#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hk7 s ILE 3 N 0.00 4.72 -0.35 -1.33 1.01 -1.26 -4.96 121.20 119.03 3hk7 s ILE 3 Ca 0.00 -1.59 0.27 0.00 0.00 0.00 0.00 60.65 59.33 3hk7 s ILE 3 Cb 0.00 -4.04 0.33 0.00 0.01 0.00 0.00 42.46 38.77 3hk7 s ILE 3 CO 0.00 -0.79 1.76 -1.13 0.00 0.00 0.00 174.94 174.78 3hk7 h ASN 4 N 8.66 0.00 -5.11 3.58 -0.00 -1.98 -3.47 115.58 117.26 3hk7 h ASN 4 Ca -0.26 0.00 -0.11 0.00 -0.00 0.00 0.00 56.30 55.93 3hk7 h ASN 4 Cb 1.09 0.00 -0.16 0.00 -0.00 0.00 0.00 38.32 39.24 3hk7 h ASN 4 CO 0.94 0.00 -0.44 -0.94 -0.00 0.00 0.00 177.43 176.98 3hk7 s SER 5 N -5.53 0.13 0.39 1.15 1.04 -1.26 -5.03 113.70 104.59 3hk7 s SER 5 Ca 0.06 -0.53 0.09 0.00 0.48 0.00 0.00 55.95 56.04 3hk7 s SER 5 Cb 0.08 0.28 0.79 0.00 0.10 0.00 0.00 66.02 67.27 3hk7 s SER 5 CO 0.59 -0.59 1.94 -0.09 0.98 0.00 0.00 173.24 176.07 3hk7 h ARG 6 N 3.32 0.31 -0.64 4.02 2.43 -1.99 -1.23 114.38 120.60 3hk7 h ARG 6 Ca -0.33 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 58.73 3hk7 h ARG 6 Cb 1.19 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 3hk7 h ARG 6 CO 0.52 0.38 0.21 0.93 -1.51 0.00 0.00 179.97 180.51 3hk7 h GLU 7 N 0.31 0.99 -0.28 0.20 3.07 -1.99 0.17 114.58 117.05 3hk7 h GLU 7 Ca 0.07 -0.21 -0.19 0.00 -0.50 0.00 0.00 59.36 58.53 3hk7 h GLU 7 Cb 0.29 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 3hk7 h GLU 7 CO 0.01 0.86 -0.57 0.28 -1.40 0.00 0.00 179.01 178.20 3hk7 h VAL 8 N 0.92 1.27 -0.45 3.13 2.07 -1.88 -2.58 116.25 118.73 3hk7 h VAL 8 Ca 0.21 -1.75 0.04 0.00 0.82 0.00 0.00 66.70 66.02 3hk7 h VAL 8 Cb 0.27 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 3hk7 h VAL 8 CO -0.01 0.57 0.22 0.25 0.02 0.00 0.00 177.57 178.62 3hk7 h LEU 9 N 0.66 0.32 -0.33 2.57 5.85 -0.89 -1.07 115.31 122.42 3hk7 h LEU 9 Ca 0.01 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3hk7 h LEU 9 Cb 1.18 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 3hk7 h LEU 9 CO 0.13 0.22 0.09 0.00 -0.34 0.00 0.00 178.44 178.54 3hk7 h ALA 10 N 1.25 0.36 -0.49 1.25 0.00 -0.55 0.17 119.26 121.24 3hk7 h ALA 10 Ca 0.20 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.18 3hk7 h ALA 10 Cb 0.11 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3hk7 h ALA 10 CO -0.14 -0.32 0.29 0.93 0.00 0.00 0.00 179.25 180.01 3hk7 h GLU 11 N 0.21 0.57 -0.54 0.00 4.39 -1.04 0.38 114.58 118.55 3hk7 h GLU 11 Ca 0.15 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.73 3hk7 h GLU 11 Cb 0.15 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3hk7 h GLU 11 CO -0.18 0.38 0.01 0.87 -1.16 0.00 0.00 179.01 178.92 3hk7 h LYS 12 N 0.59 0.95 -0.18 2.33 1.57 -0.63 -0.71 116.57 120.48 3hk7 h LYS 12 Ca 0.20 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 3hk7 h LYS 12 Cb 0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3hk7 h LYS 12 CO -0.09 0.96 0.05 0.28 -0.57 0.00 0.00 179.45 180.08 3hk7 h VAL 13 N 0.82 1.20 -0.50 0.50 2.07 -0.43 -1.06 116.25 118.85 3hk7 h VAL 13 Ca 0.15 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.08 3hk7 h VAL 13 Cb 0.52 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 3hk7 h VAL 13 CO 0.03 0.19 0.27 0.11 0.02 0.00 0.00 177.57 178.19 3hk7 h LYS 14 N 0.11 0.51 -0.56 1.57 1.57 -0.81 -0.02 116.57 118.94 3hk7 h LYS 14 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hk7 h LYS 14 Cb 0.25 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 3hk7 h LYS 14 CO -0.00 0.34 0.30 -0.91 -0.57 0.00 0.00 179.45 178.61 3hk7 h ASN 15 N 0.53 0.70 0.12 0.86 2.35 -0.96 -0.38 115.58 118.81 3hk7 h ASN 15 Ca 0.21 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 3hk7 h ASN 15 Cb 0.08 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.27 3hk7 h ASN 15 CO -0.13 0.60 -0.06 0.00 -1.65 0.00 0.00 177.43 176.19 3hk7 h ALA 16 N 1.13 -0.17 -0.46 -0.83 0.00 -0.70 0.52 119.26 118.76 3hk7 h ALA 16 Ca 0.20 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3hk7 h ALA 16 Cb 0.06 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3hk7 h ALA 16 CO -0.03 -0.59 0.28 0.28 0.00 0.00 0.00 179.25 179.18 3hk7 h VAL 17 N -0.17 1.06 -0.27 0.00 2.07 -0.84 -0.93 116.25 117.17 3hk7 h VAL 17 Ca -0.01 -0.19 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 3hk7 h VAL 17 Cb 0.13 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3hk7 h VAL 17 CO 0.02 0.10 -0.30 0.78 0.02 0.00 0.00 177.57 178.19 3hk7 h ASN 18 N 0.56 0.58 1.68 0.57 -0.26 -0.90 -3.08 115.58 114.72 3hk7 h ASN 18 Ca 0.18 -0.22 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 3hk7 h ASN 18 Cb -0.00 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.10 3hk7 h ASN 18 CO -0.07 0.85 0.00 0.78 -1.06 0.00 0.00 177.43 177.93 3hk7 h ASN 19 N 0.48 0.00 -2.92 5.81 2.35 -0.62 -3.45 115.58 117.24 3hk7 h ASN 19 Ca 0.06 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.24 3hk7 h ASN 19 Cb 0.77 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.10 3hk7 h ASN 19 CO 0.06 0.00 1.06 -1.58 -1.65 0.00 0.00 177.43 175.32 3hk7 s GLN 20 N -3.15 3.86 0.31 0.81 2.00 -0.38 -4.97 119.66 118.13 3hk7 s GLN 20 Ca 0.09 1.51 -0.30 0.00 -2.00 0.00 0.00 55.36 54.66 3hk7 s GLN 20 Cb 0.09 -3.97 -0.11 0.00 0.80 0.00 0.00 33.01 29.82 3hk7 s GLN 20 CO 0.62 -1.21 1.56 -1.25 -0.50 0.00 0.00 175.29 174.51 3hk7 s PRO 21 N 4.45 4.13 -0.09 1.67 0.04 -1.26 -4.94 135.00 138.99 3hk7 s PRO 21 Ca 0.65 2.55 -0.10 0.00 0.04 0.00 0.00 61.00 64.14 3hk7 s PRO 21 Cb -0.22 -3.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.26 3hk7 s PRO 21 CO 0.26 -0.59 0.23 0.08 0.04 0.00 0.00 177.00 177.02 3hk7 s VAL 22 N -0.23 5.35 -0.34 -0.36 1.01 0.42 -4.71 120.40 121.54 3hk7 s VAL 22 Ca 0.61 0.42 -0.10 0.00 0.00 0.00 0.00 61.98 62.91 3hk7 s VAL 22 Cb -0.47 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.41 3hk7 s VAL 22 CO 0.50 0.58 0.16 -0.89 0.00 0.00 0.00 175.10 175.46 3hk7 s THR 23 N -0.84 4.46 -0.81 3.92 2.01 -0.73 -0.87 115.64 122.78 3hk7 s THR 23 Ca 0.17 -0.68 -0.19 0.00 0.31 0.00 0.00 61.69 61.30 3hk7 s THR 23 Cb -0.13 -3.38 0.12 0.00 0.01 0.00 0.00 72.50 69.12 3hk7 s THR 23 CO 0.06 -0.07 0.99 -0.62 -0.69 0.00 0.00 174.62 174.29 3hk7 s ASP 24 N 1.56 6.48 0.00 3.53 -1.08 0.44 -4.74 116.67 122.86 3hk7 s ASP 24 Ca 0.03 -1.81 0.06 0.00 -0.52 0.00 0.00 52.55 50.31 3hk7 s ASP 24 Cb -0.18 -2.37 0.36 0.00 -1.46 0.00 0.00 42.92 39.28 3hk7 s ASP 24 CO 0.06 -1.09 0.88 1.15 0.52 0.00 0.00 175.17 176.69 3hk7 n MET 25 N 6.45 0.58 -3.15 4.34 0.00 -1.26 -0.95 117.12 123.13 3hk7 n MET 25 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.86 3hk7 n MET 25 Cb 0.47 -1.17 -0.01 0.00 0.00 0.00 0.00 33.22 32.51 3hk7 n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hk7 s HIS 26 N -2.00 -1.32 0.32 3.17 5.65 -1.26 -4.75 115.29 115.10 3hk7 s HIS 26 Ca 0.09 1.33 0.03 0.00 0.25 0.00 0.00 55.06 56.77 3hk7 s HIS 26 Cb 0.04 0.44 -0.02 0.00 -1.18 0.00 0.00 32.58 31.86 3hk7 s HIS 26 CO 0.07 -0.73 0.34 0.95 -0.65 0.00 0.00 174.74 174.72 3hk7 s THR 27 N 2.88 0.00 -0.24 0.89 -4.23 -0.63 -1.29 115.64 113.03 3hk7 s THR 27 Ca 0.15 -1.85 0.10 0.00 -1.18 0.00 0.00 61.69 58.91 3hk7 s THR 27 Cb -0.13 -2.55 0.44 0.00 1.34 0.00 0.00 72.50 71.60 3hk7 s THR 27 CO -0.19 0.00 1.20 1.41 -0.54 0.00 0.00 174.62 176.50 3hk7 n HIS 28 N -0.57 1.27 -3.57 3.99 8.25 0.14 -2.95 115.22 121.78 3hk7 n HIS 28 Ca 0.05 -1.80 -0.20 0.00 -0.26 0.00 0.00 57.72 55.51 3hk7 n HIS 28 Cb 0.62 -0.28 -0.01 0.00 1.12 0.00 0.00 29.99 31.44 3hk7 n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hk7 s LEU 29 N -3.28 3.89 0.06 2.41 1.43 -1.18 -4.61 118.68 117.40 3hk7 s LEU 29 Ca 0.43 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 3hk7 s LEU 29 Cb 0.39 -2.63 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 3hk7 s LEU 29 CO -0.02 -0.40 -0.06 -0.36 0.23 0.00 0.00 176.35 175.73 3hk7 s PHE 30 N -2.20 0.71 0.41 0.29 0.08 -1.26 -4.38 117.98 111.63 3hk7 s PHE 30 Ca 0.44 -0.73 -0.26 0.00 0.12 0.00 0.00 56.93 56.49 3hk7 s PHE 30 Cb -0.09 -0.43 -0.10 0.00 -0.57 0.00 0.00 43.02 41.84 3hk7 s PHE 30 CO 0.30 -0.15 1.37 0.45 -0.10 0.00 0.00 175.22 177.09 3hk7 n SER 31 N 0.72 3.08 -0.34 1.36 2.88 -1.26 -4.79 113.62 115.27 3hk7 n SER 31 Ca -0.18 1.15 0.19 0.00 -1.33 0.00 0.00 58.87 58.70 3hk7 n SER 31 Cb 0.58 -1.56 0.41 0.00 -0.75 0.00 0.00 64.21 62.89 3hk7 n SER 31 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hk7 h PRO 32 N 2.39 0.53 0.00 -1.46 0.11 -1.94 -1.28 132.00 130.35 3hk7 h PRO 32 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3hk7 h PRO 32 Cb 1.27 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hk7 h PRO 32 CO 0.61 0.35 0.00 -2.95 -0.21 0.00 0.00 178.00 175.80 3hk7 h ASN 33 N 0.54 0.00 1.09 -2.05 -1.07 -1.92 -2.30 115.58 109.87 3hk7 h ASN 33 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 56.30 57.01 3hk7 h ASN 33 Cb 1.29 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.54 3hk7 h ASN 33 CO -0.45 0.00 0.00 -0.26 0.07 0.00 0.00 177.43 176.79 3hk7 h PHE 34 N 0.00 0.00 0.00 4.14 -1.00 -1.58 -3.49 116.94 115.01 3hk7 h PHE 34 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3hk7 h PHE 34 Cb 0.13 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.69 3hk7 h PHE 34 CO 0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 3hk7 n GLY 35 N 0.34 -0.23 0.15 -1.45 0.00 -0.87 -4.53 105.19 98.61 3hk7 n GLY 35 Ca 0.02 -1.94 0.10 0.00 0.00 0.00 0.00 46.02 44.20 3hk7 n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hk7 n GLU 36 N 0.00 0.13 0.24 1.61 1.02 -1.26 -2.08 120.64 120.29 3hk7 n GLU 36 Ca 0.00 0.62 0.12 0.00 -0.02 0.00 0.00 57.16 57.89 3hk7 n GLU 36 Cb 0.00 -1.94 0.74 0.00 -0.02 0.00 0.00 31.44 30.22 3hk7 n GLU 36 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3hk7 h ILE 37 N 0.00 0.79 -3.58 -3.67 6.09 -1.96 -3.36 117.51 111.83 3hk7 h ILE 37 Ca 0.00 0.00 -0.58 0.00 -1.37 0.00 0.00 64.86 62.91 3hk7 h ILE 37 Cb 0.04 0.95 -0.09 0.00 0.47 0.00 0.00 36.82 38.19 3hk7 h ILE 37 CO 0.00 0.00 0.74 -0.22 -3.07 0.00 0.00 178.15 175.60 3hk7 s LEU 38 N -8.52 3.83 0.13 2.19 2.96 -0.88 -4.80 118.68 113.59 3hk7 s LEU 38 Ca -0.05 0.17 -0.23 0.00 -0.22 0.00 0.00 54.13 53.80 3hk7 s LEU 38 Cb 0.17 -3.26 -0.07 0.00 0.50 0.00 0.00 46.19 43.52 3hk7 s LEU 38 CO 0.63 -1.19 0.71 -0.76 -1.32 0.00 0.00 176.35 174.42 3hk7 s LEU 39 N 4.15 4.57 0.10 -0.68 1.43 -1.26 -4.99 118.68 122.00 3hk7 s LEU 39 Ca 0.40 1.51 -0.25 0.00 -1.03 0.00 0.00 54.13 54.77 3hk7 s LEU 39 Cb -0.09 -3.16 0.08 0.00 0.03 0.00 0.00 46.19 43.05 3hk7 s LEU 39 CO 0.27 0.23 0.72 -1.66 0.23 0.00 0.00 176.35 176.14 3hk7 s TRP 40 N -1.11 -0.44 0.00 0.29 1.48 -1.26 -0.74 118.94 117.15 3hk7 s TRP 40 Ca 0.33 0.25 0.00 0.00 -1.06 0.00 0.00 56.10 55.63 3hk7 s TRP 40 Cb -0.22 0.56 0.00 0.00 -1.16 0.00 0.00 33.47 32.65 3hk7 s TRP 40 CO 0.24 -0.75 0.00 -0.40 -4.06 0.00 0.00 176.95 171.98 3hk7 n ASP 41 N -0.33 0.00 -0.35 -2.66 5.68 -1.26 -4.56 116.55 113.07 3hk7 n ASP 41 Ca -0.13 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.29 3hk7 n ASP 41 Cb 0.63 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.94 3hk7 n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hk7 h ILE 42 N 0.00 0.70 -0.29 2.12 6.09 -1.95 -1.14 117.51 123.04 3hk7 h ILE 42 Ca 0.00 -0.26 -0.06 0.00 -1.37 0.00 0.00 64.86 63.18 3hk7 h ILE 42 Cb 0.00 -0.11 -0.02 0.00 0.47 0.00 0.00 36.82 37.16 3hk7 h ILE 42 CO 0.00 0.14 -0.06 0.44 -3.07 0.00 0.00 178.15 175.60 3hk7 h ASP 43 N 0.75 0.43 -0.15 2.19 5.19 -1.96 -0.78 116.42 122.10 3hk7 h ASP 43 Ca 0.58 -0.09 -0.18 0.00 -0.62 0.00 0.00 57.03 56.72 3hk7 h ASP 43 Cb 0.92 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 40.32 3hk7 h ASP 43 CO -0.38 0.55 -0.62 -0.33 -3.12 0.00 0.00 179.24 175.34 3hk7 h GLU 44 N 0.44 0.68 -0.26 3.56 4.39 -1.49 -2.70 114.58 119.20 3hk7 h GLU 44 Ca 0.09 -0.53 0.04 0.00 0.34 0.00 0.00 59.36 59.30 3hk7 h GLU 44 Cb 0.38 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 3hk7 h GLU 44 CO 0.02 1.15 0.02 -0.07 -1.16 0.00 0.00 179.01 178.97 3hk7 h LEU 45 N 0.36 -0.05 -1.72 1.33 3.38 -0.86 -1.80 115.31 115.95 3hk7 h LEU 45 Ca -0.04 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3hk7 h LEU 45 Cb 1.25 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3hk7 h LEU 45 CO 0.13 0.01 -0.04 -0.07 0.09 0.00 0.00 178.44 178.56 3hk7 h LEU 46 N 0.11 0.00 -2.99 1.67 3.38 -1.19 -2.79 115.31 113.50 3hk7 h LEU 46 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hk7 h LEU 46 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3hk7 h LEU 46 CO -0.18 0.04 0.00 0.35 0.09 0.00 0.00 178.44 178.73 3hk7 n THR 47 N -3.17 1.48 -1.68 0.22 -2.24 -0.75 -4.73 114.28 103.42 3hk7 n THR 47 Ca -0.00 -1.15 -0.44 0.00 -2.27 0.00 0.00 64.05 60.20 3hk7 n THR 47 Cb 0.27 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 3hk7 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hk7 n TYR 48 N 1.14 2.15 0.31 4.78 9.36 -0.80 -4.76 117.16 129.35 3hk7 n TYR 48 Ca 0.23 0.51 0.18 0.00 3.32 0.00 0.00 57.90 62.15 3hk7 n TYR 48 Cb 0.75 -2.42 1.04 0.00 -0.63 0.00 0.00 39.34 38.08 3hk7 n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 3hk7 h HIS 49 N 3.21 0.00 -0.35 2.98 2.07 -1.91 0.21 115.15 121.35 3hk7 h HIS 49 Ca -0.45 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.05 3hk7 h HIS 49 Cb 1.28 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.25 3hk7 h HIS 49 CO 0.53 0.01 0.14 1.88 -3.07 0.00 0.00 177.93 177.41 3hk7 h TYR 50 N 0.00 0.48 0.00 6.12 -1.99 -1.94 -1.59 116.97 118.06 3hk7 h TYR 50 Ca -0.00 -0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.59 3hk7 h TYR 50 Cb 0.03 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 38.58 3hk7 h TYR 50 CO 0.00 0.38 -0.82 -0.07 -0.00 0.00 0.00 178.16 177.65 3hk7 h LEU 51 N 0.49 0.00 -0.23 3.88 3.38 -1.27 -3.04 115.31 118.52 3hk7 h LEU 51 Ca 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3hk7 h LEU 51 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3hk7 h LEU 51 CO -0.01 0.54 0.04 0.58 0.09 0.00 0.00 178.44 179.68 3hk7 h VAL 52 N 0.00 