -0.25 0.04 1.61 1.04 -1.26 -0.84 113.70 110.04 1f52 s SER 147 Ca 0.00 -0.08 -0.28 0.00 0.48 0.00 0.00 55.95 56.06 1f52 s SER 147 Cb 0.00 0.33 0.09 0.00 0.10 0.00 0.00 66.02 66.54 1f52 s SER 147 CO 0.00 -0.55 1.04 -1.38 0.98 0.00 0.00 173.24 173.32 1f52 s HIS 148 N -2.92 -0.17 -0.17 5.02 -3.43 -0.33 -4.92 115.29 108.38 1f52 s HIS 148 Ca 0.08 -0.02 -0.09 0.00 -0.80 0.00 0.00 55.06 54.22 1f52 s HIS 148 Cb -0.01 0.58 0.06 0.00 -1.43 0.00 0.00 32.58 31.78 1f52 s HIS 148 CO -0.06 -0.57 0.40 0.54 -2.00 0.00 0.00 174.74 173.05 1f52 s VAL 149 N -2.97 -0.02 -0.09 -5.38 0.11 -1.26 -1.75 120.40 109.03 1f52 s VAL 149 Ca 0.10 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 1f52 s VAL 149 Cb 0.00 -0.59 0.02 0.00 -1.53 0.00 0.00 36.38 34.28 1f52 s VAL 149 CO -0.03 0.04 -0.08 0.00 -3.33 0.00 0.00 175.10 171.70 1f52 s ALA 150 N 1.32 1.22 0.01 1.54 0.00 0.79 -5.00 121.76 121.64 1f52 s ALA 150 Ca -0.09 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.45 1f52 s ALA 150 Cb -0.08 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 1f52 s ALA 150 CO -0.12 -0.22 -0.04 0.42 0.00 0.00 0.00 175.76 175.80 1f52 s ILE 151 N 1.33 3.84 -0.15 0.00 1.01 -1.26 -1.72 121.20 124.25 1f52 s ILE 151 Ca -0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 60.65 59.77 1f52 s ILE 151 Cb -0.14 -2.70 0.04 0.00 0.01 0.00 0.00 42.46 39.68 1f52 s ILE 151 CO -0.04 0.37 0.40 -0.62 0.00 0.00 0.00 174.94 175.05 1f52 s ASP 152 N -1.52 -0.43 -0.03 3.58 2.15 0.06 -5.00 116.67 115.48 1f52 s ASP 152 Ca 0.18 0.81 -0.21 0.00 0.43 0.00 0.00 52.55 53.76 1f52 s ASP 152 Cb -0.11 0.80 0.04 0.00 -0.30 0.00 0.00 42.92 43.35 1f52 s ASP 152 CO 0.09 -0.15 0.46 -0.62 -0.17 0.00 0.00 175.17 174.79 1f52 s ASP 153 N 0.41 -0.38 0.64 -0.34 2.15 -1.26 -0.49 116.67 117.39 1f52 s ASP 153 Ca -0.02 0.34 0.42 0.00 0.43 0.00 0.00 52.55 53.72 1f52 s ASP 153 Cb -0.04 0.41 2.17 0.00 -0.30 0.00 0.00 42.92 45.16 1f52 s ASP 153 CO -0.02 -0.52 2.29 -0.29 -0.17 0.00 0.00 175.17 176.46 1f52 h ILE 154 N 3.49 0.04 0.00 4.11 2.10 -1.95 -1.39 117.51 123.91 1f52 h ILE 154 Ca -0.29 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.53 1f52 h ILE 154 Cb 1.16 1.12 0.00 0.00 -1.09 0.00 0.00 36.82 38.01 1f52 h ILE 154 CO 0.40 0.00 -0.82 -0.33 -1.08 0.00 0.00 178.15 176.32 1f52 h GLU 155 N 0.00 0.00 -6.35 2.19 5.08 -1.94 -3.48 114.58 110.08 1f52 h GLU 155 Ca -0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1f52 h GLU 155 Cb 0.11 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.42 1f52 h GLU 155 CO 0.00 0.00 0.60 0.41 -1.00 0.00 0.00 179.01 179.02 1f52 n GLY 156 N 1.26 0.73 0.34 -3.84 0.00 -0.53 -3.50 105.19 99.65 1f52 n GLY 156 Ca 0.02 0.69 0.14 0.00 0.00 0.00 0.00 46.02 46.86 1f52 n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f52 h ALA 157 N 5.16 2.18 0.00 4.61 0.00 -1.90 -0.92 119.26 128.39 1f52 h ALA 157 Ca -0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1f52 h ALA 157 Cb 1.30 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1f52 h ALA 157 CO 0.82 -0.28 -0.01 0.11 0.00 0.00 0.00 179.25 179.90 1f52 h TRP 158 N 0.15 0.00 -0.07 0.00 0.09 -1.94 -1.57 115.95 112.63 1f52 h TRP 158 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.17 1f52 h TRP 158 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.79 1f52 h TRP 158 CO -0.00 0.01 0.00 0.09 0.09 0.00 0.00 178.44 178.62 1f52 n ASN 159 N -3.15 0.41 0.30 0.11 3.02 -0.35 -3.69 115.26 111.91 1f52 n ASN 159 Ca -0.02 -1.82 0.17 0.00 -0.03 0.00 0.00 54.58 52.88 1f52 n ASN 159 Cb 0.12 -0.04 0.95 0.00 -0.61 0.00 0.00 39.78 40.19 1f52 n ASN 159 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1f52 h SER 160 N 0.48 0.00 -0.01 6.41 4.64 -1.46 -2.26 113.55 121.35 1f52 h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1f52 h SER 160 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1f52 h SER 160 CO 0.00 0.03 -0.34 -1.54 -0.87 0.00 0.00 176.83 174.11 1f52 n SER 161 N -3.47 1.74 -4.75 4.97 3.41 -1.24 -5.01 113.62 109.28 1f52 n SER 161 Ca -0.02 -1.37 -0.41 0.00 -0.26 0.00 0.00 58.87 56.81 1f52 n SER 161 Cb 0.14 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 1f52 n SER 161 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1f52 s THR 162 N -1.98 3.27 -0.05 6.66 2.01 -0.85 -5.01 115.64 119.68 1f52 s THR 162 Ca 0.15 1.16 -0.24 0.00 0.31 0.00 0.00 61.69 63.06 1f52 s THR 162 Cb 0.14 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 1f52 s THR 162 CO 0.43 0.23 0.73 -0.54 -0.69 0.00 0.00 174.62 174.77 1f52 s LYS 163 N -0.90 4.45 0.13 4.92 1.02 -1.26 -4.67 119.74 123.43 1f52 s LYS 163 Ca 0.50 0.94 0.10 0.00 0.02 0.00 0.00 55.97 57.54 1f52 s LYS 163 Cb -0.35 -3.44 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 1f52 s LYS 163 CO 0.42 0.07 -0.21 0.71 -0.92 0.00 0.00 175.35 175.42 1f52 s TYR 164 N 0.74 2.45 0.15 3.18 2.02 -1.26 -5.00 117.35 119.63 1f52 s TYR 164 Ca 0.39 -0.31 -0.28 0.00 -0.37 0.00 0.00 57.07 56.50 1f52 s TYR 164 Cb -0.18 -1.30 -0.03 0.00 -0.40 0.00 0.00 41.96 40.06 1f52 s TYR 164 CO 0.19 0.39 1.57 1.49 -1.57 0.00 0.00 175.55 177.62 1f52 h GLU 165 N 3.69 -0.36 -0.75 -0.62 4.22 -2.04 -1.53 114.58 117.19 1f52 h GLU 165 Ca -0.50 0.02 -0.08 0.00 0.08 0.00 0.00 59.36 58.88 1f52 h GLU 165 Cb 1.17 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.46 1f52 h GLU 165 CO 0.44 -0.24 0.11 0.41 -2.18 0.00 0.00 179.01 177.55 1f52 n GLY 166 N -1.42 2.91 0.00 1.92 0.00 -1.26 -5.01 105.19 102.33 1f52 n GLY 166 Ca -0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1f52 n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f52 n GLY 167 N 0.22 0.49 3.63 -0.02 0.00 -0.58 -4.93 105.19 104.00 1f52 n GLY 167 Ca 0.26 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 1f52 n GLY 167 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1f52 s ASN 168 N -0.88 6.80 0.00 1.61 3.84 -1.26 -4.67 114.94 120.37 1f52 s ASN 168 Ca 0.00 0.92 0.29 0.00 0.21 0.00 0.00 52.86 54.28 1f52 s ASN 168 Cb 0.00 -2.44 1.28 0.00 -0.55 0.00 0.00 41.25 39.54 1f52 s ASN 168 CO 0.00 -0.61 1.88 0.29 -2.79 0.00 0.00 177.10 175.87 1f52 n LYS 169 N 6.21 1.33 -2.11 0.43 4.76 -1.26 -4.99 118.16 122.53 1f52 n LYS 169 Ca 0.06 -0.60 0.00 0.00 -2.87 0.00 0.00 58.31 54.90 1f52 n LYS 169 Cb 0.48 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 1f52 n LYS 169 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1f52 n GLY 170 N 1.15 0.00 2.75 0.72 0.00 -1.26 -4.94 105.19 103.61 1f52 n GLY 170 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1f52 n GLY 170 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1f52 s HIS 171 N -1.64 2.21 0.13 1.61 3.76 -1.26 -5.11 115.29 114.99 1f52 s HIS 171 Ca 0.00 -2.57 0.10 0.00 -0.15 0.00 0.00 55.06 52.44 1f52 s HIS 171 Cb 0.00 -2.05 -0.04 0.00 1.11 0.00 0.00 32.58 31.60 1f52 s HIS 171 CO 0.00 -0.77 -0.25 1.03 -0.85 0.00 0.00 174.74 173.90 1f52 s ARG 172 N 0.19 1.35 0.01 1.40 0.52 -1.26 -3.98 118.95 117.19 1f52 s ARG 172 Ca 0.18 -1.33 -0.30 0.00 -0.52 0.00 0.00 55.73 53.76 1f52 s ARG 172 Cb -0.24 -1.77 -0.05 0.00 0.52 0.00 0.00 34.95 33.41 1f52 s ARG 172 CO -0.01 0.41 1.26 -1.25 0.02 0.00 0.00 175.30 175.74 1f52 s PRO 173 N -2.11 4.36 1.15 3.54 0.04 -1.26 -4.99 135.00 135.74 1f52 s PRO 173 Ca 0.13 1.80 -0.19 0.00 0.04 0.00 0.00 61.00 62.78 1f52 s PRO 173 Cb -0.10 -3.46 0.28 0.00 0.04 0.00 0.00 34.50 31.26 1f52 s PRO 173 CO 0.06 -0.40 1.21 0.20 0.04 0.00 0.00 177.00 178.11 1f52 s GLY 174 N 1.38 1.68 0.20 0.56 0.00 -1.26 -4.09 107.32 105.79 1f52 s GLY 174 Ca 0.59 -1.18 -0.32 0.00 0.00 0.00 0.00 44.72 43.82 1f52 s GLY 174 CO 0.26 -0.28 1.65 0.14 0.00 0.00 0.00 173.10 174.88 1f52 s VAL 175 N -3.39 2.27 -1.87 1.40 1.01 -1.26 -0.90 120.40 117.66 1f52 s VAL 175 Ca 0.74 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.92 1f52 s VAL 175 Cb -0.05 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.20 1f52 s VAL 175 CO 0.55 0.02 0.00 0.29 0.00 0.00 0.00 175.10 175.96 1f52 n LYS 176 N 3.88 -1.53 -0.68 2.72 5.02 -1.25 -4.85 118.16 121.46 1f52 n LYS 176 Ca 0.15 1.11 -0.00 0.00 -2.02 0.00 0.00 58.31 57.54 1f52 n LYS 176 Cb 0.37 -5.50 0.21 0.00 -0.02 0.00 0.00 35.03 30.08 1f52 n LYS 176 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f52 n GLY 177 N -0.19 4.76 0.02 0.72 0.00 -0.08 -4.63 105.19 105.79 1f52 n GLY 177 Ca -0.18 -1.19 0.12 0.00 0.00 0.00 0.00 46.02 44.77 1f52 n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f52 n GLY 178 N -1.03 -1.34 3.57 -0.02 0.00 0.17 -4.33 105.19 102.21 1f52 n GLY 178 Ca 0.29 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1f52 n GLY 178 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1f52 s TYR 179 N -3.04 1.93 0.00 1.61 5.04 -1.18 -4.21 117.35 117.50 1f52 s TYR 179 Ca 0.10 0.42 0.00 0.00 -2.44 0.00 0.00 57.07 55.15 1f52 s TYR 179 Cb 0.17 -4.09 0.00 0.00 0.35 0.00 0.00 41.96 38.39 1f52 s TYR 179 CO 0.67 -1.57 0.00 1.19 -1.34 0.00 0.00 175.55 174.50 1f52 n PHE 180 N 13.66 0.00 -1.59 4.97 0.99 -1.26 -5.05 117.46 129.18 1f52 n PHE 180 Ca 0.42 0.00 -0.53 0.00 -0.00 0.00 0.00 57.45 57.34 1f52 n PHE 180 Cb 0.47 0.00 -0.06 0.00 -1.00 0.00 0.00 39.48 38.89 1f52 n PHE 180 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1f52 n PRO 181 N -2.39 1.08 -1.07 -1.08 -0.02 -1.26 -4.90 135.00 125.37 1f52 n PRO 181 Ca 0.00 0.39 -0.30 0.00 -2.02 0.00 0.00 63.50 61.57 1f52 n PRO 181 Cb 0.00 -2.03 0.14 0.00 -0.02 0.00 0.00 33.50 31.59 1f52 n PRO 181 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1f52 s VAL 182 N 0.49 2.71 0.82 -1.45 -7.23 -1.26 -3.61 120.40 110.88 1f52 s VAL 182 Ca 0.85 0.23 -0.14 0.00 -1.81 0.00 0.00 61.98 61.12 1f52 s VAL 182 Cb -0.97 -2.59 0.06 0.00 0.56 0.00 0.00 36.38 33.44 1f52 s VAL 182 CO 0.48 -0.30 0.95 -2.65 -0.31 0.00 0.00 175.10 173.26 1f52 n PRO 183 N -3.92 0.09 0.00 4.82 -0.02 -1.26 -2.50 135.00 132.21 1f52 n PRO 183 Ca 0.08 0.10 0.13 0.00 -2.02 0.00 0.00 63.50 61.80 1f52 n PRO 183 Cb 0.54 -2.23 0.75 0.00 -0.02 0.00 0.00 33.50 32.53 1f52 n PRO 183 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1f52 n PRO 184 N -2.61 0.63 -0.20 0.52 -0.04 -1.26 -4.83 135.00 127.21 1f52 n PRO 184 Ca 0.12 0.02 -0.05 0.00 -0.04 0.00 0.00 63.50 63.55 1f52 n PRO 184 Cb 0.51 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 1f52 n PRO 184 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1f52 h VAL 185 N 0.00 1.07 -3.58 0.52 2.07 -1.62 -3.32 116.25 111.38 1f52 h VAL 185 Ca 0.00 -0.24 -0.61 0.00 0.82 0.00 0.00 66.70 66.67 1f52 h VAL 185 Cb 0.12 0.32 -0.11 0.00 -1.52 0.00 0.00 31.29 30.09 1f52 h VAL 185 CO 0.00 0.13 0.42 -0.62 0.02 0.00 0.00 177.57 177.52 1f52 s ASP 186 N -5.64 6.51 0.00 0.57 3.68 -1.23 -4.33 116.67 116.23 1f52 s ASP 186 Ca -0.13 0.18 0.25 0.00 2.13 0.00 0.00 52.55 54.98 1f52 s ASP 186 Cb 0.14 -2.41 0.67 0.00 -1.45 0.00 0.00 42.92 39.87 1f52 s ASP 186 CO 0.75 -0.86 1.53 -1.54 0.13 0.00 0.00 175.17 175.18 1f52 n SER 187 N 6.68 2.19 -1.06 -0.34 3.41 -1.25 -4.07 113.62 119.18 1f52 n SER 187 Ca 0.04 -1.74 -0.00 0.00 -0.26 0.00 0.00 58.87 56.91 1f52 n SER 187 Cb 0.48 -0.05 0.22 0.00 -0.26 0.00 0.00 64.21 64.60 1f52 n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f52 n ALA 188 N 0.69 3.83 0.23 7.33 0.00 -1.26 -4.74 120.51 126.60 1f52 n ALA 188 Ca 0.17 -2.84 -0.15 0.00 0.00 0.00 0.00 53.44 50.62 1f52 n ALA 188 Cb 0.45 -0.74 -0.08 0.00 0.00 0.00 0.00 19.45 19.08 1f52 n ALA 188 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1f52 h GLN 189 N 1.22 -0.56 -0.96 0.00 5.75 -2.00 -0.49 115.11 118.07 1f52 h GLN 189 Ca 0.15 0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.77 1f52 h GLN 189 Cb 1.60 0.13 -0.07 0.00 1.07 0.00 0.00 27.48 30.20 1f52 h GLN 189 CO 0.34 -0.28 0.61 -0.44 -2.65 0.00 0.00 178.83 176.41 1f52 h ASP 190 N -0.78 0.94 -0.28 -0.69 3.45 -1.96 -1.82 116.42 115.27 1f52 h ASP 190 Ca -0.06 0.03 -0.19 0.00 0.43 0.00 0.00 57.03 57.24 1f52 h ASP 190 Cb 0.54 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 39.14 1f52 h ASP 190 CO 0.10 0.57 -0.56 -0.29 -1.57 0.00 0.00 179.24 177.49 1f52 h ILE 191 N 1.05 1.27 -0.73 0.35 2.10 -1.86 -1.98 117.51 117.72 1f52 h ILE 191 Ca 0.44 -1.74 -0.01 0.00 1.08 0.00 0.00 64.86 64.63 1f52 h ILE 191 Cb 0.27 1.65 -0.04 0.00 -1.09 0.00 0.00 36.82 37.62 1f52 h ILE 191 CO -0.21 0.57 0.42 0.03 -1.08 0.00 0.00 178.15 177.88 1f52 h ARG 192 N 0.66 0.99 -0.20 2.19 3.08 -0.61 -1.36 114.38 119.13 1f52 h ARG 192 Ca 0.01 -0.10 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 1f52 h ARG 192 Cb 1.17 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 1f52 h ARG 192 CO 0.12 0.71 -0.51 0.77 -1.07 0.00 0.00 179.97 180.00 1f52 h SER 193 N 1.01 0.63 -0.66 7.04 0.02 -1.15 -1.13 113.55 119.31 1f52 h SER 193 Ca 0.26 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1f52 h SER 193 Cb -0.01 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 1f52 h SER 193 CO -0.05 1.03 0.40 -0.33 -1.14 0.00 0.00 176.83 176.74 1f52 h GLU 194 N 0.45 0.89 -1.00 3.45 4.39 -0.93 0.17 114.58 122.00 1f52 h GLU 194 Ca 0.02 -0.08 0.04 0.00 0.34 0.00 0.00 59.36 59.68 1f52 h GLU 194 Cb 1.05 -0.19 -0.06 0.00 -0.10 0.00 0.00 28.75 29.45 1f52 h GLU 194 CO 0.10 0.63 0.65 0.52 -1.16 0.00 0.00 179.01 179.75 1f52 h MET 195 N 0.89 1.21 0.24 2.33 2.86 -0.88 0.71 114.93 122.29 1f52 h MET 195 Ca 0.24 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1f52 h MET 195 Cb -0.03 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.36 1f52 h MET 195 CO -0.04 0.80 -0.12 0.00 1.06 0.00 0.00 176.91 178.61 1f52 h LEU 197 N -0.57 0.27 -0.61 0.00 3.38 -0.32 -0.60 115.31 116.86 1f52 h LEU 197 Ca -0.03 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1f52 h LEU 197 Cb 0.42 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1f52 h LEU 197 CO 0.06 0.18 -0.09 0.58 0.09 0.00 0.00 178.44 179.25 1f52 h VAL 198 N 0.43 1.27 -0.83 1.22 2.07 -0.77 -0.54 116.25 119.09 1f52 h VAL 198 Ca 0.26 -1.24 0.02 0.00 0.82 0.00 0.00 66.70 66.57 1f52 h VAL 198 Cb 0.26 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1f52 h VAL 198 CO -0.24 0.44 0.54 0.24 0.02 0.00 0.00 177.57 178.57 1f52 h MET 199 N 0.89 1.05 -0.19 1.57 2.86 0.13 -1.63 114.93 119.61 1f52 h MET 199 Ca 0.14 -0.06 -0.14 0.00 -2.06 0.00 0.00 59.70 57.58 1f52 h MET 199 Cb 0.65 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1f52 h MET 199 CO 0.04 0.69 -0.46 0.93 1.06 0.00 0.00 176.91 179.17 1f52 h GLU 200 N 1.08 0.48 0.00 1.72 5.08 -0.71 -1.18 114.58 121.05 1f52 h GLU 200 Ca 0.32 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1f52 h GLU 200 Cb -0.06 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1f52 h GLU 200 CO -0.09 0.85 -0.01 1.96 -1.00 0.00 0.00 179.01 180.72 1f52 h GLN 201 N 0.39 0.00 -0.63 2.33 4.20 -0.26 -0.31 115.11 120.83 1f52 h GLN 201 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1f52 h GLN 201 Cb 0.96 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.74 1f52 h GLN 201 CO 0.08 0.01 0.00 -1.33 -0.67 0.00 0.00 178.83 176.92 1f52 n MET 202 N -3.16 3.77 -0.13 1.46 2.81 -0.54 -4.87 117.12 116.45 1f52 n MET 202 Ca -0.02 -2.89 0.00 0.00 -1.81 0.00 0.00 57.70 52.98 1f52 n MET 202 Cb 0.14 -1.90 0.00 0.00 -0.71 0.00 0.00 33.22 30.75 1f52 n MET 202 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1f52 n GLY 203 N 1.03 0.61 3.90 3.03 0.00 -0.12 -5.03 105.19 108.60 1f52 n GLY 203 Ca 0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 1f52 n GLY 203 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f52 s LEU 204 N 0.00 3.44 -0.17 0.99 1.02 -0.64 -4.98 118.68 118.34 1f52 s LEU 204 Ca 0.00 0.99 0.01 0.00 0.02 0.00 0.00 54.13 55.15 1f52 s LEU 204 Cb 0.00 -3.94 0.02 0.00 0.02 0.00 0.00 46.19 42.30 1f52 s LEU 204 CO 0.00 -0.76 -0.18 -0.69 0.02 0.00 0.00 176.35 174.74 1f52 s VAL 205 N -2.90 1.87 -0.04 -1.59 1.01 -1.26 -4.00 120.40 113.49 1f52 s VAL 205 Ca 0.51 -0.84 -0.17 0.00 0.00 0.00 0.00 61.98 61.47 1f52 s VAL 205 Cb -0.10 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 1f52 s VAL 205 CO 0.47 0.49 0.48 -0.69 0.00 0.00 0.00 175.10 175.85 1f52 s VAL 206 N 1.36 5.04 -0.19 2.92 1.01 -1.26 0.14 120.40 129.42 1f52 s VAL 206 Ca 0.05 0.98 0.10 0.00 0.00 0.00 0.00 61.98 63.10 1f52 s VAL 206 Cb -0.13 -3.80 -0.18 0.00 0.00 0.00 0.00 36.38 32.27 1f52 s VAL 206 CO -0.12 0.46 -0.04 -0.62 0.00 0.00 0.00 175.10 174.78 1f52 n GLU 207 N 2.64 0.97 -3.61 2.72 1.02 0.14 -4.86 120.64 119.66 1f52 n GLU 207 Ca -0.10 0.05 -0.04 0.00 -0.02 0.00 0.00 57.16 57.05 1f52 n GLU 207 Cb 0.52 -1.43 -0.02 0.00 -0.02 0.00 0.00 31.44 30.49 1f52 n GLU 207 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1f52 s ALA 208 N -2.42 -1.95 -0.07 0.62 0.00 -1.04 -5.00 121.76 111.90 1f52 s ALA 208 Ca -0.17 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 1f52 s ALA 208 Cb 0.06 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.50 1f52 s ALA 208 CO 0.61 -0.81 0.27 -3.38 0.00 0.00 0.00 175.76 172.45 1f52 s HIS 209 N -2.79 -0.24 0.11 0.00 -3.43 -1.26 0.33 115.29 108.01 1f52 s HIS 209 Ca 0.10 0.54 -0.25 0.00 -0.80 0.00 0.00 55.06 54.64 1f52 s HIS 209 Cb 0.00 0.09 0.07 0.00 -1.43 0.00 0.00 32.58 31.31 1f52 s HIS 209 CO -0.04 -0.22 0.80 -3.38 -2.00 0.00 0.00 174.74 169.90 1f52 s HIS 210 N -0.36 -0.34 0.45 0.38 -3.43 -0.59 -5.03 115.29 106.37 1f52 s HIS 210 Ca -0.05 0.10 -0.22 0.00 -0.80 0.00 0.00 55.06 54.09 1f52 s HIS 210 Cb -0.03 0.59 -0.09 0.00 -1.43 0.00 0.00 32.58 31.62 1f52 s HIS 210 CO 0.01 -0.79 1.05 -1.58 -2.00 0.00 0.00 174.74 171.44 1f52 s HIS 211 N -3.44 3.08 0.00 0.38 2.46 -1.26 -1.30 115.29 115.21 1f52 s HIS 211 Ca 0.06 1.60 0.00 0.00 0.47 0.00 0.00 55.06 57.19 1f52 s HIS 211 Cb -0.02 -3.11 0.00 0.00 -0.13 0.00 0.00 32.58 29.32 1f52 s HIS 211 CO -0.06 -0.80 0.00 0.39 -2.47 0.00 0.00 174.74 171.80 1f52 n GLU 212 N -0.61 1.24 -0.08 2.88 -0.58 0.69 -4.51 120.64 119.67 1f52 n GLU 212 Ca 0.08 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.69 1f52 n GLU 212 Cb 0.51 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.33 1f52 n GLU 212 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1f52 h VAL 213 N -0.05 1.30 -4.10 2.62 2.07 -1.83 -3.13 116.25 113.13 1f52 h VAL 213 Ca 0.00 -1.20 -0.52 0.00 0.82 0.00 0.00 66.70 65.80 1f52 h VAL 213 Cb 0.00 1.58 0.10 0.00 -1.52 0.00 0.00 31.29 31.45 1f52 h VAL 213 CO 0.00 0.37 0.45 0.00 0.02 0.00 0.00 177.57 178.41 1f52 s ALA 214 N -4.58 2.57 1.12 1.67 0.00 -1.26 0.45 121.76 121.73 1f52 s ALA 214 Ca -0.13 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 1f52 s ALA 214 Cb 0.07 -3.41 0.25 0.00 0.00 0.00 0.00 23.12 20.02 1f52 s ALA 214 CO 0.77 -1.08 1.13 -0.08 0.00 0.00 0.00 175.76 176.51 1f52 s THR 215 N -1.72 1.75 -1.18 0.00 -1.32 -1.26 -3.68 115.64 108.24 1f52 s THR 215 Ca 0.75 0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 61.19 1f52 s THR 215 Cb -0.28 -2.57 0.00 0.00 -1.51 0.00 0.00 72.50 68.15 1f52 s THR 215 CO 0.32 0.00 0.54 0.00 -2.21 0.00 0.00 174.62 173.27 1f52 n ALA 216 N -4.47 -0.79 -1.77 11.08 0.00 -1.23 -4.11 120.51 119.22 1f52 n ALA 216 Ca 0.11 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1f52 n ALA 216 Cb 0.59 -3.34 0.00 0.00 0.00 0.00 0.00 19.45 16.71 1f52 n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f52 n GLY 217 N -1.40 0.75 3.73 0.00 0.00 -1.26 -4.43 105.19 102.57 1f52 n GLY 217 Ca -0.07 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 1f52 n GLY 217 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1f52 s GLN 218 N -3.67 4.68 0.19 1.61 0.74 -1.24 -0.29 119.66 121.67 1f52 s GLN 218 Ca 0.00 1.50 -0.04 0.00 0.05 0.00 0.00 55.36 56.88 1f52 s GLN 218 Cb 0.00 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.72 1f52 s GLN 218 CO 0.00 0.18 0.18 -0.80 -0.55 0.00 0.00 175.29 174.31 1f52 s ASN 219 N -0.01 0.13 -0.17 6.67 -0.87 0.89 -0.22 114.94 121.36 1f52 s ASN 219 Ca 0.47 -1.23 -0.13 0.00 -1.57 0.00 0.00 52.86 50.40 1f52 s ASN 219 Cb -0.24 0.40 0.05 0.00 -0.02 0.00 0.00 41.25 41.44 1f52 s ASN 219 CO 0.31 -0.87 0.44 -0.70 -2.57 0.00 0.00 177.10 173.71 1f52 s GLU 220 N -4.10 0.48 -0.22 -0.60 2.12 -0.42 -1.57 118.70 114.39 1f52 s GLU 220 Ca 0.31 0.70 0.00 0.00 0.36 0.00 0.00 54.97 56.34 1f52 s GLU 220 Cb 0.06 0.16 0.03 0.00 0.26 0.00 0.00 34.13 34.63 1f52 s GLU 220 CO 0.08 -0.10 -0.12 0.08 -0.54 0.00 0.00 175.26 174.67 1f52 s VAL 221 N 0.67 2.48 -0.19 3.70 1.01 -1.26 -1.54 120.40 125.27 1f52 s VAL 221 Ca -0.04 -1.07 -0.17 0.00 0.00 0.00 0.00 61.98 60.70 1f52 s VAL 221 Cb -0.05 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1f52 s VAL 221 CO -0.05 0.29 0.46 0.00 0.00 0.00 0.00 175.10 175.81 1f52 s ALA 222 N 1.28 3.54 0.19 5.51 0.00 0.15 -4.76 121.76 127.67 1f52 s ALA 222 Ca 0.01 -0.41 0.09 0.00 0.00 0.00 0.00 51.96 51.65 1f52 s ALA 222 Cb -0.16 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1f52 s ALA 222 CO -0.08 -0.30 -0.12 0.95 0.00 0.00 0.00 175.76 176.22 1f52 s THR 223 N 1.32 3.05 0.46 0.00 -4.23 -1.26 0.24 115.64 115.21 1f52 s THR 223 Ca 0.22 -1.75 -0.24 0.00 -1.18 0.00 0.00 61.69 58.75 1f52 s THR 223 Cb -0.15 -2.51 -0.07 0.00 1.34 0.00 0.00 72.50 71.10 1f52 s THR 223 CO 0.09 -0.13 1.22 -0.60 -0.54 0.00 0.00 174.62 174.66 1f52 s ARG 224 N -2.87 3.73 1.38 3.99 3.52 0.12 -4.80 118.95 124.03 1f52 s ARG 224 Ca 0.25 1.93 -0.22 0.00 -0.13 0.00 0.00 55.73 57.56 1f52 s ARG 224 Cb -0.08 -2.48 0.35 0.00 -1.56 0.00 0.00 34.95 31.18 1f52 s ARG 224 CO 0.15 -0.62 0.96 -0.59 -0.81 0.00 0.00 175.30 174.38 1f52 s PHE 225 N -1.44 -0.40 0.13 5.12 -0.71 -1.26 -4.79 117.98 114.63 1f52 s PHE 225 Ca 0.63 0.59 -0.25 0.00 -1.04 0.00 0.00 56.93 56.86 1f52 s PHE 225 Cb -0.33 -2.99 0.08 0.00 -1.21 0.00 0.00 43.02 38.58 1f52 s PHE 225 CO 0.40 -4.80 1.08 1.21 -1.34 0.00 0.00 175.22 171.76 1f52 s ASN 226 N -3.23 -0.05 0.51 1.98 3.84 -0.90 -4.99 114.94 112.10 1f52 s ASN 226 Ca 0.69 -0.48 -0.22 0.00 0.21 0.00 0.00 52.86 53.06 1f52 s ASN 226 Cb -0.13 0.41 -0.06 0.00 -0.55 0.00 0.00 41.25 40.92 1f52 s ASN 226 CO 0.58 -0.80 1.24 0.42 -2.79 0.00 0.00 177.10 175.75 1f52 s THR 227 N -2.49 2.65 0.01 -5.21 -4.23 -1.26 -1.54 115.64 103.57 1f52 s THR 227 Ca 0.19 0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 61.15 1f52 s THR 227 Cb -0.01 -3.23 -0.01 0.00 1.34 0.00 0.00 72.50 70.59 1f52 s THR 227 CO 0.03 -0.02 0.87 0.80 -0.54 0.00 0.00 174.62 175.76 1f52 n MET 228 N -0.85 -0.04 -0.25 3.99 0.00 -0.68 -0.92 117.12 118.37 1f52 n MET 228 Ca 0.09 0.87 0.00 0.00 -0.00 0.00 0.00 57.70 58.67 1f52 n MET 228 Cb 0.47 -1.30 0.22 0.00 0.00 0.00 0.00 33.22 32.61 1f52 n MET 228 