1.23 -0.07 1.22 2.07 -1.05 0.89 116.25 120.54 3hk7 h VAL 52 Ca -0.05 -0.76 0.03 0.00 0.82 0.00 0.00 66.70 66.74 3hk7 h VAL 52 Cb 1.46 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 3hk7 h VAL 52 CO 0.06 0.24 -0.13 0.00 0.02 0.00 0.00 177.57 177.76 3hk7 h ALA 53 N 0.85 -0.10 -0.73 1.67 0.00 -1.36 -1.67 119.26 117.91 3hk7 h ALA 53 Ca 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3hk7 h ALA 53 Cb 0.32 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3hk7 h ALA 53 CO 0.00 -0.61 0.37 0.93 0.00 0.00 0.00 179.25 179.95 3hk7 h GLU 54 N -0.19 1.04 -0.48 0.00 5.08 -1.40 -2.71 114.58 115.92 3hk7 h GLU 54 Ca 0.07 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3hk7 h GLU 54 Cb 0.29 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3hk7 h GLU 54 CO -0.18 0.80 0.07 -0.24 -1.00 0.00 0.00 179.01 178.46 3hk7 h VAL 55 N 1.02 1.22 0.00 3.13 3.04 -0.55 -2.00 116.25 122.11 3hk7 h VAL 55 Ca 0.25 -0.84 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 3hk7 h VAL 55 Cb 0.09 0.78 0.00 0.00 -2.01 0.00 0.00 31.29 30.15 3hk7 h VAL 55 CO -0.04 0.30 0.00 0.24 -1.01 0.00 0.00 177.57 177.07 3hk7 h MET 56 N 0.71 0.00 0.00 4.17 2.86 -0.97 -0.26 114.93 121.44 3hk7 h MET 56 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3hk7 h MET 56 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3hk7 h MET 56 CO 0.01 0.00 -0.09 0.54 1.06 0.00 0.00 176.91 178.42 3hk7 n ARG 57 N -2.51 0.22 -0.06 1.72 1.74 -0.75 -4.41 116.66 112.62 3hk7 n ARG 57 Ca -0.00 0.16 -0.11 0.00 -0.77 0.00 0.00 57.85 57.13 3hk7 n ARG 57 Cb 0.14 -1.74 -0.04 0.00 -1.02 0.00 0.00 32.46 29.80 3hk7 n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3hk7 n TRP 58 N -2.11 0.00 -1.67 -1.55 7.02 -0.22 -5.09 117.44 113.82 3hk7 n TRP 58 Ca 0.05 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.20 3hk7 n TRP 58 Cb 0.42 -0.40 0.06 0.00 -2.42 0.00 0.00 31.31 28.96 3hk7 n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 3hk7 s THR 59 N -2.21 3.02 -0.43 -0.99 -1.32 -0.54 -4.98 115.64 108.19 3hk7 s THR 59 Ca -0.15 0.48 0.23 0.00 -1.21 0.00 0.00 61.69 61.04 3hk7 s THR 59 Cb 0.06 -3.00 0.03 0.00 -1.51 0.00 0.00 72.50 68.07 3hk7 s THR 59 CO 0.20 -0.29 1.18 0.44 -2.21 0.00 0.00 174.62 173.94 3hk7 h ASP 60 N -0.07 0.00 -2.66 8.08 3.45 -1.94 -3.46 116.42 119.82 3hk7 h ASP 60 Ca -0.47 -0.11 -0.53 0.00 0.43 0.00 0.00 57.03 56.35 3hk7 h ASP 60 Cb 1.26 0.00 0.04 0.00 -0.56 0.00 0.00 39.33 40.07 3hk7 h ASP 60 CO 0.53 0.06 1.01 -0.69 -1.57 0.00 0.00 179.24 178.58 3hk7 s VAL 61 N -3.27 2.57 0.74 -1.35 1.01 -1.26 -4.96 120.40 113.89 3hk7 s VAL 61 Ca 0.03 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.12 3hk7 s VAL 61 Cb 0.11 -3.15 0.04 0.00 0.00 0.00 0.00 36.38 33.38 3hk7 s VAL 61 CO 0.76 0.01 1.11 -0.94 0.00 0.00 0.00 175.10 176.04 3hk7 s SER 62 N 1.98 4.55 0.39 3.32 1.04 -1.26 -4.82 113.70 118.90 3hk7 s SER 62 Ca 0.76 1.96 0.08 0.00 0.48 0.00 0.00 55.95 59.23 3hk7 s SER 62 Cb -0.45 -2.54 0.79 0.00 0.10 0.00 0.00 66.02 63.92 3hk7 s SER 62 CO 0.33 -2.01 1.96 -0.29 0.98 0.00 0.00 173.24 174.22 3hk7 h ILE 63 N -0.71 1.15 -0.14 -1.02 6.09 -1.97 -0.42 117.51 120.48 3hk7 h ILE 63 Ca -0.45 -0.56 -0.02 0.00 -1.37 0.00 0.00 64.86 62.46 3hk7 h ILE 63 Cb 1.25 0.93 -0.01 0.00 0.47 0.00 0.00 36.82 39.46 3hk7 h ILE 63 CO 0.51 0.19 0.02 -0.33 -3.07 0.00 0.00 178.15 175.47 3hk7 h GLU 64 N 0.37 0.24 -1.00 2.19 3.07 -1.94 -2.50 114.58 115.02 3hk7 h GLU 64 Ca 0.09 -0.07 0.02 0.00 -0.50 0.00 0.00 59.36 58.90 3hk7 h GLU 64 Cb 0.21 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.05 3hk7 h GLU 64 CO 0.00 0.44 0.66 0.00 -1.40 0.00 0.00 179.01 178.71 3hk7 h ALA 65 N 0.79 1.31 -0.13 3.43 0.00 -1.75 -2.18 119.26 120.73 3hk7 h ALA 65 Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hk7 h ALA 65 Cb 0.32 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hk7 h ALA 65 CO 0.00 0.62 0.05 0.35 0.00 0.00 0.00 179.25 180.27 3hk7 h PHE 66 N 1.32 0.09 0.00 0.00 3.57 -0.91 -2.07 116.94 118.94 3hk7 h PHE 66 Ca 0.38 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.84 3hk7 h PHE 66 Cb -0.10 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 3hk7 h PHE 66 CO -0.00 0.05 -0.19 -1.49 -2.23 0.00 0.00 178.31 174.44 3hk7 h TRP 67 N 0.11 0.00 0.00 0.41 -0.00 -1.20 -2.23 115.95 113.05 3hk7 h TRP 67 Ca 0.05 0.00 -0.11 0.00 -0.00 0.00 0.00 58.89 58.83 3hk7 h TRP 67 Cb 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.17 3hk7 h TRP 67 CO -0.10 0.19 -0.55 0.00 -0.00 0.00 0.00 178.44 177.99 3hk7 h ALA 68 N 1.81 0.91 -2.30 1.49 0.00 -0.82 -3.45 119.26 116.89 3hk7 h ALA 68 Ca -0.00 -0.50 -0.52 0.00 0.00 0.00 0.00 54.91 53.89 3hk7 h ALA 68 Cb 0.51 -0.09 0.16 0.00 0.00 0.00 0.00 17.79 18.37 3hk7 h ALA 68 CO 0.03 0.68 0.28 -1.64 0.00 0.00 0.00 179.25 178.59 3hk7 s MET 69 N -3.48 1.71 0.70 0.00 -1.94 -0.83 -5.01 119.30 110.44 3hk7 s MET 69 Ca -0.00 1.32 -0.11 0.00 -1.71 0.00 0.00 55.69 55.19 3hk7 s MET 69 Cb 0.11 -1.82 0.01 0.00 2.01 0.00 0.00 34.83 35.14 3hk7 s MET 69 CO 0.74 -2.08 1.06 -1.54 -0.01 0.00 0.00 175.02 173.19 3hk7 s SER 70 N -3.09 5.43 0.24 3.03 1.04 -1.26 -4.82 113.70 114.27 3hk7 s SER 70 Ca 0.64 1.47 -0.04 0.00 0.48 0.00 0.00 55.95 58.49 3hk7 s SER 70 Cb -0.20 -2.35 0.43 0.00 0.10 0.00 0.00 66.02 64.00 3hk7 s SER 70 CO 0.57 -1.39 1.77 0.50 0.98 0.00 0.00 173.24 175.67 3hk7 h LYS 71 N -0.68 0.61 -0.17 4.02 1.63 -1.95 -0.31 116.57 119.71 3hk7 h LYS 71 Ca -0.45 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.22 3hk7 h LYS 71 Cb 1.22 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.70 3hk7 h LYS 71 CO 0.59 0.40 -0.31 -0.09 -3.45 0.00 0.00 179.45 176.59 3hk7 h ARG 72 N 0.62 0.33 -0.16 1.90 2.43 -1.93 -1.43 114.38 116.14 3hk7 h ARG 72 Ca 0.40 -0.13 -0.16 0.00 -0.81 0.00 0.00 59.98 59.28 3hk7 h ARG 72 Cb 0.49 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 3hk7 h ARG 72 CO -0.31 0.61 -0.57 0.93 -1.51 0.00 0.00 179.97 179.12 3hk7 h GLU 73 N 0.29 0.51 -0.38 0.20 5.08 -1.59 -1.13 114.58 117.56 3hk7 h GLU 73 Ca 0.04 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 58.01 3hk7 h GLU 73 Cb 0.69 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3hk7 h GLU 73 CO 0.05 0.94 -0.02 1.96 -1.00 0.00 0.00 179.01 180.94 3hk7 h GLN 74 N 0.39 0.68 -0.64 2.33 4.20 -0.83 -1.19 115.11 120.05 3hk7 h GLN 74 Ca 0.00 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 3hk7 h GLN 74 Cb 1.11 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.80 3hk7 h GLN 74 CO 0.10 0.79 0.37 0.00 -0.67 0.00 0.00 178.83 179.43 3hk7 h ALA 75 N 0.87 0.82 -0.72 3.87 0.00 -1.17 -0.92 119.26 122.01 3hk7 h ALA 75 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3hk7 h ALA 75 Cb 0.49 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3hk7 h ALA 75 CO 0.02 0.31 0.32 -0.44 0.00 0.00 0.00 179.25 179.46 3hk7 h ASP 76 N 0.87 0.96 0.07 0.00 3.32 -1.00 -0.81 116.42 119.84 3hk7 h ASP 76 Ca 0.23 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 3hk7 h ASP 76 Cb -0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 3hk7 h ASP 76 CO -0.04 0.85 -0.03 0.25 -1.72 0.00 0.00 179.24 178.54 3hk7 h LEU 77 N 1.01 -0.08 -0.94 1.55 5.85 -0.73 -1.86 115.31 120.11 3hk7 h LEU 77 Ca 0.24 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 3hk7 h LEU 77 Cb 0.16 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 3hk7 h LEU 77 CO -0.03 0.10 0.53 0.40 -0.34 0.00 0.00 178.44 179.10 3hk7 h ILE 78 N -0.26 1.26 -0.26 4.05 2.04 -1.08 0.68 117.51 123.94 3hk7 h ILE 78 Ca -0.01 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 3hk7 h ILE 78 Cb 0.22 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 3hk7 h ILE 78 CO 0.02 0.28 0.16 -0.25 0.00 0.00 0.00 178.15 178.35 3hk7 h TRP 79 N 1.28 0.34 -0.17 1.37 2.91 -1.06 0.23 115.95 120.85 3hk7 h TRP 79 Ca 0.33 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.32 3hk7 h TRP 79 Cb -0.02 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 28.51 3hk7 h TRP 79 CO 0.01 0.26 0.02 1.49 -1.03 0.00 0.00 178.44 179.19 3hk7 h GLU 80 N 0.33 0.29 -0.17 2.65 4.57 -0.92 -0.45 114.58 120.87 3hk7 h GLU 80 Ca 0.09 -0.08 -0.19 0.00 -1.18 0.00 0.00 59.36 58.01 3hk7 h GLU 80 Cb 0.02 -0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.58 3hk7 h GLU 80 CO -0.02 0.47 -0.62 0.93 -1.18 0.00 0.00 179.01 178.59 3hk7 h GLU 81 N 0.07 0.73 0.00 1.92 4.39 -0.81 0.12 114.58 121.00 3hk7 h GLU 81 Ca 0.05 -0.55 -0.03 0.00 0.34 0.00 0.00 59.36 59.17 3hk7 h GLU 81 Cb 0.32 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 3hk7 h GLU 81 CO 0.00 1.17 -1.76 1.28 -1.16 0.00 0.00 179.01 178.55 3hk7 n LEU 82 N -4.06 0.25 -0.07 1.33 4.77 0.06 -3.79 117.00 115.50 3hk7 n LEU 82 Ca -0.07 0.10 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 3hk7 n LEU 82 Cb 0.66 0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.71 3hk7 n LEU 82 CO 0.50 -0.00 -0.94 0.49 -1.33 0.00 0.00 177.39 176.10 3hk7 n PHE 83 N -2.43 0.00 -0.10 -1.77 3.72 -0.23 -3.20 117.46 113.44 3hk7 n PHE 83 Ca -0.05 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.15 3hk7 n PHE 83 Cb 0.62 -0.55 -0.10 0.00 -0.94 0.00 0.00 39.48 38.52 3hk7 n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hk7 n ILE 84 N -2.82 1.52 0.19 4.37 2.08 -0.87 -4.32 119.36 119.51 3hk7 n ILE 84 Ca -0.24 -0.03 0.04 0.00 0.56 0.00 0.00 62.75 63.08 3hk7 n