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 1f52 h THR 229 N 0.00 1.19 0.00 1.12 2.02 -1.90 -0.78 112.91 114.56 1f52 h THR 229 Ca 0.01 -0.37 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 1f52 h THR 229 Cb 0.04 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 1f52 h THR 229 CO -0.08 0.20 -0.32 0.50 0.37 0.00 0.00 175.52 176.18 1f52 h LYS 230 N 1.08 0.00 -0.14 6.66 3.64 -1.67 -2.30 116.57 123.83 1f52 h LYS 230 Ca 0.30 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.47 1f52 h LYS 230 Cb -0.10 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1f52 h LYS 230 CO -0.07 0.32 -0.75 -0.22 -2.27 0.00 0.00 179.45 176.46 1f52 h LYS 231 N 0.00 0.71 -0.54 1.90 1.63 0.40 -0.35 116.57 120.32 1f52 h LYS 231 Ca -0.00 -0.57 -0.04 0.00 -0.85 0.00 0.00 60.65 59.18 1f52 h LYS 231 Cb 0.61 0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.33 1f52 h LYS 231 CO 0.04 1.18 0.16 0.00 -3.45 0.00 0.00 179.45 177.38 1f52 h ALA 232 N 0.66 1.27 -0.12 5.00 0.00 -1.14 0.18 119.26 125.11 1f52 h ALA 232 Ca -0.04 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1f52 h ALA 232 Cb 1.37 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1f52 h ALA 232 CO 0.15 0.52 0.07 -0.44 0.00 0.00 0.00 179.25 179.55 1f52 h ASP 233 N 0.78 0.15 -0.66 0.00 3.32 -1.13 -2.09 116.42 116.78 1f52 h ASP 233 Ca 0.18 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.22 1f52 h ASP 233 Cb 0.25 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1f52 h ASP 233 CO -0.01 0.18 0.44 -0.33 -1.72 0.00 0.00 179.24 177.80 1f52 h GLU 234 N 0.10 0.64 -0.34 3.56 5.08 0.11 -1.40 114.58 122.33 1f52 h GLU 234 Ca 0.04 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1f52 h GLU 234 Cb 0.06 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1f52 h GLU 234 CO -0.01 0.43 0.15 0.82 -1.00 0.00 0.00 179.01 179.40 1f52 h ILE 235 N 0.66 1.17 -0.78 3.13 1.08 -0.09 0.47 117.51 123.15 1f52 h ILE 235 Ca 0.29 -0.51 0.04 0.00 -0.39 0.00 0.00 64.86 64.29 1f52 h ILE 235 Cb 0.28 0.88 -0.05 0.00 -3.07 0.00 0.00 36.82 34.86 1f52 h ILE 235 CO -0.09 0.18 0.49 1.56 -0.69 0.00 0.00 178.15 179.60 1f52 h GLN 236 N 0.41 0.91 -0.35 2.37 1.08 -0.64 0.13 115.11 119.01 1f52 h GLN 236 Ca 0.12 -0.05 -0.11 0.00 -1.45 0.00 0.00 58.65 57.15 1f52 h GLN 236 Cb 0.15 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 1f52 h GLN 236 CO -0.01 0.60 -0.21 0.82 -0.95 0.00 0.00 178.83 179.08 1f52 h ILE 237 N 0.94 1.29 -0.03 2.54 2.04 -0.93 -1.10 117.51 122.26 1f52 h ILE 237 Ca 0.32 -1.35 0.03 0.00 1.00 0.00 0.00 64.86 64.86 1f52 h ILE 237 Cb 0.06 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.49 1f52 h ILE 237 CO -0.13 0.44 -0.19 0.22 0.00 0.00 0.00 178.15 178.49 1f52 h TYR 238 N 0.55 -0.49 -0.82 1.37 5.03 0.61 0.24 116.97 123.46 1f52 h TYR 238 Ca 0.07 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.41 1f52 h TYR 238 Cb 0.76 0.22 -0.04 0.00 1.55 0.00 0.00 36.73 39.23 1f52 h TYR 238 CO 0.06 -0.27 0.52 0.87 -1.32 0.00 0.00 178.16 178.02 1f52 h LYS 239 N -0.29 1.09 -0.35 1.82 1.57 -0.67 -0.39 116.57 119.35 1f52 h LYS 239 Ca 0.07 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1f52 h LYS 239 Cb 0.38 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1f52 h LYS 239 CO -0.20 0.74 0.23 -0.92 -0.57 0.00 0.00 179.45 178.73 1f52 h TYR 240 N 1.11 0.44 -0.25 -1.35 3.20 -0.38 0.16 116.97 119.89 1f52 h TYR 240 Ca 0.30 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 1f52 h TYR 240 Cb -0.10 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 1f52 h TYR 240 CO -0.01 0.28 0.09 0.28 -1.64 0.00 0.00 178.16 177.16 1f52 h VAL 241 N 0.47 1.18 -0.01 1.81 2.07 -0.13 -0.95 116.25 120.70 1f52 h VAL 241 Ca 0.13 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.09 1f52 h VAL 241 Cb -0.05 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1f52 h VAL 241 CO -0.03 0.19 -0.08 0.58 0.02 0.00 0.00 177.57 178.25 1f52 h VAL 242 N 0.25 0.78 -0.49 2.57 2.07 -0.76 0.17 116.25 120.85 1f52 h VAL 242 Ca 0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.63 1f52 h VAL 242 Cb 0.21 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1f52 h VAL 242 CO -0.00 0.00 0.29 0.45 0.02 0.00 0.00 177.57 178.32 1f52 h HIS 243 N -0.14 0.54 0.04 1.57 -0.00 -0.59 -1.62 115.15 114.95 1f52 h HIS 243 Ca 0.04 0.02 -0.22 0.00 -0.00 0.00 0.00 60.37 60.20 1f52 h HIS 243 Cb 0.19 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 1f52 h HIS 243 CO -0.16 0.31 -1.03 -0.91 -0.00 0.00 0.00 177.93 176.14 1f52 h ASN 244 N 0.57 0.18 -0.35 2.45 4.21 -0.96 -2.04 115.58 119.65 1f52 h ASN 244 Ca 0.20 -0.18 -0.16 0.00 1.21 0.00 0.00 56.30 57.37 1f52 h ASN 244 Cb 0.02 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 1f52 h ASN 244 CO -0.09 1.09 -0.38 0.58 -1.29 0.00 0.00 177.43 177.33 1f52 h VAL 245 N 0.05 1.27 -0.16 2.81 2.07 -0.58 -0.98 116.25 120.73 1f52 h VAL 245 Ca -0.05 -1.56 0.02 0.00 0.82 0.00 0.00 66.70 65.92 1f52 h VAL 245 Cb 1.74 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 1f52 h VAL 245 CO 0.15 0.52 0.04 0.00 0.02 0.00 0.00 177.57 178.30 1f52 h ALA 246 N 0.82 0.17 -0.56 1.67 0.00 -1.30 -0.74 119.26 119.32 1f52 h ALA 246 Ca 0.06 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1f52 h ALA 246 Cb 0.97 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1f52 h ALA 246 CO 0.09 -0.40 0.28 1.25 0.00 0.00 0.00 179.25 180.48 1f52 h HIS 247 N 0.12 0.51 0.00 0.00 6.17 -1.21 0.23 115.15 120.97 1f52 h HIS 247 Ca 0.07 0.02 -0.02 0.00 0.71 0.00 0.00 60.37 61.15 1f52 h HIS 247 Cb 0.05 -0.15 -0.00 0.00 2.52 0.00 0.00 27.41 29.83 1f52 h HIS 247 CO -0.12 0.24 -0.11 0.00 0.71 0.00 0.00 177.93 178.65 1f52 h ARG 248 N 0.54 0.00 -0.27 5.26 3.08 -0.55 -1.75 114.38 120.68 1f52 h ARG 248 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1f52 h ARG 248 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1f52 h ARG 248 CO -0.18 0.11 0.00 1.19 -1.07 0.00 0.00 179.97 180.02 1f52 n PHE 249 N -3.47 0.35 -0.81 3.04 3.72 -0.00 -4.91 117.46 115.37 1f52 n PHE 249 Ca -0.01 -0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1f52 n PHE 249 Cb 0.26 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 1f52 n PHE 249 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1f52 n GLY 250 N 1.26 0.50 1.74 1.37 0.00 -0.66 -5.05 105.19 104.37 1f52 n GLY 250 Ca 0.17 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 1f52 n GLY 250 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1f52 n LYS 251 N -2.81 1.31 -3.70 1.61 5.02 0.59 -4.82 118.16 115.37 1f52 n LYS 251 Ca 0.00 -1.70 -0.14 0.00 -2.02 0.00 0.00 58.31 54.45 1f52 n LYS 251 Cb 0.00 0.37 -0.14 0.00 -0.02 0.00 0.00 35.03 35.24 1f52 n LYS 251 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1f52 s THR 252 N -1.66 -0.20 0.06 -0.18 -1.32 -0.22 -3.45 115.64 108.66 1f52 s THR 252 Ca 0.05 0.23 0.02 0.00 -1.21 0.00 0.00 61.69 60.78 1f52 s THR 252 Cb -0.00 -0.37 -0.04 0.00 -1.51 0.00 0.00 72.50 70.57 1f52 s THR 252 CO 0.03 0.09 0.09 0.00 -2.21 0.00 0.00 174.62 172.62 1f52 s ALA 253 N 1.80 3.59 0.00 11.08 0.00 -1.26 -0.81 121.76 136.17 1f52 s ALA 253 Ca -0.04 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1f52 s ALA 253 Cb -0.11 -1.50 -0.01 0.00 0.00 0.00 0.00 23.12 21.50 1f52 s ALA 253 CO -0.08 0.74 -0.05 -0.08 0.00 0.00 0.00 175.76 176.29 1f52 s THR 254 N -1.34 0.36 -1.03 0.00 -1.32 -0.43 -4.93 115.64 106.94 1f52 s THR 254 Ca 0.28 -0.34 0.17 0.00 -1.21 0.00 0.00 61.69 60.60 1f52 s THR 254 Cb -0.12 -0.34 0.66 0.00 -1.51 0.00 0.00 72.50 71.19 1f52 s THR 254 CO 0.20 0.01 1.57 0.49 -2.21 0.00 0.00 174.62 174.68 1f52 n PHE 255 N 2.71 1.31 -1.68 9.09 3.72 -1.26 -1.83 117.46 129.51 1f52 n PHE 255 Ca -0.14 -0.62 -0.40 0.00 -0.05 0.00 0.00 57.45 56.23 1f52 n PHE 255 Cb 0.58 -0.22 0.02 0.00 -0.94 0.00 0.00 39.48 38.92 1f52 n PHE 255 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1f52 n MET 256 N 0.91 1.67 0.02 -1.08 2.81 -1.26 -3.86 117.12 116.34 1f52 n MET 256 Ca 0.24 0.60 -0.10 0.00 -1.81 0.00 0.00 57.70 56.63 1f52 n MET 256 Cb 0.84 -2.34 0.04 0.00 -0.71 0.00 0.00 33.22 31.04 1f52 n MET 256 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1f52 h PRO 257 N 1.69 0.51 -2.47 0.03 0.13 -1.88 -3.40 132.00 126.61 1f52 h PRO 257 Ca -0.48 -0.36 -0.59 0.00 -0.87 0.00 0.00 66.00 63.70 1f52 h PRO 257 Cb 1.31 0.06 -0.38 0.00 0.13 0.00 0.00 31.00 32.11 1f52 h PRO 257 CO 0.58 0.98 -0.92 0.21 -0.23 0.00 0.00 178.00 178.62 1f52 s LYS 258 N -3.84 0.81 0.40 0.86 2.47 -1.26 0.10 119.74 119.27 1f52 s LYS 258 Ca -0.07 -1.84 0.21 0.00 -1.56 0.00 0.00 55.97 52.72 1f52 s LYS 258 Cb 0.11 -1.42 0.42 0.00 -1.46 0.00 0.00 37.83 35.48 1f52 s LYS 258 CO 0.84 -1.32 1.62 -1.00 0.16 0.00 0.00 175.35 175.66 1f52 h PRO 259 N 6.17 0.00 -4.79 4.03 0.13 -1.88 -3.45 132.00 132.21 1f52 h PRO 259 Ca 0.18 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.83 1f52 h PRO 259 Cb 0.93 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.75 1f52 h PRO 259 CO 0.34 0.20 -0.81 -1.64 -0.23 0.00 0.00 178.00 175.87 1f52 s MET 260 N -3.23 1.31 0.04 0.86 -1.94 -1.26 -5.07 119.30 110.01 1f52 s MET 260 Ca 0.04 -0.41 -0.30 0.00 -1.71 0.00 0.00 55.69 53.32 1f52 s MET 260 Cb 0.07 -1.17 -0.04 0.00 2.01 0.00 0.00 34.83 35.70 1f52 s MET 260 CO 0.68 0.14 0.96 0.12 -0.01 0.00 0.00 175.02 176.90 1f52 s PHE 261 N 0.23 3.72 0.00 -0.03 5.36 -1.26 -3.73 117.98 122.27 1f52 s PHE 261 Ca -0.05 1.72 0.00 0.00 -0.96 0.00 0.00 56.93 57.64 1f52 s PHE 261 Cb -0.11 -3.08 0.00 0.00 -0.34 0.00 0.00 43.02 39.50 1f52 s PHE 261 CO 0.01 0.09 0.00 0.41 -1.46 0.00 0.00 175.22 174.27 1f52 n GLY 262 N 2.64 0.50 3.31 13.12 0.00 -1.26 -5.06 105.19 118.44 1f52 n GLY 262 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1f52 n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f52 s ASP 263 N -2.01 0.09 0.41 1.61 3.68 -1.24 -4.81 116.67 114.40 1f52 s ASP 263 Ca 0.00 -1.14 -0.22 0.00 2.13 0.00 0.00 52.55 53.32 1f52 s ASP 263 Cb 0.00 0.43 -0.14 0.00 -1.45 0.00 0.00 42.92 41.76 1f52 s ASP 263 CO 0.00 -0.90 0.38 -3.20 0.13 0.00 0.00 175.17 171.57 1f52 n ASN 264 N -0.26 -1.62 -3.76 -0.34 4.05 -1.26 -4.82 115.26 107.26 1f52 n ASN 264 Ca -0.02 0.87 -0.12 0.00 0.45 0.00 0.00 54.58 55.77 1f52 n ASN 264 Cb 0.64 -1.03 0.04 0.00 1.23 0.00 0.00 39.78 40.66 1f52 n ASN 264 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1f52 n GLY 265 N 1.99 1.92 3.38 8.20 0.00 -1.26 -4.78 105.19 114.63 1f52 n GLY 265 Ca 0.12 -2.18 -0.33 0.00 0.00 0.00 0.00 46.02 43.62 1f52 n GLY 265 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f52 s SER 266 N -3.17 4.15 0.44 1.61 0.01 0.28 -4.99 113.70 112.04 1f52 s SER 266 Ca 0.37 -0.31 0.06 0.00 1.31 0.00 0.00 55.95 57.38 1f52 s SER 266 Cb -0.03 -1.65 -0.04 0.00 0.21 0.00 0.00 66.02 64.51 1f52 s SER 266 CO 0.23 0.14 0.17 -0.83 0.41 0.00 0.00 173.24 173.36 1f52 s GLY 267 N 0.50 2.44 -0.43 3.44 0.00 -1.26 -4.40 107.32 107.61 1f52 s GLY 267 Ca -0.08 -1.84 0.05 0.00 0.00 0.00 0.00 44.72 42.86 1f52 s GLY 267 CO 0.04 -1.97 0.42 -0.13 0.00 0.00 0.00 173.10 171.45 1f52 n MET 268 N -1.27 0.52 -1.70 2.90 1.56 0.21 -2.29 117.12 117.06 1f52 n MET 268 Ca -0.04 -3.33 -0.41 0.00 -0.27 0.00 0.00 57.70 53.66 1f52 n MET 268 Cb 0.65 -1.60 0.02 0.00 2.15 0.00 0.00 33.22 34.44 1f52 n MET 268 CO 0.00 0.00 0.00 0.72 -0.73 0.00 0.00 175.97 175.96 1f52 n HIS 269 N 2.30 2.03 -4.03 1.12 8.25 -1.25 -4.29 115.22 119.35 1f52 n HIS 269 Ca 0.27 0.49 -0.31 0.00 -0.26 0.00 0.00 57.72 57.91 1f52 n HIS 269 Cb 0.48 -2.35 -0.16 0.00 1.12 0.00 0.00 29.99 29.08 1f52 n HIS 269 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1f52 s HIS 271 N 1.28 3.66 0.06 0.00 3.76 -0.67 -0.30 115.29 123.08 1f52 s HIS 271 Ca -0.04 1.26 0.00 0.00 -0.15 0.00 0.00 55.06 56.14 1f52 s HIS 271 Cb -0.17 -2.71 -0.03 0.00 1.11 0.00 0.00 32.58 30.77 1f52 s HIS 271 CO -0.08 0.25 -0.05 -1.64 -0.85 0.00 0.00 174.74 172.38 1f52 s MET 272 N 0.16 0.61 -0.08 1.40 -1.94 0.34 -0.49 119.30 119.29 1f52 s MET 272 Ca 0.34 -1.08 -0.30 0.00 -1.71 0.00 0.00 55.69 52.94 1f52 s MET 272 Cb -0.18 0.01 0.12 0.00 2.01 0.00 0.00 34.83 36.78 1f52 s MET 272 CO 0.18 -0.05 0.96 -1.54 -0.01 0.00 0.00 175.02 174.57 1f52 s SER 273 N -2.51 -0.34 0.27 3.03 1.04 -1.06 -1.29 113.70 112.84 1f52 s SER 273 Ca 0.02 0.13 0.10 0.00 0.48 0.00 0.00 55.95 56.68 1f52 s SER 273 Cb 0.02 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 1f52 s SER 273 CO -0.06 -0.48 -0.04 -0.76 0.98 0.00 0.00 173.24 172.89 1f52 s LEU 274 N -1.99 3.07 0.04 2.42 1.43 -1.26 -0.92 118.68 121.47 1f52 s LEU 274 Ca 0.03 -0.74 -0.15 0.00 -1.03 0.00 0.00 54.13 52.24 1f52 s LEU 274 Cb -0.01 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.66 1f52 s LEU 274 CO -0.05 -0.00 0.34 0.00 0.23 0.00 0.00 176.35 176.87 1f52 s ALA 275 N -2.37 -0.79 -0.08 4.21 0.00 -0.78 -1.85 121.76 120.09 1f52 s ALA 275 Ca 0.31 0.12 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 1f52 s ALA 275 Cb -0.06 0.31 0.04 0.00 0.00 0.00 0.00 23.12 23.42 1f52 s ALA 275 CO 0.19 -0.42 0.19 0.21 0.00 0.00 0.00 175.76 175.93 1f52 s LYS 276 N -2.46 0.15 -1.41 0.00 2.20 -0.94 -0.02 119.74 117.26 1f52 s LYS 276 Ca -0.06 0.43 -0.14 0.00 -0.36 0.00 0.00 55.97 55.85 1f52 s LYS 276 Cb -0.01 -0.14 0.02 0.00 -1.51 0.00 0.00 37.83 36.19 1f52 s LYS 276 CO -0.03 -0.16 0.30 0.09 -0.36 0.00 0.00 175.35 175.20 1f52 n ASN 277 N 4.14 -1.16 0.00 1.43 3.02 -1.26 -0.47 115.26 120.96 1f52 n ASN 277 Ca -0.25 -1.27 0.00 0.00 -0.03 0.00 0.00 54.58 53.03 1f52 n ASN 277 Cb 0.53 -1.74 0.00 0.00 -0.61 0.00 0.00 39.78 37.95 1f52 n ASN 277 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1f52 n GLY 278 N -2.35 0.91 3.83 7.41 0.00 -1.26 -4.99 105.19 108.74 1f52 n GLY 278 Ca -0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 1f52 n GLY 278 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1f52 s THR 279 N -2.44 5.08 -0.76 2.61 -4.23 0.38 -5.05 115.64 111.24 1f52 s THR 279 Ca 0.00 -0.20 -0.26 0.00 -1.18 0.00 0.00 61.69 60.05 1f52 s THR 279 Cb 0.00 -3.31 0.04 0.00 1.34 0.00 0.00 72.50 70.57 1f52 s THR 279 CO 0.00 0.41 1.27 0.21 -0.54 0.00 0.00 174.62 175.97 1f52 s ASN 280 N -1.61 6.19 0.00 3.99 3.84 -1.26 -2.22 114.94 123.88 1f52 s ASN 280 Ca 0.22 -0.58 0.00 0.00 0.21 0.00 0.00 52.86 52.71 1f52 s ASN 280 Cb -0.12 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.03 1f52 s ASN 280 CO 0.13 -1.78 0.58 0.18 -2.79 0.00 0.00 177.10 173.42 1f52 n LEU 281 N 9.19 0.00 -0.00 3.21 4.32 -0.77 -1.90 117.00 131.06 1f52 n LEU 281 Ca 0.05 0.10 0.10 0.00 -0.02 0.00 0.00 56.01 56.24 1f52 n LEU 281 Cb 0.49 -0.10 -0.12 0.00 -1.62 0.00 0.00 43.42 42.07 1f52 n LEU 281 CO 0.70 -0.10 -0.08 0.49 -1.22 0.00 0.00 177.39 177.18 1f52 n PHE 282 N -1.08 0.00 -3.10 -1.77 3.01 -1.26 -4.53 117.46 108.73 1f52 n PHE 282 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1f52 n PHE 282 Cb 0.01 -0.02 -0.06 0.00 -0.01 0.00 0.00 39.48 39.40 1f52 n PHE 282 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1f52 s SER 283 N -3.02 7.10 0.00 4.37 1.04 -0.80 -0.36 113.70 122.04 1f52 s SER 283 Ca 0.07 1.43 0.00 0.00 0.48 0.00 0.00 55.95 57.94 1f52 s SER 283 Cb 0.16 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.85 1f52 s SER 283 CO 0.85 0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.76 1f52 n GLY 284 N 0.92 1.72 0.00 7.32 0.00 0.50 -3.93 105.19 111.73 1f52 n GLY 284 Ca -0.03 -0.78 0.10 0.00 0.00 0.00 0.00 46.02 45.30 1f52 n GLY 284 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f52 n ASP 285 N -0.24 0.88 -2.63 1.61 5.68 -1.18 -3.99 116.55 116.68 1f52 n ASP 285 Ca 0.00 -0.85 -0.04 0.00 -0.50 0.00 0.00 54.79 53.40 1f52 n ASP 285 Cb 0.00 0.98 0.03 0.00 -1.14 0.00 0.00 41.12 41.00 1f52 n ASP 285 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1f52 n LYS 286 N -1.56 -1.24 -1.48 0.11 4.76 -0.76 -4.79 118.16 113.19 1f52 n LYS 286 Ca 0.04 -0.25 -0.58 0.00 -2.87 0.00 0.00 58.31 54.65 1f52 n LYS 286 Cb 0.35 -0.23 -0.08 0.00 -1.84 0.00 0.00 35.03 33.23 1f52 n LYS 286 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1f52 n TYR 287 N -2.80 0.56 -1.53 2.13 9.36 -1.26 -2.14 117.16 121.48 1f52 n TYR 287 Ca 0.02 1.05 -0.10 0.00 3.32 0.00 0.00 57.90 62.19 1f52 n TYR 287 Cb 0.08 -2.07 -0.03 0.00 -0.63 0.00 0.00 39.34 36.69 1f52 n TYR 287 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1f52 n ALA 288 N 1.39 -0.29 -0.31 2.98 0.00 -1.26 -1.13 120.51 121.89 1f52 n ALA 288 Ca 0.20 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1f52 n ALA 288 Cb 0.09 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1f52 n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f52 n GLY 289 N -0.30 0.83 3.89 0.00 0.00 -0.91 -4.90 105.19 103.80 1f52 n GLY 289 Ca -0.10 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 1f52 n GLY 289 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f52 s LEU 290 N 0.00 3.90 0.52 0.99 1.43 -0.28 -0.37 118.68 124.86 1f52 s LEU 290 Ca 0.00 0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 54.01 1f52 s LEU 290 Cb 0.00 -3.81 -0.00 0.00 0.03 0.00 0.00 46.19 42.41 1f52 s LEU 290 CO 0.00 -0.34 0.79 -0.94 0.23 0.00 0.00 176.35 176.09 1f52 s SER 291 N -3.29 5.76 0.39 2.29 1.04 0.51 -1.83 113.70 118.57 1f52 s SER 291 Ca 0.48 0.56 0.28 0.00 0.48 0.00 0.00 55.95 57.75 1f52 s SER 291 Cb -0.10 -1.70 0.99 0.00 0.10 0.00 0.00 66.02 65.31 1f52 s SER 291 CO 0.32 -0.86 1.80 1.05 0.98 0.00 0.00 173.24 176.54 1f52 h GLU 292 N 0.10 0.00 -0.37 4.02 4.11 -1.90 -2.76 114.58 117.79 1f52 h GLU 292 Ca -0.46 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.90 1f52 h GLU 292 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1f52 h GLU 292 CO 0.59 0.00 -0.05 0.37 0.07 0.00 0.00 179.01 179.99 1f52 h GLN 293 N 0.00 0.68 -0.61 1.06 4.15 -1.93 -2.12 115.11 116.34 1f52 h GLN 293 Ca 0.00 -0.24 0.04 0.00 0.77 0.00 0.00 58.65 59.22 1f52 h GLN 293 Cb 0.59 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.18 1f52 h GLN 293 CO 0.00 0.82 0.35 0.00 -1.93 0.00 0.00 178.83 178.07 1f52 h ALA 294 N 0.84 0.80 -0.83 3.38 0.00 -1.73 -0.77 119.26 120.95 1f52 h ALA 294 Ca 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1f52 h ALA 294 Cb 0.54 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1f52 h ALA 294 CO 0.03 0.05 0.37 -0.07 0.00 0.00 0.00 179.25 179.64 1f52 h LEU 295 N 0.68 1.12 -0.69 0.00 3.38 -1.43 0.97 115.31 119.33 1f52 h LEU 295 Ca 0.26 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1f52 h LEU 295 Cb 0.10 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1f52 h LEU 295 CO -0.14 0.96 -0.11 1.88 0.09 0.00 0.00 178.44 181.13 1f52 h TYR 296 N 1.20 1.00 0.10 1.13 0.05 -0.81 0.01 116.97 119.65 1f52 h TYR 296 Ca 0.28 -0.19 0.01 0.00 0.05 0.00 0.00 58.73 58.88 1f52 h TYR 296 Cb 0.16 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 1f52 h TYR 296 CO 0.02 0.95 -0.11 -0.92 -1.05 0.00 0.00 178.16 177.05 1f52 h TYR 297 N 0.81 -0.29 -0.76 4.88 3.20 -0.45 0.90 116.97 125.26 1f52 h TYR 297 Ca 0.13 0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.09 1f52 h TYR 297 Cb 0.63 0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.94 1f52 h TYR 297 CO 0.04 -0.17 0.42 0.82 -1.64 0.00 0.00 178.16 177.62 1f52 h ILE 298 N -0.24 0.90 -0.91 1.81 2.04 -0.50 0.09 117.51 120.70 1f52 h ILE 298 Ca 0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1f52 h ILE 298 Cb 0.24 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.39 1f52 h ILE 298 CO -0.04 0.13 0.59 1.23 0.00 0.00 0.00 178.15 180.06 1f52 h GLY 299 N 0.72 1.30 0.87 5.37 0.00 -0.05 0.11 103.07 111.39 1f52 h GLY 299 Ca 0.37 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 1f52 h GLY 299 CO -0.24 0.49 0.04 -1.33 0.00 0.00 0.00 176.54 175.50 1f52 h GLY 300 N 1.25 0.14 0.72 4.60 0.00 0.10 0.86 103.07 110.74 1f52 h GLY 300 Ca 0.33 -0.08 0.05 0.00 0.00 0.00 0.00 47.33 47.64 1f52 h GLY 300 CO -0.07 0.07 0.40 -2.08 0.00 0.00 0.00 176.54 174.86 1f52 h VAL 301 N -0.01 1.00 -0.51 4.60 2.07 -0.74 -0.63 116.25 122.04 1f52 h VAL 301 Ca 0.03 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.18 1f52 h VAL 301 Cb 0.16 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1f52 h VAL 301 CO -0.00 0.13 -0.15 0.40 0.02 0.00 0.00 177.57 177.98 1f52 h ILE 302 N 0.74 1.27 -0.53 4.57 2.04 -0.75 0.22 117.51 125.07 1f52 h ILE 302 Ca 0.30 -1.30 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 1f52 h ILE 302 Cb 0.15 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1f52 h ILE 302 CO -0.17 0.46 0.21 0.50 0.00 0.00 0.00 178.15 179.15 1f52 h LYS 303 N 0.88 0.79 -0.55 2.37 3.64 0.06 -3.09 116.57 120.67 1f52 h LYS 303 Ca 0.13 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1f52 h LYS 303 Cb 0.71 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1f52 h LYS 303 CO 0.05 0.69 0.00 0.72 -2.27 0.00 0.00 179.45 178.65 1f52 n HIS 304 N -4.53 1.86 -0.04 1.91 8.25 -0.33 -4.72 115.22 117.63 1f52 n HIS 304 Ca 0.02 -0.73 -0.10 0.00 -0.26 0.00 0.00 57.72 56.65 1f52 n HIS 304 Cb 0.16 -0.45 -0.04 0.00 1.12 0.00 0.00 29.99 30.78 1f52 n HIS 304 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1f52 h ALA 305 N 3.76 -0.41 -0.75 -1.41 0.00 -0.86 -0.28 119.26 119.31 1f52 h ALA 305 Ca 0.00 0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.09 1f52 h ALA 305 Cb 1.84 0.72 -0.05 0.00 0.00 0.00 0.00 17.79 20.30 1f52 h ALA 305 CO 0.42 -0.83 0.50 0.87 0.00 0.00 0.00 179.25 180.21 1f52 h LYS 306 N -0.39 0.43 0.04 0.00 1.57 -1.86 0.93 116.57 117.29 1f52 h LYS 306 Ca 0.11 -0.03 -0.25 0.00 -1.87 0.00 0.00 60.65 58.61 1f52 h LYS 306 Cb 0.58 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.80 1f52 h LYS 306 CO -0.43 0.28 -1.05 0.00 -0.57 0.00 0.00 179.45 177.68 1f52 h ALA 307 N 1.64 0.23 -0.44 3.86 0.00 -1.53 -3.07 119.26 119.95 1f52 h ALA 307 Ca 0.37 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1f52 h ALA 307 Cb 0.81 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1f52 h ALA 307 CO -0.12 0.79 0.14 0.82 0.00 0.00 0.00 179.25 180.88 1f52 h ILE 308 N 0.25 1.18 -1.00 0.00 2.04 0.66 -2.31 117.51 118.33 1f52 h ILE 308 Ca -0.11 -0.61 0.19 0.00 1.00 0.00 0.00 64.86 65.33 1f52 h ILE 308 Cb 1.70 0.69 -0.10 0.00 -0.74 0.00 0.00 36.82 38.37 1f52 h ILE 308 CO 0.19 0.23 0.61 0.78 0.00 0.00 0.00 178.15 179.96 1f52 h ASN 309 N 0.63 0.78 0.00 1.72 -0.26 -0.81 0.34 115.58 117.99 1f52 h ASN 309 Ca 0.15 0.09 0.00 0.00 -0.56 0.00 0.00 56.30 55.98 1f52 h ASN 309 Cb 0.18 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 1f52 h ASN 309 CO -0.01 0.29 0.02 0.00 -1.06 0.00 0.00 177.43 176.66 1f52 h ALA 310 N 1.64 1.01 0.00 -0.83 0.00 -1.46 0.35 119.26 119.97 1f52 h ALA 310 Ca 0.57 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.40 1f52 h ALA 310 Cb 0.89 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1f52 h ALA 310 CO -0.37 -0.01 -1.30 1.28 0.00 0.00 0.00 179.25 178.84 1f52 n LEU 311 N -2.37 0.00 0.03 0.00 4.77 0.94 -4.26 117.00 116.10 1f52 n LEU 311 Ca -0.02 -0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.08 1f52 n LEU 311 Cb 0.06 0.11 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 1f52 n LEU 311 CO 0.11 0.11 0.22 0.00 -1.33 0.00 0.00 177.39 176.50 1f52 n ALA 312 N -2.16 3.33 -3.01 -1.18 0.00 0.31 -3.79 120.51 114.01 1f52 n ALA 312 Ca -0.07 -0.35 -0.17 0.00 0.00 0.00 0.00 53.44 52.85 1f52 n ALA 312 Cb 0.64 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 1f52 n ALA 312 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1f52 n ASN 313 N -1.88 -0.96 -0.39 0.00 3.02 0.12 -0.82 115.26 114.36 1f52 n ASN 313 Ca 0.03 -3.01 0.01 0.00 -0.03 0.00 0.00 54.58 51.58 1f52 n ASN 313 Cb 0.41 0.38 0.04 0.00 -0.61 0.00 0.00 39.78 40.00 1f52 n ASN 313 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1f52 n PRO 314 N 1.27 1.31 -4.24 3.52 -0.04 -1.24 -4.56 135.00 131.03 1f52 n PRO 314 Ca 0.16 -0.33 -0.19 0.00 -0.04 0.00 0.00 63.50 63.11 1f52 n PRO 314 Cb 0.59 -1.31 -0.11 0.00 -0.04 0.00 0.00 33.50 32.63 1f52 n PRO 314 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1f52 s THR 315 N -1.56 1.35 0.36 0.52 -4.23 -1.26 -5.00 115.64 105.81 1f52 s THR 315 Ca 0.06 -1.64 0.04 0.00 -1.18 0.00 0.00 61.69 58.97 1f52 s THR 315 Cb 0.04 -1.47 0.20 0.00 1.34 0.00 0.00 72.50 72.61 1f52 s THR 315 CO 0.03 -0.35 1.94 0.71 -0.54 0.00 0.00 174.62 176.41 1f52 h THR 316 N 3.68 1.17 -0.33 3.99 1.35 -1.95 -1.13 112.91 119.69 1f52 h THR 316 Ca -0.41 -0.55 0.01 0.00 -0.55 0.00 0.00 66.41 64.91 1f52 h THR 316 Cb 1.19 0.70 -0.02 0.00 -1.73 0.00 0.00 68.15 68.30 1f52 h THR 316 CO 0.48 0.21 0.22 -1.13 -0.25 0.00 0.00 175.52 175.05 1f52 h ASN 317 N 0.59 0.37 -0.91 5.36 -0.73 -1.96 -1.64 115.58 116.66 1f52 h ASN 317 Ca 0.14 -0.01 0.19 0.00 1.87 0.00 0.00 56.30 58.50 1f52 h ASN 317 Cb 0.15 -0.09 -0.07 0.00 0.27 0.00 0.00 38.32 38.58 1f52 h ASN 317 CO -0.01 0.27 0.59 0.28 -0.37 0.00 0.00 177.43 178.19 1f52 h SER 318 N 0.43 0.46 -0.02 1.15 0.02 -1.53 0.17 113.55 114.24 1f52 h SER 318 Ca 0.12 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1f52 h SER 318 Cb -0.03 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1f52 h SER 318 CO -0.03 0.19 0.00 -1.22 -1.14 0.00 0.00 176.83 174.63 1f52 n TYR 319 N -4.54 0.02 1.03 3.45 4.02 -0.62 -2.36 117.16 118.17 1f52 n TYR 319 Ca 0.19 -0.01 0.12 0.00 -0.01 0.00 0.00 57.90 58.19 1f52 n TYR 319 Cb 0.66 0.00 0.17 0.00 -0.02 0.00 0.00 39.34 40.15 1f52 n TYR 319 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1f52 n LYS 320 N -0.66 0.16 -0.05 -0.72 5.02 0.58 -3.86 118.16 118.64 1f52 n LYS 320 Ca 0.19 -0.11 -0.19 0.00 -2.02 0.00 0.00 58.31 56.19 1f52 n LYS 320 Cb 0.15 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.53 1f52 n LYS 320 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1f52 n ARG 321 N -1.32 0.71 -2.87 1.97 0.63 -1.00 -4.61 116.66 110.16 1f52 n ARG 321 Ca 0.06 0.21 -0.44 0.00 -0.92 0.00 0.00 57.85 56.76 1f52 n ARG 321 Cb 0.34 -1.63 0.00 0.00 0.45 0.00 0.00 32.46 31.62 1f52 n ARG 321 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1f52 n LEU 322 N -3.35 5.48 -4.11 6.15 4.77 -1.11 -4.88 117.00 119.96 1f52 n LEU 322 Ca -0.37 -4.53 -0.15 0.00 -0.03 0.00 0.00 56.01 50.93 1f52 n LEU 322 Cb 1.03 -1.58 -0.12 0.00 -2.33 0.00 0.00 43.42 40.42 1f52 n LEU 322 CO 0.37 0.88 -0.42 0.68 -1.33 0.00 0.00 177.39 177.56 1f52 s VAL 323 N 1.16 0.75 -0.73 4.08 -7.23 -1.26 -4.82 120.40 112.34 1f52 s VAL 323 Ca 0.42 -1.20 -0.13 0.00 -1.81 0.00 0.00 61.98 59.26 1f52 s VAL 323 Cb -0.01 -0.81 -0.20 0.00 0.56 0.00 0.00 36.38 35.91 1f52 s VAL 323 CO 0.00 -0.35 1.94 -2.65 -0.31 0.00 0.00 175.10 173.74 1f52 n PRO 324 N 1.33 0.14 -4.60 4.82 -0.02 -1.26 -4.69 135.00 130.72 1f52 n PRO 324 Ca -0.22 -0.41 -0.30 0.00 -2.02 0.00 0.00 63.50 60.56 1f52 n PRO 324 Cb 0.55 -1.98 -0.07 0.00 -0.02 0.00 0.00 33.50 31.98 1f52 n PRO 324 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f52 n GLY 325 N 5.65 3.40 0.12 -1.23 0.00 -1.26 -5.06 105.19 106.81 1f52 n GLY 325 Ca 0.44 -2.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 1f52 n GLY 325 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1f52 h TYR 326 N 1.46 -0.17 -0.10 1.61 0.05 -1.99 -3.30 116.97 114.54 1f52 h TYR 326 Ca -0.38 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.40 1f52 h TYR 326 Cb 1.27 0.06 0.00 0.00 1.01 0.00 0.00 36.73 39.07 1f52 h TYR 326 CO 0.00 0.28 0.00 0.39 -1.05 0.00 0.00 178.16 177.78 1f52 n GLU 327 N -4.88 1.49 -1.63 4.88 1.02 -1.26 -4.71 120.64 115.54 1f52 n GLU 327 Ca -0.07 -0.73 -0.43 0.00 -0.02 0.00 0.00 57.16 55.91 1f52 n GLU 327 Cb 0.26 -1.38 -0.03 0.00 -0.02 0.00 0.00 31.44 30.27 1f52 n GLU 327 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1f52 n ALA 328 N -0.06 1.63 -0.60 0.62 0.00 -1.24 -4.82 120.51 116.04 1f52 n ALA 328 Ca 0.16 0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.53 1f52 n ALA 328 Cb 0.25 -2.77 -0.08 0.00 0.00 0.00 0.00 19.45 16.85 1f52 n ALA 328 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1f52 n PRO 329 N 7.99 1.35 -0.00 0.00 -0.02 -1.26 -4.37 135.00 138.69 1f52 n PRO 329 Ca 0.24 -0.77 0.09 0.00 -2.02 0.00 0.00 63.50 61.04 1f52 n PRO 329 Cb 0.42 -1.94 -0.11 0.00 -0.02 0.00 0.00 33.50 31.84 1f52 n PRO 329 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1f52 n VAL 330 N 3.07 0.00 -2.77 -1.45 0.24 -1.25 -4.37 118.33 111.79 1f52 n VAL 330 Ca 0.29 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.34 62.00 1f52 n VAL 330 Cb 0.43 0.74 -0.03 0.00 -1.47 0.00 0.00 33.84 33.51 1f52 n VAL 330 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1f52 s MET 331 N -2.88 4.12 -1.19 7.34 -1.94 -1.19 -2.37 119.30 121.20 1f52 s MET 331 Ca 0.03 1.01 -0.22 0.00 -1.71 0.00 0.00 55.69 54.80 1f52 s MET 331 Cb 0.13 -3.69 -0.07 0.00 2.01 0.00 0.00 34.83 33.22 1f52 s MET 331 CO 0.76 -0.69 1.91 1.28 -0.01 0.00 0.00 175.02 178.27 1f52 n LEU 332 N 6.37 3.44 -3.91 -0.03 4.32 -0.48 -1.10 117.00 125.61 1f52 n LEU 332 Ca 0.09 -3.29 -0.08 0.00 -0.02 0.00 0.00 56.01 52.71 1f52 n LEU 332 Cb 0.47 -1.71 -0.03 0.00 -1.62 0.00 0.00 43.42 40.53 1f52 n LEU 332 CO 0.52 -1.43 0.37 0.00 -1.22 0.00 0.00 177.39 175.63 1f52 s ALA 333 N 9.66 -0.85 0.24 -1.18 0.00 -1.26 -4.61 121.76 123.76 1f52 s ALA 333 Ca 0.65 -0.53 0.11 0.00 0.00 0.00 0.00 51.96 52.19 1f52 s ALA 333 Cb 0.01 0.92 -0.05 0.00 0.00 0.00 0.00 23.12 24.00 1f52 s ALA 333 CO 0.13 -0.97 -0.20 1.52 0.00 0.00 0.00 175.76 176.24 1f52 s TYR 334 N -3.88 2.15 -0.22 0.00 1.13 -1.26 -1.99 117.35 113.28 1f52 s TYR 334 Ca 0.15 -0.39 -0.36 0.00 -1.41 0.00 0.00 57.07 55.06 1f52 s TYR 334 Cb -0.04 -0.98 0.14 0.00 -1.10 0.00 0.00 41.96 39.98 1f52 s TYR 334 CO 0.08 0.58 1.26 0.45 -2.51 0.00 0.00 175.55 175.41 1f52 s SER 335 N -3.23 -0.10 0.00 -0.18 0.15 -0.86 -1.55 113.70 107.94 1f52 s SER 335 Ca 0.26 0.00 0.22 0.00 0.70 0.00 0.00 55.95 57.13 1f52 s SER 335 Cb -0.05 0.10 0.01 0.00 -1.71 0.00 0.00 66.02 64.37 1f52 s SER 335 CO 0.12 -0.17 1.08 0.00 1.20 0.00 0.00 173.24 175.47 1f52 n ALA 336 N -0.06 3.43 0.08 5.45 0.00 -1.26 -0.18 120.51 127.97 1f52 n ALA 336 Ca 0.02 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1f52 n ALA 336 Cb 0.58 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1f52 n ALA 336 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1f52 n ARG 337 N 0.10 0.00 -1.51 0.00 1.85 -1.26 -4.71 116.66 111.12 1f52 n ARG 337 Ca 0.09 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.56 1f52 n ARG 337 Cb 0.47 -0.16 -0.13 0.00 -1.05 0.00 0.00 32.46 31.58 1f52 n ARG 337 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1f52 n ASN 338 N -3.26 0.60 -1.87 2.89 5.15 -1.26 -4.77 115.26 112.73 1f52 n ASN 338 Ca 0.00 -0.04 -0.12 0.00 -0.60 0.00 0.00 54.58 53.82 1f52 n ASN 338 Cb 0.00 -1.04 -0.03 0.00 -0.53 0.00 0.00 39.78 38.18 1f52 n ASN 338 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1f52 n ARG 339 N 8.39 1.66 -0.02 1.20 1.74 -1.26 -2.13 116.66 126.24 1f52 n ARG 339 Ca 0.60 -1.06 -0.01 0.00 -0.77 0.00 0.00 57.85 56.61 1f52 n ARG 339 Cb 0.15 -1.56 -0.05 0.00 -1.02 0.00 0.00 32.46 29.98 1f52 n ARG 339 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1f52 n SER 340 N 1.20 3.60 -4.71 0.55 7.64 -1.26 -4.64 113.62 116.00 1f52 n SER 340 Ca 0.25 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.71 1f52 n SER 340 Cb 0.61 0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 64.62 1f52 n SER 340 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f52 s ALA 341 N -2.23 3.44 -1.25 -0.43 0.00 -0.91 -3.15 121.76 117.23 1f52 s ALA 341 Ca -0.03 0.89 0.19 0.00 0.00 0.00 0.00 51.96 53.01 1f52 s ALA 341 Cb 0.02 -3.47 0.90 0.00 0.00 0.00 0.00 23.12 20.57 1f52 s ALA 341 CO 0.24 -0.49 1.60 -1.13 0.00 0.00 0.00 175.76 175.97 1f52 n SER 342 N 4.03 0.00 -3.91 0.00 3.41 -0.26 -4.36 113.62 112.54 1f52 n SER 342 Ca 0.10 0.22 -0.30 0.00 -0.26 0.00 0.00 58.87 58.62 1f52 n SER 342 Cb 0.46 -0.37 -0.15 0.00 -0.26 0.00 0.00 64.21 63.88 1f52 n SER 342 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1f52 s ILE 343 N -2.75 1.53 0.11 -1.33 1.01 -0.84 0.67 121.20 119.60 1f52 s ILE 343 Ca 0.14 -1.49 -0.07 0.00 0.00 0.00 0.00 60.65 59.24 1f52 s ILE 343 Cb 0.13 -1.95 -0.06 0.00 0.01 0.00 0.00 42.46 40.59 1f52 s ILE 343 CO 0.31 -0.34 0.38 -0.60 0.00 0.00 0.00 174.94 174.69 1f52 s ARG 344 N 1.34 3.66 -0.34 2.79 3.52 -0.01 -2.02 118.95 127.90 1f52 s ARG 344 Ca 0.01 -0.00 -0.03 0.00 -0.13 0.00 0.00 55.73 55.58 1f52 s ARG 344 Cb -0.18 -2.91 0.06 0.00 -1.56 0.00 0.00 34.95 30.36 1f52 s ARG 344 CO -0.11 0.51 0.08 0.42 -0.81 0.00 0.00 175.30 175.39 1f52 s ILE 345 N -1.55 3.22 0.29 4.11 -1.09 0.74 -0.76 121.20 126.16 1f52 s ILE 345 Ca 0.37 -1.52 -0.30 0.00 -2.23 0.00 0.00 60.65 56.97 1f52 s ILE 345 Cb -0.13 -2.95 -0.12 0.00 -1.58 0.00 0.00 42.46 37.69 1f52 s ILE 345 CO 0.22 -0.28 1.61 -2.65 -1.23 0.00 0.00 174.94 172.60 1f52 n PRO 346 N 4.65 2.71 -3.40 2.79 -0.02 -1.26 -4.32 135.00 136.15 1f52 n PRO 346 Ca -0.10 0.97 -0.41 0.00 -2.02 0.00 0.00 63.50 61.93 1f52 n PRO 346 Cb 0.43 -2.76 -0.09 0.00 -0.02 0.00 0.00 33.50 31.06 1f52 n PRO 346 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1f52 s VAL 347 N 0.10 5.17 0.07 -1.45 1.01 -1.26 -4.82 120.40 119.23 1f52 s VAL 347 Ca 0.65 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.51 1f52 s VAL 347 Cb -0.50 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 1f52 s VAL 347 CO 0.47 -0.19 -0.08 0.54 0.00 0.00 0.00 175.10 175.84 1f52 s VAL 348 N 1.98 0.72 -0.02 2.92 0.11 -1.26 -5.11 120.40 119.75 1f52 s VAL 348 Ca 0.11 -1.49 -0.06 0.00 -2.93 0.00 0.00 61.98 57.61 1f52 s VAL 348 Cb -0.17 -1.14 -0.03 0.00 -1.53 0.00 0.00 36.38 33.51 1f52 s VAL 348 CO 0.12 -0.56 0.41 0.00 -3.33 0.00 0.00 175.10 171.73 1f52 h ALA 349 N 3.80 -0.38 -2.31 1.54 0.00 -1.97 -3.45 119.26 116.49 1f52 h ALA 349 Ca -0.36 -0.04 -0.55 0.00 0.00 0.00 0.00 54.91 53.95 1f52 h ALA 349 Cb 1.19 0.08 0.03 0.00 0.00 0.00 0.00 17.79 19.08 1f52 h ALA 349 CO 0.51 -0.36 1.15 0.45 0.00 0.00 0.00 179.25 180.99 1f52 n SER 350 N -3.42 3.91 0.14 0.00 2.88 -1.26 -4.83 113.62 111.03 1f52 n SER 350 Ca -0.03 0.95 0.11 0.00 -1.33 0.00 0.00 58.87 58.58 1f52 n SER 350 Cb 0.08 -1.49 0.52 0.00 -0.75 0.00 0.00 64.21 62.57 1f52 n SER 350 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1f52 n PRO 351 N 6.56 0.16 0.28 -1.46 -0.02 -1.26 -1.63 135.00 137.64 1f52 n PRO 351 Ca 0.20 0.52 0.17 0.00 -2.02 0.00 0.00 63.50 62.37 1f52 n PRO 351 Cb 0.36 -1.90 0.78 0.00 -0.02 0.00 0.00 33.50 32.73 1f52 n PRO 351 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1f52 h LYS 352 N 0.00 0.00 -0.44 -0.52 1.57 -1.95 -2.88 116.57 112.35 1f52 h LYS 352 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1f52 h LYS 352 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1f52 h LYS 352 CO 0.00 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 178.91 1f52 n ALA 353 N -2.12 2.64 -1.93 3.86 0.00 -0.65 -4.84 120.51 117.48 1f52 n ALA 353 Ca -0.00 -1.57 -0.41 0.00 0.00 0.00 0.00 53.44 51.46 1f52 n ALA 353 Cb 0.26 -0.70 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 1f52 n ALA 353 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1f52 s ARG 354 N -1.68 4.39 0.20 0.00 6.06 -1.09 -4.95 118.95 121.88 1f52 s ARG 354 Ca 0.38 2.09 -0.22 0.00 -2.50 0.00 0.00 55.73 55.47 1f52 s ARG 354 Cb 0.24 -3.16 0.07 0.00 0.06 0.00 0.00 34.95 32.16 1f52 s ARG 354 CO 0.18 -0.22 1.01 -0.98 -2.50 0.00 0.00 175.30 172.79 1f52 s ARG 355 N -0.55 1.37 0.17 5.12 1.70 -1.26 -4.71 118.95 120.78 1f52 s ARG 355 Ca 0.55 -0.86 0.10 0.00 -0.47 0.00 0.00 55.73 55.05 1f52 s ARG 355 Cb -0.37 0.39 -0.04 0.00 -0.57 0.00 0.00 34.95 34.36 1f52 s ARG 355 CO 0.42 -0.64 -0.19 0.96 -1.08 0.00 0.00 175.30 174.76 1f52 s ILE 356 N -2.35 2.66 -0.29 4.99 -4.36 -0.42 -4.23 121.20 117.21 1f52 s ILE 356 Ca 0.20 -1.80 0.03 0.00 -0.26 0.00 0.00 60.65 58.82 1f52 s ILE 356 Cb -0.03 -2.27 0.07 0.00 1.25 0.00 0.00 42.46 41.49 1f52 s ILE 356 CO 0.05 -0.05 -0.05 -0.70 0.24 0.00 0.00 174.94 174.44 1f52 s GLU 357 N -2.54 1.91 -0.38 0.37 2.12 0.06 -0.50 118.70 119.73 1f52 s GLU 357 Ca 0.20 -1.50 -0.24 0.00 0.36 0.00 0.00 54.97 53.80 1f52 s GLU 357 Cb -0.09 -2.96 0.01 0.00 0.26 0.00 0.00 34.13 31.36 1f52 s GLU 357 CO 0.11 -0.71 0.83 0.08 -0.54 0.00 0.00 175.26 175.03 1f52 s VAL 358 N 1.06 4.66 -0.65 3.70 1.01 0.60 -0.83 120.40 129.96 1f52 s VAL 358 Ca -0.02 0.90 0.25 0.00 0.00 0.00 0.00 61.98 63.11 1f52 s VAL 358 Cb -0.20 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 32.02 1f52 s VAL 358 CO -0.06 -0.53 1.43 0.03 0.00 0.00 0.00 175.10 175.97 1f52 h ARG 359 N 8.59 0.00 0.00 2.72 2.47 -0.05 0.56 114.38 128.66 1f52 h ARG 359 Ca -0.24 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.43 1f52 h ARG 359 Cb 1.09 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 1f52 h ARG 359 CO 0.94 0.00 -0.27 0.27 0.56 0.00 0.00 179.97 181.47 1f52 h PHE 360 N 0.00 0.00 -2.91 3.04 -0.00 -1.77 -3.41 116.94 111.90 1f52 h PHE 360 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 57.97 57.40 1f52 h PHE 360 Cb 0.75 0.00 0.18 0.00 -0.00 0.00 0.00 35.95 36.88 1f52 h PHE 360 CO 0.00 0.23 -0.54 -2.30 -0.00 0.00 0.00 178.31 175.70 1f52 n PRO 361 N -3.14 0.35 -4.38 6.09 -0.02 -1.26 -4.83 135.00 127.81 1f52 n PRO 361 Ca 0.03 0.15 -0.19 0.00 -2.02 0.00 0.00 63.50 61.46 1f52 n PRO 361 Cb 0.63 -1.64 -0.10 0.00 -0.02 0.00 0.00 33.50 32.37 1f52 n PRO 361 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1f52 s ASP 362 N -1.26 2.42 0.00 2.55 1.47 0.00 -0.62 116.67 121.24 1f52 s ASP 362 Ca 0.65 -1.15 0.05 0.00 1.18 0.00 0.00 52.55 53.27 1f52 s ASP 362 Cb -0.40 -0.11 0.21 0.00 -0.34 0.00 0.00 42.92 42.29 1f52 s ASP 362 CO 0.58 -0.35 1.09 -2.65 0.68 0.00 0.00 175.17 174.52 1f52 n PRO 363 N -0.48 0.02 0.15 2.11 -0.02 -1.26 -1.76 135.00 133.77 1f52 n PRO 363 Ca -0.06 0.36 0.13 0.00 -2.02 0.00 0.00 63.50 61.91 1f52 n PRO 363 Cb 0.63 -1.50 0.41 0.00 -0.02 0.00 0.00 33.50 33.01 1f52 n PRO 363 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f52 h ALA 364 N 2.18 1.00 -2.92 3.55 0.00 -1.88 -3.46 119.26 117.73 1f52 h ALA 364 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1f52 h ALA 364 Cb 0.07 0.00 0.09 0.00 0.00 0.00 0.00 17.79 17.95 1f52 h ALA 364 CO 0.00 0.00 0.71 0.00 0.00 0.00 0.00 179.25 179.96 1f52 s ALA 365 N -3.23 3.51 0.04 0.00 0.00 -0.72 -4.83 121.76 116.53 1f52 s ALA 365 Ca 0.08 1.42 -0.30 0.00 0.00 0.00 0.00 51.96 53.16 1f52 s ALA 365 Cb 0.10 -3.55 -0.08 0.00 0.00 0.00 0.00 23.12 19.59 1f52 s ALA 365 CO 0.56 -0.88 1.77 1.21 0.00 0.00 0.00 175.76 178.42 1f52 s ASN 366 N -0.33 6.55 0.11 0.00 3.84 -1.25 -4.89 114.94 118.97 1f52 s ASN 366 Ca 0.52 2.52 -0.34 0.00 0.21 0.00 0.00 52.86 55.77 1f52 s ASN 366 Cb -0.43 -2.55 -0.13 0.00 -0.55 0.00 0.00 41.25 37.59 1f52 s ASN 366 CO 0.58 -0.96 1.56 -0.65 -2.79 0.00 0.00 177.10 174.83 1f52 h PRO 367 N 9.31 -0.62 0.04 0.43 0.11 -1.89 0.08 132.00 139.46 1f52 h PRO 367 Ca -0.44 0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.72 1f52 h PRO 367 Cb 1.21 0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.41 1f52 h PRO 367 CO 0.94 -0.41 -0.45 1.88 -0.21 0.00 0.00 178.00 179.74 1f52 h TYR 368 N -0.64 -1.33 -0.23 0.65 -1.99 -1.88 0.12 116.97 111.66 1f52 h TYR 368 Ca 0.02 0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.72 1f52 h TYR 368 Cb 0.71 0.57 -0.01 0.00 2.00 0.00 0.00 36.73 40.00 1f52 h TYR 368 CO -0.54 -0.50 -0.17 -0.07 -0.00 0.00 0.00 178.16 176.89 1f52 h LEU 369 N -0.60 0.39 0.01 3.88 3.38 -1.78 -0.38 115.31 120.21 1f52 h LEU 369 Ca 0.00 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1f52 h LEU 369 Cb 0.62 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1f52 h LEU 369 CO -0.28 0.58 -0.01 0.00 0.09 0.00 0.00 178.44 178.82 1f52 h PHE 371 N -0.46 0.28 -0.24 0.00 0.05 -0.67 -1.84 116.94 114.06 1f52 h PHE 371 Ca -0.00 0.01 0.05 0.00 3.82 0.00 0.00 57.97 61.84 1f52 h PHE 371 Cb 0.44 -0.09 -0.05 0.00 2.00 0.00 0.00 35.95 38.25 1f52 h PHE 371 CO 0.08 0.18 -0.06 0.00 -0.18 0.00 0.00 178.31 178.32 1f52 h ALA 372 N 1.08 0.16 -0.40 2.45 0.00 -1.07 -0.99 119.26 120.48 1f52 h ALA 372 Ca 0.08 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1f52 h ALA 372 Cb -0.04 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1f52 h ALA 372 CO -0.02 -0.47 0.22 0.00 0.00 0.00 0.00 179.25 178.98 1f52 h ALA 373 N 1.23 1.64 -0.41 0.00 0.00 -1.10 -0.38 119.26 120.23 1f52 h ALA 373 Ca 0.12 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1f52 h ALA 373 Cb 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1f52 h ALA 373 CO -0.25 0.31 0.04 -0.07 0.00 0.00 0.00 179.25 179.28 1f52 h LEU 374 N 0.55 0.68 0.84 0.00 4.07 -0.37 -2.29 115.31 118.79 1f52 h LEU 374 Ca 0.14 -0.28 -0.04 0.00 0.08 0.00 0.00 57.88 57.78 1f52 h LEU 374 Cb 0.01 -0.18 0.01 0.00 1.08 0.00 0.00 40.66 41.58 1f52 h LEU 374 CO -0.02 0.79 -0.40 0.25 -1.08 0.00 0.00 178.44 177.97 1f52 h LEU 375 N 0.54 -0.96 -1.18 1.67 6.46 -0.23 -1.86 115.31 119.75 1f52 h LEU 375 Ca 0.12 0.03 0.21 0.00 -0.12 0.00 0.00 57.88 58.12 1f52 h LEU 375 Cb 0.42 0.25 -0.10 0.00 -0.73 0.00 0.00 40.66 40.50 1f52 h LEU 375 CO 0.01 -0.62 0.62 0.24 -0.62 0.00 0.00 178.44 178.08 1f52 h MET 376 N -1.26 0.59 -0.43 1.25 2.86 -1.16 0.35 114.93 117.13 1f52 h MET 376 Ca -0.12 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.36 1f52 h MET 376 Cb 0.87 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 1f52 h MET 376 CO 0.19 0.39 -0.25 0.00 1.06 0.00 0.00 176.91 178.30 1f52 h ALA 377 N 1.64 0.74 -0.27 6.32 0.00 -1.31 -1.16 119.26 125.21 1f52 h ALA 377 Ca 0.56 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1f52 h ALA 377 Cb 1.09 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1f52 h ALA 377 CO -0.33 0.66 0.06 0.78 0.00 0.00 0.00 179.25 180.42 1f52 h GLY 378 N 0.90 0.47 0.98 0.00 0.00 0.40 -1.88 103.07 103.96 1f52 h GLY 378 Ca 0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1f52 h GLY 378 CO 0.07 0.28 0.29 1.41 0.00 0.00 0.00 176.54 178.59 1f52 h LEU 379 N 0.27 0.66 -2.11 3.11 3.38 -0.65 -0.27 115.31 119.69 1f52 h LEU 379 Ca 0.08 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1f52 h LEU 379 Cb 0.31 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1f52 h LEU 379 CO 0.00 0.56 -0.06 -0.78 0.09 0.00 0.00 178.44 178.25 1f52 h ASP 380 N 0.70 0.00 0.61 -0.43 3.58 -1.12 0.24 116.42 120.01 1f52 h ASP 380 Ca 0.18 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.44 1f52 h ASP 380 Cb 0.05 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 1f52 h ASP 380 CO -0.03 0.06 -0.87 1.23 -2.88 0.00 0.00 179.24 176.75 1f52 h GLY 381 N 0.88 0.19 0.10 -0.78 0.00 -0.23 -2.87 103.07 100.36 1f52 h GLY 381 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1f52 h GLY 381 CO 0.01 0.30 -0.05 -2.22 0.00 0.00 0.00 176.54 174.58 1f52 h ILE 382 N 0.09 0.00 -1.02 2.60 2.04 -0.17 0.22 117.51 121.27 1f52 h ILE 382 Ca -0.04 -0.68 0.35 0.00 1.00 0.00 0.00 64.86 65.49 1f52 h ILE 382 Cb 1.50 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 37.42 1f52 h ILE 382 CO 0.13 0.00 0.58 0.11 0.00 0.00 0.00 178.15 178.97 1f52 h LYS 383 N -0.82 0.23 -0.47 2.37 1.57 -0.72 0.52 116.57 119.23 1f52 h LYS 383 Ca -0.01 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1f52 h LYS 383 Cb 0.11 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1f52 h LYS 383 CO 0.02 0.15 0.02 0.09 -0.57 0.00 0.00 179.45 179.16 1f52 n ASN 384 N -5.08 5.03 -3.89 0.86 5.03 -1.08 -4.97 115.26 111.16 1f52 n ASN 384 Ca 0.34 -3.00 -0.26 0.00 0.87 0.00 0.00 54.58 52.53 1f52 n ASN 384 Cb 1.08 -0.64 -0.06 0.00 -1.02 0.00 0.00 39.78 39.14 1f52 n ASN 384 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1f52 n LYS 385 N 0.16 -0.85 -2.33 3.52 5.02 0.18 -4.80 118.16 119.06 1f52 n LYS 385 Ca 0.27 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 56.17 1f52 n LYS 385 Cb 1.11 -2.