ILE 84 Cb 0.78 -2.08 0.38 0.00 -0.75 0.00 0.00 39.64 37.97 3hk7 n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hk7 h LYS 85 N -1.00 0.00 -4.28 0.38 1.57 -0.92 -3.44 116.57 108.89 3hk7 h LYS 85 Ca -0.34 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.26 3hk7 h LYS 85 Cb 1.22 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.34 3hk7 h LYS 85 CO -0.20 0.37 -0.70 1.03 -0.57 0.00 0.00 179.45 179.37 3hk7 s ARG 86 N -4.03 0.51 0.28 3.15 3.00 -1.25 -5.06 118.95 115.54 3hk7 s ARG 86 Ca -0.02 -0.90 -0.29 0.00 0.00 0.00 0.00 55.73 54.51 3hk7 s ARG 86 Cb 0.13 -0.00 -0.10 0.00 0.00 0.00 0.00 34.95 34.99 3hk7 s ARG 86 CO 0.71 -0.04 1.25 -1.12 0.00 0.00 0.00 175.30 176.10 3hk7 s SER 87 N -2.09 6.95 -0.81 0.23 0.01 -1.26 -3.67 113.70 113.06 3hk7 s SER 87 Ca -0.05 2.48 -0.06 0.00 1.31 0.00 0.00 55.95 59.64 3hk7 s SER 87 Cb -0.03 -2.63 -0.10 0.00 0.21 0.00 0.00 66.02 63.47 3hk7 s SER 87 CO -0.03 -0.43 2.43 -0.81 0.41 0.00 0.00 173.24 174.81 3hk7 n PRO 88 N 1.48 2.22 0.21 12.44 -0.04 -1.20 -4.65 135.00 145.47 3hk7 n PRO 88 Ca 0.02 -1.39 0.10 0.00 -0.04 0.00 0.00 63.50 62.18 3hk7 n PRO 88 Cb 0.43 -2.35 0.21 0.00 -0.04 0.00 0.00 33.50 31.74 3hk7 n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk7 h VAL 89 N 3.04 0.22 -4.13 0.52 -1.51 -1.90 -3.25 116.25 109.24 3hk7 h VAL 89 Ca 0.47 -1.23 -0.51 0.00 -1.23 0.00 0.00 66.70 64.21 3hk7 h VAL 89 Cb 0.42 2.03 0.20 0.00 -2.13 0.00 0.00 31.29 31.81 3hk7 h VAL 89 CO 1.20 0.12 0.19 -0.94 -1.23 0.00 0.00 177.57 176.92 3hk7 s SER 90 N -6.21 2.64 0.21 4.19 1.04 -1.26 -4.72 113.70 109.59 3hk7 s SER 90 Ca 0.05 2.10 -0.10 0.00 0.48 0.00 0.00 55.95 58.48 3hk7 s SER 90 Cb 0.06 -2.53 0.16 0.00 0.10 0.00 0.00 66.02 63.81 3hk7 s SER 90 CO 0.67 -3.26 1.87 -0.08 0.98 0.00 0.00 173.24 173.42 3hk7 h GLU 91 N -1.98 1.03 -0.17 4.02 4.57 -1.97 -0.67 114.58 119.40 3hk7 h GLU 91 Ca -0.46 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 57.63 3hk7 h GLU 91 Cb 1.28 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 29.63 3hk7 h GLU 91 CO 0.43 0.70 0.04 0.00 -1.18 0.00 0.00 179.01 178.99 3hk7 h ALA 92 N 1.27 0.23 -0.29 2.92 0.00 -1.95 0.07 119.26 121.50 3hk7 h ALA 92 Ca 0.28 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3hk7 h ALA 92 Cb -0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3hk7 h ALA 92 CO -0.06 -0.12 -0.35 0.00 0.00 0.00 0.00 179.25 178.72 3hk7 h ARG 94 N 0.54 1.31 -0.66 0.00 2.43 -1.01 -2.14 114.38 114.85 3hk7 h ARG 94 Ca 0.06 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.21 3hk7 h ARG 94 Cb 0.85 -0.29 -0.06 0.00 -0.42 0.00 0.00 29.97 30.05 3hk7 h ARG 94 CO 0.07 0.87 0.35 0.78 -1.51 0.00 0.00 179.97 180.53 3hk7 h GLY 95 N 1.34 0.97 0.80 2.80 0.00 -0.29 -1.14 103.07 107.56 3hk7 h GLY 95 Ca 0.36 -0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.49 3hk7 h GLY 95 CO -0.08 0.11 0.26 -2.08 0.00 0.00 0.00 176.54 174.76 3hk7 h VAL 96 N 0.63 1.00 -0.72 4.60 2.07 -1.02 -1.58 116.25 121.22 3hk7 h VAL 96 Ca 0.31 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 3hk7 h VAL 96 Cb 0.25 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 3hk7 h VAL 96 CO -0.21 0.10 0.43 -0.07 0.02 0.00 0.00 177.57 177.83 3hk7 h LEU 97 N 0.52 0.86 -1.33 2.57 3.38 -1.04 -1.64 115.31 118.62 3hk7 h LEU 97 Ca 0.20 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3hk7 h LEU 97 Cb 0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3hk7 h LEU 97 CO -0.12 0.67 0.20 0.74 0.09 0.00 0.00 178.44 180.02 3hk7 h THR 98 N 0.98 1.17 0.08 0.22 2.02 -0.76 -1.12 112.91 115.50 3hk7 h THR 98 Ca 0.26 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 3hk7 h THR 98 Cb -0.03 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 3hk7 h THR 98 CO -0.05 0.20 -0.04 0.00 0.37 0.00 0.00 175.52 176.00 3hk7 h LEU 100 N -0.44 0.42 -0.65 0.00 3.38 -1.04 -1.41 115.31 115.57 3hk7 h LEU 100 Ca -0.01 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3hk7 h LEU 100 Cb 0.38 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3hk7 h LEU 100 CO 0.02 0.28 0.20 -0.61 0.09 0.00 0.00 178.44 178.41 3hk7 h GLN 101 N 0.57 1.01 -0.01 1.13 4.15 -1.18 -0.52 115.11 120.25 3hk7 h GLN 101 Ca 0.28 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 3hk7 h GLN 101 Cb 0.21 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 3hk7 h GLN 101 CO -0.20 0.89 -0.25 0.78 -1.93 0.00 0.00 178.83 178.12 3hk7 h GLY 102 N 0.94 0.03 1.44 2.39 0.00 -0.67 -1.85 103.07 105.35 3hk7 h GLY 102 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3hk7 h GLY 102 CO -0.01 0.02 0.00 1.04 0.00 0.00 0.00 176.54 177.59 3hk7 n LEU 103 N -4.24 0.00 0.00 3.11 4.77 -0.59 -4.87 117.00 