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 1f52 n LYS 385 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1f52 s ILE 386 N -4.01 3.78 0.03 -0.18 1.01 0.72 -4.96 121.20 117.58 1f52 s ILE 386 Ca 0.07 0.72 -0.30 0.00 0.00 0.00 0.00 60.65 61.14 1f52 s ILE 386 Cb -0.04 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1f52 s ILE 386 CO 0.75 -0.96 1.00 -2.28 0.00 0.00 0.00 174.94 173.45 1f52 s HIS 387 N 6.08 3.66 0.48 3.97 2.46 -1.26 -4.20 115.29 126.49 1f52 s HIS 387 Ca 0.58 1.67 0.25 0.00 0.47 0.00 0.00 55.06 58.04 1f52 s HIS 387 Cb -0.13 -3.15 1.31 0.00 -0.13 0.00 0.00 32.58 30.48 1f52 s HIS 387 CO 0.28 -0.13 1.87 -1.35 -2.47 0.00 0.00 174.74 172.94 1f52 h PRO 388 N 6.51 0.17 0.00 2.88 0.11 -1.92 -3.47 132.00 136.29 1f52 h PRO 388 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1f52 h PRO 388 Cb 1.22 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1f52 h PRO 388 CO 0.75 0.12 0.00 0.41 -0.21 0.00 0.00 178.00 179.07 1f52 n GLY 389 N -1.62 -1.73 3.89 -0.55 0.00 -1.26 -4.92 105.19 99.00 1f52 n GLY 389 Ca 0.19 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.29 1f52 n GLY 389 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f52 s GLU 390 N 0.00 3.71 0.37 1.61 0.41 -1.26 -5.06 118.70 118.48 1f52 s GLU 390 Ca 0.00 0.12 -0.27 0.00 -0.41 0.00 0.00 54.97 54.41 1f52 s GLU 390 Cb 0.00 -2.68 -0.09 0.00 -1.78 0.00 0.00 34.13 29.58 1f52 s GLU 390 CO 0.00 0.30 1.25 -2.14 -0.49 0.00 0.00 175.26 174.18 1f52 s PRO 391 N -3.05 4.16 -0.29 0.39 0.02 -1.26 -4.85 135.00 130.11 1f52 s PRO 391 Ca 0.45 2.06 -0.20 0.00 0.02 0.00 0.00 61.00 63.32 1f52 s PRO 391 Cb -0.11 -2.86 -0.01 0.00 0.02 0.00 0.00 34.50 31.54 1f52 s PRO 391 CO 0.25 -0.30 0.64 -1.64 -0.33 0.00 0.00 177.00 175.62 1f52 s MET 392 N -2.06 3.96 0.00 5.54 -1.94 -0.59 -4.88 119.30 119.32 1f52 s MET 392 Ca 0.54 0.38 0.00 0.00 -1.71 0.00 0.00 55.69 54.90 1f52 s MET 392 Cb -0.36 -3.71 0.00 0.00 2.01 0.00 0.00 34.83 32.77 1f52 s MET 392 CO 0.47 -0.54 0.72 -0.25 -0.01 0.00 0.00 175.02 175.41 1f52 n ASP 393 N 5.85 1.37 0.00 3.03 8.00 -1.26 -4.50 116.55 129.05 1f52 n ASP 393 Ca -0.01 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.00 1f52 n ASP 393 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1f52 n ASP 393 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1f52 n LYS 394 N -0.25 0.00 -3.71 -1.24 4.76 -1.26 -4.81 118.16 111.66 1f52 n LYS 394 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 1f52 n LYS 394 Cb 0.17 -0.07 0.00 0.00 -1.84 0.00 0.00 35.03 33.30 1f52 n LYS 394 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1f52 n ASN 395 N 0.00 -1.80 0.00 4.39 5.15 -1.26 -5.01 115.26 116.74 1f52 n ASN 395 Ca 0.00 -2.62 0.00 0.00 -0.60 0.00 0.00 54.58 51.36 1f52 n ASN 395 Cb 0.00 3.10 0.00 0.00 -0.53 0.00 0.00 39.78 42.35 1f52 n ASN 395 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1f52 n LEU 396 N 0.00 0.00 0.04 1.20 -0.00 -1.26 -4.71 117.00 112.27 1f52 n LEU 396 Ca -0.05 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.08 1f52 n LEU 396 Cb 0.56 0.00 0.12 0.00 -0.00 0.00 0.00 43.42 44.09 1f52 n LEU 396 CO 0.27 0.00 0.21 0.00 -0.00 0.00 0.00 177.39 177.87 1f52 n TYR 397 N 0.00 0.41 -4.71 1.47 4.11 -1.26 -4.15 117.16 113.04 1f52 n TYR 397 Ca 0.00 0.12 -0.33 0.00 -0.00 0.00 0.00 57.90 57.69 1f52 n TYR 397 Cb 0.00 -0.55 -0.13 0.00 -0.00 0.00 0.00 39.34 38.66 1f52 n TYR 397 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1f52 s ASP 398 N -4.05 4.25 -0.17 9.48 -1.08 -1.26 -4.33 116.67 119.51 1f52 s ASP 398 Ca 0.05 -0.22 -0.15 0.00 -0.52 0.00 0.00 52.55 51.71 1f52 s ASP 398 Cb 0.14 -1.45 0.02 0.00 -1.46 0.00 0.00 42.92 40.17 1f52 s ASP 398 CO 0.75 0.23 0.25 0.00 0.52 0.00 0.00 175.17 176.92 1f52 n LEU 399 N 3.13 -1.69 0.00 -1.34 -0.00 -1.26 -4.63 117.00 111.21 1f52 n LEU 399 Ca -0.18 0.02 0.00 0.00 -0.00 0.00 0.00 56.01 55.85 1f52 n LEU 399 Cb 0.53 -0.94 0.00 0.00 -0.00 0.00 0.00 43.42 43.01 1f52 n LEU 399 CO 0.30 -0.30 0.00 -2.65 -0.00 0.00 0.00 177.39 174.74 1f52 n PRO 400 N 0.28 0.00 -1.28 1.47 -0.02 -1.26 -4.62 135.00 129.57 1f52 n PRO 400 Ca -0.03 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.44 1f52 n PRO 400 Cb 0.37 -0.11 -0.00 0.00 -0.02 0.00 0.00 33.50 33.74 1f52 n PRO 400 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1f52 n PRO 401 N 0.00 -1.35 0.00 0.52 -0.02 -1.26 -4.83 135.00 128.06 1f52 n PRO 401 Ca 0.00 0.06 -0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1f52 n PRO 401 Cb 0.00 -4.16 -0.00 0.00 -0.02 0.00 0.00 33.50 29.32 1f52 n PRO 401 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1f52 h GLU 402 N 0.00 -0.01 -1.00 -0.52 5.08 -1.97 -3.31 114.58 112.86 1f52 h GLU 402 Ca -0.02 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.07 1f52 h GLU 402 Cb 0.23 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.32 1f52 h GLU 402 CO 0.03 -0.00 0.34 -0.85 -1.00 0.00 0.00 179.01 177.52 1f52 n GLU 403 N -2.05 1.66 -0.78 2.33 0.28 -1.26 -4.74 120.64 116.08 1f52 n GLU 403 Ca -0.00 -1.57 0.00 0.00 -0.16 0.00 0.00 57.16 55.43 1f52 n GLU 403 Cb 0.00 -1.62 0.00 0.00 1.43 0.00 0.00 31.44 31.26 1f52 n GLU 403 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1f52 n ALA 404 N -0.35 0.00 -4.51 -1.84 0.00 -1.25 -3.86 120.51 108.70 1f52 n ALA 404 Ca 0.31 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.34 1f52 n ALA 404 Cb 1.11 -0.68 -0.08 0.00 0.00 0.00 0.00 19.45 19.80 1f52 n ALA 404 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1f52 n LYS 405 N -1.63 -0.75 -2.31 0.00 3.00 -1.26 -4.82 118.16 110.39 1f52 n LYS 405 Ca 0.00 0.13 -0.43 0.00 -0.00 0.00 0.00 58.31 58.01 1f52 n LYS 405 Cb 0.08 -4.53 0.00 0.00 0.00 0.00 0.00 35.03 30.58 1f52 n LYS 405 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1f52 n GLU 406 N -4.14 3.17 -3.01 1.64 0.28 -1.25 -4.90 120.64 112.43 1f52 n GLU 406 Ca 0.05 -3.17 -0.20 0.00 -0.16 0.00 0.00 57.16 53.68 1f52 n GLU 406 Cb 0.49 -3.27 0.07 0.00 1.43 0.00 0.00 31.44 30.16 1f52 n GLU 406 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 1f52 s ILE 407 N 2.91 2.05 0.12 3.84 -4.36 -1.26 -5.04 121.20 119.45 1f52 s ILE 407 Ca 0.48 -0.97 -0.35 0.00 -0.26 0.00 0.00 60.65 59.55 1f52 s ILE 407 Cb 0.07 -2.08 -0.17 0.00 1.25 0.00 0.00 42.46 41.54 1f52 s ILE 407 CO -0.00 0.00 1.13 -2.65 0.24 0.00 0.00 174.94 173.65 1f52 n PRO 408 N -2.34 0.82 -4.10 0.37 -0.02 -1.26 -4.91 135.00 123.56 1f52 n PRO 408 Ca 0.17 0.29 -0.08 0.00 -2.02 0.00 0.00 63.50 61.86 1f52 n PRO 408 Cb 0.62 -1.78 -0.10 0.00 -0.02 0.00 0.00 33.50 32.22 1f52 n PRO 408 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1f52 s GLN 409 N -0.16 0.63 0.92 -0.52 -0.21 -1.26 -1.39 119.66 117.67 1f52 s GLN 409 Ca 0.78 -1.21 -0.11 0.00 0.02 0.00 0.00 55.36 54.84 1f52 s GLN 409 Cb -0.97 0.13 0.14 0.00 1.00 0.00 0.00 33.01 33.32 1f52 s GLN 409 CO 0.52 -0.09 1.10 0.14 -2.12 0.00 0.00 175.29 174.84 1f52 s VAL 410 N -3.75 2.52 0.54 1.09 -7.23 -1.00 -4.80 120.40 107.78 1f52 s VAL 410 Ca 0.07 0.17 -0.21 0.00 -1.81 0.00 0.00 61.98 60.20 1f52 s VAL 410 Cb 0.07 -2.45 -0.06 0.00 0.56 0.00 0.00 36.38 34.50 1f52 s VAL 410 CO -0.09 -0.22 1.09 0.00 -0.31 0.00 0.00 175.10 175.58 1f52 n ALA 411 N -4.08 0.61 0.99 1.32 0.00 -1.26 -4.92 120.51 113.16 1f52 n ALA 411 Ca 0.08 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.73 1f52 n ALA 411 Cb 0.54 -2.18 0.10 0.00 0.00 0.00 0.00 19.45 17.90 1f52 n ALA 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f52 n GLY 412 N 1.10 0.95 3.43 0.00 0.00 -1.26 -4.97 105.19 104.44 1f52 n GLY 412 Ca 0.12 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 1f52 n GLY 412 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f52 s SER 413 N -2.01 -0.57 0.17 1.61 1.04 -1.26 -4.94 113.70 107.74 1f52 s SER 413 Ca 0.27 0.03 -0.12 0.00 0.48 0.00 0.00 55.95 56.61 1f52 s SER 413 Cb 0.20 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.98 1f52 s SER 413 CO 0.31 -0.95 1.74 0.25 0.98 0.00 0.00 173.24 175.57 1f52 h LEU 414 N 2.04 0.78 -0.56 2.42 5.85 -1.88 -2.42 115.31 121.54 1f52 h LEU 414 Ca -0.34 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.28 1f52 h LEU 414 Cb 1.30 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.09 1f52 h LEU 414 CO 0.38 0.71 0.30 -0.08 -0.34 0.00 0.00 178.44 179.41 1f52 h GLU 415 N 0.79 0.56 -0.72 1.25 4.81 -1.97 0.24 114.58 119.55 1f52 h GLU 415 Ca 0.20 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1f52 h GLU 415 Cb 0.16 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1f52 h GLU 415 CO -0.02 0.37 0.47 1.49 -0.73 0.00 0.00 179.01 180.59 1f52 h GLU 416 N 0.58 0.91 -0.56 1.92 4.81 -1.93 0.20 114.58 120.51 1f52 h GLU 416 Ca 0.24 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.32 1f52 h GLU 416 Cb 0.13 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1f52 h GLU 416 CO -0.15 0.61 -0.06 0.00 -0.73 0.00 0.00 179.01 178.67 1f52 h ALA 417 N 1.28 0.76 -0.54 2.92 0.00 -0.73 -0.84 119.26 122.12 1f52 h ALA 417 Ca 0.27 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1f52 h ALA 417 Cb -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1f52 h ALA 417 CO -0.08 0.64 0.05 -0.07 0.00 0.00 0.00 179.25 179.79 1f52 h LEU 418 N 0.91 0.88 -0.81 0.00 3.38 0.07 -1.02 115.31 118.73 1f52 h LEU 418 Ca 0.15 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1f52 h LEU 418 Cb 0.62 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 1f52 h LEU 418 CO 0.04 0.94 0.34 -1.13 0.09 0.00 0.00 178.44 178.73 1f52 h ASN 419 N 0.79 1.09 -0.41 -0.43 -0.73 -0.36 -0.23 115.58 115.31 1f52 h ASN 419 Ca 0.16 -0.16 -0.00 0.00 1.87 0.00 0.00 56.30 58.16 1f52 h ASN 419 Cb 0.46 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 1f52 h ASN 419 CO 0.02 0.95 0.24 0.00 -0.37 0.00 0.00 177.43 178.27 1f52 h ALA 420 N 1.18 0.52 -0.91 1.57 0.00 -0.83 -1.33 119.26 119.47 1f52 h ALA 420 Ca 0.27 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1f52 h ALA 420 Cb 0.18 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1f52 h ALA 420 CO -0.03 0.03 0.60 1.25 0.00 0.00 0.00 179.25 181.10 1f52 h LEU 421 N 0.53 0.98 0.85 0.00 5.85 -0.66 0.42 115.31 123.28 1f52 h LEU 421 Ca 0.15 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1f52 h LEU 421 Cb 0.02 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.83 1f52 h LEU 421 CO -0.03 0.67 -0.47 -0.78 -0.34 0.00 0.00 178.44 177.49 1f52 h ASP 422 N 1.13 -1.17 -0.14 1.25 3.58 -0.01 -3.07 116.42 118.00 1f52 h ASP 422 Ca 0.36 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.84 1f52 h ASP 422 Cb 0.03 0.33 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 1f52 h ASP 422 CO -0.11 -0.76 -0.01 -0.07 -2.88 0.00 0.00 179.24 175.41 1f52 h LEU 423 N -1.23 0.24 -3.78 2.28 3.38 -1.00 -3.29 115.31 111.92 1f52 h LEU 423 Ca -0.11 -0.33 -0.40 0.00 0.09 0.00 0.00 57.88 57.13 1f52 h LEU 423 Cb 0.97 -0.07 -0.16 0.00 0.09 0.00 0.00 40.66 41.49 1f52 h LEU 423 CO 0.15 0.52 0.45 -0.67 0.09 0.00 0.00 178.44 178.98 1f52 n ASP 424 N -4.75 6.59 0.06 -0.43 4.64 0.15 -4.57 116.55 118.23 1f52 n ASP 424 Ca -0.06 -3.17 0.13 0.00 -1.38 0.00 0.00 54.79 50.31 1f52 n ASP 424 Cb 0.22 -1.09 0.34 0.00 -1.04 0.00 0.00 41.12 39.55 1f52 n ASP 424 CO 0.00 0.00 0.00 -2.11 -0.82 0.00 0.00 177.20 174.27 1f52 n ARG 425 N 0.36 0.20 -0.09 -0.67 1.85 -1.16 -4.33 116.66 112.82 1f52 n ARG 425 Ca 0.38 0.11 -0.06 0.00 -1.00 0.00 0.00 57.85 57.27 1f52 n ARG 425 Cb 0.58 -1.68 0.00 0.00 -1.05 0.00 0.00 32.46 30.31 1f52 n ARG 425 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1f52 h GLU 426 N 0.00 -0.05 -0.02 2.89 4.39 -1.91 -1.24 114.58 118.64 1f52 h GLU 426 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1f52 h GLU 426 Cb 0.68 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1f52 h GLU 426 CO 0.00 -0.03 0.19 0.27 -1.16 0.00 0.00 179.01 178.28 1f52 h PHE 427 N -0.05 0.00 0.04 4.33 -5.15 -1.95 0.26 116.94 114.42 1f52 h PHE 427 Ca 0.16 0.00 -0.30 0.00 -0.20 0.00 0.00 57.97 57.63 1f52 h PHE 427 Cb 0.30 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.43 1f52 h PHE 427 CO -0.34 0.00 -1.68 -0.07 -2.00 0.00 0.00 178.31 174.22 1f52 h LEU 428 N 0.00 0.14 -0.55 2.10 4.07 -1.52 -3.34 115.31 116.21 1f52 h LEU 428 Ca 0.01 -0.27 0.00 0.00 0.08 0.00 0.00 57.88 57.70 1f52 h LEU 428 Cb 0.39 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.08 1f52 h LEU 428 CO -0.00 1.24 0.00 0.11 -1.08 0.00 0.00 178.44 178.71 1f52 h LYS 429 N 0.02 0.00 -6.49 