115.19 3hk7 n LEU 103 Ca -0.02 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3hk7 n LEU 103 Cb 0.31 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3hk7 n LEU 103 CO 0.37 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3hk7 n GLY 104 N 1.15 0.62 3.89 -0.72 0.00 -0.69 -5.07 105.19 104.36 3hk7 n GLY 104 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3hk7 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hk7 s LEU 105 N 0.00 3.02 -0.40 0.99 1.43 -0.24 -5.00 118.68 118.49 3hk7 s LEU 105 Ca 0.00 1.11 -0.03 0.00 -1.03 0.00 0.00 54.13 54.18 3hk7 s LEU 105 Cb 0.00 -3.95 0.10 0.00 0.03 0.00 0.00 46.19 42.37 3hk7 s LEU 105 CO 0.00 -1.20 0.19 -0.62 0.23 0.00 0.00 176.35 174.95 3hk7 s ASP 106 N -4.32 5.24 0.61 2.29 -1.08 -1.26 -4.03 116.67 114.13 3hk7 s ASP 106 Ca 0.57 -1.94 0.34 0.00 -0.52 0.00 0.00 52.55 50.99 3hk7 s ASP 106 Cb -0.11 -1.83 1.98 0.00 -1.46 0.00 0.00 42.92 41.51 3hk7 s ASP 106 CO 0.51 -0.52 2.29 -0.65 0.52 0.00 0.00 175.17 177.32 3hk7 h PRO 107 N 8.06 0.00 -0.47 4.34 0.11 -1.91 -2.60 132.00 139.54 3hk7 h PRO 107 Ca -0.14 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.99 3hk7 h PRO 107 Cb 1.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 3hk7 h PRO 107 CO 0.69 0.00 0.31 0.00 -0.21 0.00 0.00 178.00 178.79 3hk7 h ALA 108 N 2.00 1.74 0.00 -0.75 0.00 -2.01 -2.25 119.26 117.99 3hk7 h ALA 108 Ca -0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 3hk7 h ALA 108 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3hk7 h ALA 108 CO 0.00 0.22 -0.73 1.79 0.00 0.00 0.00 179.25 180.53 3hk7 h THR 109 N 0.57 1.46 -2.08 0.00 1.35 -1.90 -3.47 112.91 108.84 3hk7 h THR 109 Ca 0.18 -2.57 -0.40 0.00 -0.55 0.00 0.00 66.41 63.08 3hk7 h THR 109 Cb 0.03 2.41 -0.07 0.00 -1.73 0.00 0.00 68.15 68.79 3hk7 h THR 109 CO -0.04 0.72 -0.45 0.54 -0.25 0.00 0.00 175.52 176.03 3hk7 n ARG 110 N -3.57 -1.50 -2.84 4.72 1.74 -0.85 -4.90 116.66 109.46 3hk7 n ARG 110 Ca -0.00 1.05 -0.44 0.00 -0.77 0.00 0.00 57.85 57.69 3hk7 n ARG 110 Cb 0.74 -5.55 -0.01 0.00 -1.02 0.00 0.00 32.46 26.62 3hk7 n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hk7 s ASP 111 N -2.38 6.92 0.32 0.55 -1.08 -1.26 -4.85 116.67 114.89 3hk7 s ASP 111 Ca 0.00 -2.65 0.05 0.00 -0.52 0.00 0.00 52.55 49.43 3hk7 s ASP 111 Cb 0.00 -2.45 0.69 0.00 -1.46 0.00 0.00 42.92 39.70 3hk7 s ASP 111 CO 0.00 -0.93 1.84 0.25 0.52 0.00 0.00 175.17 176.85 3hk7 h LEU 112 N 10.63 0.79 -0.52 -1.34 5.85 -1.98 -1.08 115.31 127.66 3hk7 h LEU 112 Ca 0.32 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 59.05 3hk7 h LEU 112 Cb 0.90 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3hk7 h LEU 112 CO 1.28 0.40 0.19 -0.61 -0.34 0.00 0.00 178.44 179.36 3hk7 h GLN 113 N 0.84 0.79 -0.86 1.25 5.75 -2.00 -1.27 115.11 119.61 3hk7 h GLN 113 Ca 0.49 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.82 3hk7 h GLN 113 Cb 0.64 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 29.03 3hk7 h GLN 113 CO -0.25 0.71 0.51 0.28 -2.65 0.00 0.00 178.83 177.43 3hk7 h VAL 114 N 0.70 1.24 -0.55 2.39 2.07 -1.64 -1.69 116.25 118.77 3hk7 h VAL 114 Ca 0.17 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 3hk7 h VAL 114 Cb 0.23 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 3hk7 h VAL 114 CO -0.01 0.25 0.24 1.88 0.02 0.00 0.00 177.57 179.95 3hk7 h TYR 115 N 1.19 0.82 -0.86 1.57 0.05 -0.99 -2.52 116.97 116.22 3hk7 h TYR 115 Ca 0.31 -0.05 0.04 0.00 0.05 0.00 0.00 58.73 59.07 3hk7 h TYR 115 Cb -0.04 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 37.40 3hk7 h TYR 115 CO -0.00 0.66 0.57 0.00 -1.05 0.00 0.00 178.16 178.34 3hk7 h ARG 116 N 0.75 1.04 0.00 4.88 3.08 -0.73 -1.67 114.38 121.73 3hk7 h ARG 116 Ca 0.19 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 3hk7 h ARG 116 Cb 0.17 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3hk7 h ARG 116 CO -0.02 0.69 -0.02 0.93 -1.07 0.00 0.00 179.97 180.48 3hk7 h GLU 117 N 1.07 0.00 -0.25 0.04 5.08 -0.87 -2.34 114.58 117.31 3hk7 h GLU 117 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3hk7 h GLU 117 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 3hk7 h GLU 117 CO -0.10 0.02 0.16 -0.92 -1.00 0.00 0.00 179.01 177.16 3hk7 h TYR 118 N 0.00 0.32 -0.07 4.33 3.20 -1.20 -3.10 116.97 120.46 3hk7 h TYR 118 Ca -0.00 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.69 3hk7 h TYR 118 Cb 0.04 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3hk7 h TYR 118 CO 0.00 0.23 -0.73 0.74 -1.64 0.00 0.00 178.16 176.76 3hk7 h PHE 119 N 0.32 0.48 -0.53 -3.82 0.04 -1.50 -3.27 116.94 108.65 3hk7 h PHE 119 Ca 0.09 -0.21 0.13 0.00 2.80 0.00 0.00 57.97 60.78 