1.13 1.57 -0.50 -2.19 116.57 110.12 1f52 h LYS 429 Ca -0.28 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.89 1f52 h LYS 429 Cb 2.00 0.00 0.10 0.00 0.08 0.00 0.00 32.23 34.41 1f52 h LYS 429 CO 0.10 0.00 0.22 0.00 -0.57 0.00 0.00 179.45 179.20 1f52 n ALA 430 N -1.89 -0.06 -0.92 3.86 0.00 -0.92 -0.19 120.51 120.39 1f52 n ALA 430 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1f52 n ALA 430 Cb 0.35 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1f52 n ALA 430 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f52 n GLY 431 N 1.37 0.23 2.39 0.00 0.00 -1.26 -2.69 105.19 105.22 1f52 n GLY 431 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 1f52 n GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f52 n GLY 432 N -0.84 1.24 0.33 -0.02 0.00 0.74 -4.92 105.19 101.71 1f52 n GLY 432 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 1f52 n GLY 432 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1f52 h VAL 433 N 0.00 0.25 -3.28 1.61 2.07 -1.60 -3.43 116.25 111.87 1f52 h VAL 433 Ca -0.30 -0.36 -0.63 0.00 0.82 0.00 0.00 66.70 66.23 1f52 h VAL 433 Cb 0.98 0.35 -0.18 0.00 -1.52 0.00 0.00 31.29 30.92 1f52 h VAL 433 CO 0.42 0.04 -0.60 -0.36 0.02 0.00 0.00 177.57 177.09 1f52 s PHE 434 N -4.81 3.17 0.32 1.57 0.08 -0.82 -4.81 117.98 112.67 1f52 s PHE 434 Ca -0.14 -0.04 0.02 0.00 0.12 0.00 0.00 56.93 56.88 1f52 s PHE 434 Cb 0.02 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.44 1f52 s PHE 434 CO 0.48 0.13 0.50 0.95 -0.10 0.00 0.00 175.22 177.18 1f52 s THR 435 N 0.22 5.03 0.19 0.64 -4.23 -1.26 -4.01 115.64 112.22 1f52 s THR 435 Ca 0.01 -0.64 -0.12 0.00 -1.18 0.00 0.00 61.69 59.76 1f52 s THR 435 Cb -0.13 -3.81 0.11 0.00 1.34 0.00 0.00 72.50 70.01 1f52 s THR 435 CO 0.01 -0.46 1.84 0.44 -0.54 0.00 0.00 174.62 175.91 1f52 h ASP 436 N 0.85 0.77 -0.59 3.99 5.19 -1.99 -2.03 116.42 122.61 1f52 h ASP 436 Ca -0.50 -0.05 0.06 0.00 -0.62 0.00 0.00 57.03 55.92 1f52 h ASP 436 Cb 1.23 -0.19 -0.05 0.00 0.18 0.00 0.00 39.33 40.49 1f52 h ASP 436 CO 0.61 0.59 0.30 -0.33 -3.12 0.00 0.00 179.24 177.28 1f52 h GLU 437 N 0.88 0.55 0.30 3.56 5.08 -1.98 0.25 114.58 123.22 1f52 h GLU 437 Ca 0.23 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1f52 h GLU 437 Cb -0.05 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1f52 h GLU 437 CO -0.05 0.37 -0.15 0.00 -1.00 0.00 0.00 179.01 178.18 1f52 h ALA 438 N 1.32 -0.41 -0.47 3.43 0.00 -1.80 -0.89 119.26 120.43 1f52 h ALA 438 Ca 0.26 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1f52 h ALA 438 Cb 0.18 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1f52 h ALA 438 CO -0.18 -0.72 0.22 0.82 0.00 0.00 0.00 179.25 179.39 1f52 h ILE 439 N -0.44 0.94 -0.23 0.00 2.04 -0.95 -0.43 117.51 118.45 1f52 h ILE 439 Ca -0.04 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1f52 h ILE 439 Cb 0.33 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1f52 h ILE 439 CO 0.07 0.08 -0.11 0.44 0.00 0.00 0.00 178.15 178.63 1f52 h ASP 440 N 0.44 0.35 -0.23 1.72 3.32 -0.37 -1.19 116.42 120.46 1f52 h ASP 440 Ca 0.21 -0.08 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 1f52 h ASP 440 Cb 0.14 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 1f52 h ASP 440 CO -0.16 0.50 -0.36 0.00 -1.72 0.00 0.00 179.24 177.50 1f52 h ALA 441 N 1.54 0.35 -0.13 3.45 0.00 -0.40 -1.61 119.26 122.46 1f52 h ALA 441 Ca 0.07 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1f52 h ALA 441 Cb 0.42 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1f52 h ALA 441 CO 0.02 0.42 0.08 -0.92 0.00 0.00 0.00 179.25 178.86 1f52 h TYR 442 N 0.35 0.17 -0.90 0.00 5.03 -0.81 -1.43 116.97 119.37 1f52 h TYR 442 Ca 0.02 0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.36 1f52 h TYR 442 Cb 0.95 -0.05 -0.05 0.00 1.55 0.00 0.00 36.73 39.13 1f52 h TYR 442 CO 0.08 0.13 0.59 0.82 -1.32 0.00 0.00 178.16 178.47 1f52 h ILE 443 N 0.15 1.18 -0.36 1.81 2.04 -1.19 -1.79 117.51 119.34 1f52 h ILE 443 Ca 0.05 -0.40 -0.11 0.00 1.00 0.00 0.00 64.86 65.39 1f52 h ILE 443 Cb 0.01 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.00 1f52 h ILE 443 CO -0.01 0.21 -0.24 0.00 0.00 0.00 0.00 178.15 178.11 1f52 h ALA 444 N 1.46 0.90 -0.40 1.87 0.00 -0.82 -0.53 119.26 121.73 1f52 h ALA 444 Ca 0.35 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1f52 h ALA 444 Cb -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1f52 h ALA 444 CO -0.10 0.62 0.16 -0.07 0.00 0.00 0.00 179.25 179.87 1f52 h LEU 445 N 0.63 0.56 -0.78 0.00 3.38 -0.47 -2.96 115.31 115.67 1f52 h LEU 445 Ca 0.09 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1f52 h LEU 445 Cb 0.74 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1f52 h LEU 445 CO 0.06 0.58 -0.48 0.03 0.09 0.00 0.00 178.44 178.72 1f52 h ARG 446 N 0.51 0.00 0.00 1.13 2.47 -1.15 -3.09 114.38 114.25 1f52 h ARG 446 Ca 0.13 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.76 1f52 h ARG 446 Cb 0.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1f52 h ARG 446 CO -0.01 0.48 -0.42 0.00 0.56 0.00 0.00 179.97 180.58 1f52 h ARG 447 N 0.00 0.00 -0.41 0.04 3.08 -0.94 0.25 114.38 116.40 1f52 h ARG 447 Ca -0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 1f52 h ARG 447 Cb 1.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 1f52 h ARG 447 CO 0.06 0.42 -0.35 1.49 -1.07 0.00 0.00 179.97 180.53 1f52 h GLU 448 N 0.00 0.95 -0.10 0.04 4.81 -1.45 0.06 114.58 118.89 1f52 h GLU 448 Ca -0.00 -0.48 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 1f52 h GLU 448 Cb 0.85 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.24 1f52 h GLU 448 CO 0.06 1.14 -0.10 0.93 -0.73 0.00 0.00 179.01 180.30 1f52 h GLU 449 N 0.78 0.25 -0.75 1.92 5.08 -1.30 -2.86 114.58 117.70 1f52 h GLU 449 Ca 0.07 -0.13 0.12 0.00 -1.00 0.00 0.00 59.36 58.42 1f52 h GLU 449 Cb 0.94 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.14 1f52 h GLU 449 CO 0.09 0.66 0.49 0.22 -1.00 0.00 0.00 179.01 179.47 1f52 h ASP 450 N -0.16 0.51 -0.50 1.42 3.58 -0.33 -1.71 116.42 119.22 1f52 h ASP 450 Ca 0.02 0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.39 1f52 h ASP 450 Cb 0.61 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.56 1f52 h ASP 450 CO 0.02 0.29 -0.04 0.44 -2.88 0.00 0.00 179.24 177.07 1f52 h ASP 451 N 0.55 0.94 -0.36 2.28 3.32 -0.77 -0.94 116.42 121.44 1f52 h ASP 451 Ca 0.36 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1f52 h ASP 451 Cb 0.63 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 1f52 h ASP 451 CO -0.13 1.02 0.20 0.03 -1.72 0.00 0.00 179.24 178.64 1f52 h ARG 452 N 0.87 0.39 -0.32 3.56 2.47 -1.13 0.11 114.38 120.33 1f52 h ARG 452 Ca 0.15 -0.02 -0.16 0.00 -1.26 0.00 0.00 59.98 58.69 1f52 h ARG 452 Cb 0.57 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.79 1f52 h ARG 452 CO 0.03 0.26 -0.43 0.28 0.56 0.00 0.00 179.97 180.68 1f52 h VAL 453 N 0.40 1.28 -0.12 2.04 2.07 -1.41 -1.99 116.25 118.52 1f52 h VAL 453 Ca 0.15 -1.61 -0.12 0.00 0.82 0.00 0.00 66.70 65.94 1f52 h VAL 453 Cb 0.03 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1f52 h VAL 453 CO -0.09 0.52 -0.47 0.03 0.02 0.00 0.00 177.57 177.59 1f52 h ARG 454 N 0.65 0.30 0.00 1.57 3.08 -0.79 -3.27 114.38 115.91 1f52 h ARG 454 Ca 0.05 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1f52 h ARG 454 Cb 0.99 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1f52 h ARG 454 CO 0.10 0.71 -0.92 0.52 -1.07 0.00 0.00 179.97 179.31 1f52 h MET 455 N 0.24 0.00 -5.60 0.04 2.86 -0.73 -3.46 114.93 108.28 1f52 h MET 455 Ca 0.01 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 57.06 1f52 h MET 455 Cb 0.92 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.48 1f52 h MET 455 CO 0.08 0.00 0.01 0.99 1.06 0.00 0.00 176.91 179.04 1f52 s THR 456 N -3.35 5.08 0.29 2.22 2.01 -0.75 -5.02 115.64 116.12 1f52 s THR 456 Ca 0.00 1.04 -0.28 0.00 0.31 0.00 0.00 61.69 62.76 1f52 s THR 456 Cb 0.09 -3.88 -0.14 0.00 0.01 0.00 0.00 72.50 68.59 1f52 s THR 456 CO 0.78 0.17 1.12 -2.65 -0.69 0.00 0.00 174.62 173.34 1f52 n PRO 457 N 4.78 1.59 -3.77 4.92 -0.02 -1.26 -4.93 135.00 136.31 1f52 n PRO 457 Ca -0.04 0.56 -0.37 0.00 -2.02 0.00 0.00 63.50 61.64 1f52 n PRO 457 Cb 0.50 -2.01 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 1f52 n PRO 457 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1f52 s HIS 458 N -0.96 3.56 0.32 6.00 2.46 -1.26 -4.93 115.29 120.47 1f52 s HIS 458 Ca 0.59 0.55 0.09 0.00 0.47 0.00 0.00 55.06 56.76 1f52 s HIS 458 Cb -0.67 -2.07 0.91 0.00 -0.13 0.00 0.00 32.58 30.61 1f52 s HIS 458 CO 0.60 0.58 1.66 -1.35 -2.47 0.00 0.00 174.74 173.76 1f52 h PRO 459 N 5.49 0.30 0.00 2.88 0.11 -1.92 0.54 132.00 139.40 1f52 h PRO 459 Ca -0.50 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1f52 h PRO 459 Cb 1.20 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1f52 h PRO 459 CO 0.64 0.20 -0.11 0.28 -0.21 0.00 0.00 178.00 178.80 1f52 h VAL 460 N 0.31 0.64 0.00 3.15 2.07 -2.00 -1.17 116.25 119.24 1f52 h VAL 460 Ca 0.65 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 67.66 1f52 h VAL 460 Cb 1.39 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1f52 h VAL 460 CO -0.61 0.11 -0.21 -0.33 0.02 0.00 0.00 177.57 176.55 1f52 h GLU 461 N 0.00 0.00 -0.12 1.57 5.08 -0.30 -0.19 114.58 120.63 1f52 h GLU 461 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 1f52 h GLU 461 Cb 0.28 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1f52 h GLU 461 CO 0.01 0.21 -0.57 0.74 -1.00 0.00 0.00 179.01 178.40 1f52 h PHE 462 N 0.00 0.80 -0.36 4.33 0.04 -1.25 0.43 116.94 120.94 1f52 h PHE 462 Ca -0.00 -0.35 0.02 0.00 2.80 0.00 0.00 57.97 60.43 1f52 h PHE 462 Cb 0.45 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 1f52 h PHE 462 CO 0.00 1.15 0.21 1.49 -0.60 0.00 0.00 178.31 180.55 1f52 h GLU 463 N 0.23 0.41 -0.06 1.51 4.81 -1.37 0.10 114.58 120.21 1f52 h GLU 463 Ca -0.04 -0.02 -0.25 0.00 -0.13 0.00 0.00 59.36 58.92 1f52 h GLU 463 Cb 1.22 -0.09 0.02 0.00 0.63 0.00 0.00 28.75 30.52 1f52 h GLU 463 CO 0.12 0.27 -0.93 -0.07 -0.73 0.00 0.00 179.01 177.67 1f52 h LEU 464 N 0.43 0.89 -1.47 1.64 4.07 -1.04 -3.41 115.31 116.42 1f52 h LEU 464 Ca 0.14 -0.66 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1f52 h LEU 464 Cb 0.00 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 41.47 1f52 h LEU 464 CO -0.07 1.46 0.00 -1.22 -1.08 0.00 0.00 178.44 177.54 1f52 n TYR 465 N -3.88 0.00 -0.29 1.13 4.02 0.15 -4.79 117.16 113.50 1f52 n TYR 465 Ca -0.09 -0.16 0.01 0.00 -0.01 0.00 0.00 57.90 57.65 1f52 n TYR 465 Cb 0.83 -0.02 0.20 0.00 -0.02 0.00 0.00 39.34 40.34 1f52 n TYR 465 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 1f52 h TYR 466 N 0.00 1.07 -0.33 -0.72 3.20 -1.07 -2.27 116.97 116.85 1f52 h TYR 466 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1f52 h TYR 466 Cb 0.38 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1f52 h TYR 466 CO 0.00 0.64 0.00 0.43 -1.64 0.00 0.00 178.16 177.59 1f52 n SER 467 N -4.43 3.01 0.00 -2.11 7.64 -1.26 -5.14 113.62 111.33 1f52 n SER 467 Ca 0.11 -2.33 0.01 0.00 1.01 0.00 0.00 58.87 57.67 1f52 n SER 467 Cb 0.08 -0.49 0.05 0.00 -1.01 0.00 0.00 64.21 62.85 1f52 n SER 467 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58