3hk7 h PHE 119 Cb -0.00 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 3hk7 h PHE 119 CO -0.05 0.96 0.37 0.00 -0.60 0.00 0.00 178.31 178.99 3hk7 h ALA 120 N 0.98 2.32 -0.71 2.45 0.00 -1.36 -2.44 119.26 120.51 3hk7 h ALA 120 Ca -0.03 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.63 3hk7 h ALA 120 Cb 1.29 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 3hk7 h ALA 120 CO 0.12 -0.46 0.30 0.36 0.00 0.00 0.00 179.25 179.57 3hk7 n LYS 121 N -4.42 3.25 -4.20 0.00 2.85 -1.23 -4.93 118.16 109.47 3hk7 n LYS 121 Ca 0.09 -2.73 -0.16 0.00 -1.05 0.00 0.00 58.31 54.47 3hk7 n LYS 121 Cb 0.51 -2.11 -0.11 0.00 -0.65 0.00 0.00 35.03 32.67 3hk7 n LYS 121 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3hk7 s LYS 122 N -2.75 0.92 0.44 -1.58 1.02 -0.92 -5.14 119.74 111.74 3hk7 s LYS 122 Ca 0.49 -1.21 0.04 0.00 0.02 0.00 0.00 55.97 55.32 3hk7 s LYS 122 Cb 0.40 -0.66 0.01 0.00 -0.52 0.00 0.00 37.83 37.06 3hk7 s LYS 122 CO 0.12 0.11 0.63 0.95 -0.92 0.00 0.00 175.35 176.24 3hk7 s THR 123 N -2.41 3.38 0.20 2.17 -4.23 -1.26 -4.96 115.64 108.53 3hk7 s THR 123 Ca 0.07 -0.79 -0.11 0.00 -1.18 0.00 0.00 61.69 59.69 3hk7 s THR 123 Cb -0.03 -3.21 0.12 0.00 1.34 0.00 0.00 72.50 70.73 3hk7 s THR 123 CO 0.01 -0.11 1.81 0.28 -0.54 0.00 0.00 174.62 176.07 3hk7 h SER 124 N 0.48 0.88 -0.93 3.99 0.02 -1.97 -1.73 113.55 114.29 3hk7 h SER 124 Ca -0.43 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 3hk7 h SER 124 Cb 1.27 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 63.54 3hk7 h SER 124 CO 0.52 0.72 0.59 -0.33 -1.14 0.00 0.00 176.83 177.19 3hk7 h GLU 125 N 0.96 1.23 -0.33 3.45 3.07 -1.94 -1.06 114.58 119.96 3hk7 h GLU 125 Ca 0.25 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 58.89 3hk7 h GLU 125 Cb 0.05 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 27.67 3hk7 h GLU 125 CO -0.04 0.84 -0.31 0.93 -1.40 0.00 0.00 179.01 179.03 3hk7 h GLU 126 N 1.26 0.71 -0.33 2.33 5.08 -1.83 -2.42 114.58 119.39 3hk7 h GLU 126 Ca 0.34 -0.32 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 3hk7 h GLU 126 Cb -0.11 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 3hk7 h GLU 126 CO -0.07 0.93 -0.48 0.37 -1.00 0.00 0.00 179.01 178.75 3hk7 h GLN 127 N 0.60 0.91 -0.74 2.33 5.75 -0.95 -1.21 115.11 121.80 3hk7 h GLN 127 Ca 0.07 -0.54 0.00 0.00 -0.15 0.00 0.00 58.65 58.04 3hk7 h GLN 127 Cb 0.82 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.38 3hk7 h GLN 127 CO 0.07 1.18 0.47 0.28 -2.65 0.00 0.00 178.83 178.18 3hk7 h VAL 128 N 0.71 1.20 -0.50 2.39 2.07 -1.15 0.39 116.25 121.37 3hk7 h VAL 128 Ca 0.03 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.09 3hk7 h VAL 128 Cb 1.09 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3hk7 h VAL 128 CO 0.11 0.20 0.08 0.44 0.02 0.00 0.00 177.57 178.42 3hk7 h ASP 129 N 1.01 0.80 0.21 0.57 3.32 -1.29 -0.28 116.42 120.77 3hk7 h ASP 129 Ca 0.27 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3hk7 h ASP 129 Cb -0.08 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.26 3hk7 h ASP 129 CO -0.05 0.86 -0.10 0.74 -1.72 0.00 0.00 179.24 178.96 3hk7 h THR 130 N 0.71 0.85 -0.09 0.35 2.02 -0.58 -2.40 112.91 113.76 3hk7 h THR 130 Ca 0.15 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 3hk7 h THR 130 Cb 0.40 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 3hk7 h THR 130 CO 0.01 0.08 0.04 0.58 0.37 0.00 0.00 175.52 176.60 3hk7 h VAL 131 N -0.46 1.12 -0.37 3.16 2.07 -0.18 0.18 116.25 121.76 3hk7 h VAL 131 Ca -0.03 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.15 3hk7 h VAL 131 Cb 0.35 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3hk7 h VAL 131 CO 0.05 0.10 0.24 -0.07 0.02 0.00 0.00 177.57 177.91 3hk7 h LEU 132 N 0.02 0.43 0.30 2.57 3.38 -1.11 0.18 115.31 121.08 3hk7 h LEU 132 Ca 0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3hk7 h LEU 132 Cb 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hk7 h LEU 132 CO -0.00 0.31 -0.15 -0.61 0.09 0.00 0.00 178.44 178.08 3hk7 h GLN 133 N 0.50 -0.39 -0.95 1.13 -0.00 -1.09 -0.67 115.11 113.64 3hk7 h GLN 133 Ca 0.14 0.03 0.03 0.00 -0.00 0.00 0.00 58.65 58.84 3hk7 h GLN 133 Cb -0.05 0.09 -0.05 0.00 0.00 0.00 0.00 27.48 27.47 3hk7 h GLN 133 CO -0.03 -0.06 0.62 -0.07 0.00 0.00 0.00 178.83 179.29 3hk7 h LEU 134 N -0.82 1.04 -0.49 -2.39 3.38 -0.53 -1.95 115.31 113.55 3hk7 h LEU 134 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hk7 h LEU 134 Cb 0.52 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3hk7 h LEU 134 CO 0.07 0.73 -0.07 0.00 0.09 0.00 0.00 178.44 179.25 3hk7 n ALA 135 N -2.36 2.73 -3.91 1.53 0.00 0.60 -4.93 120.51 114.18 3hk7 n ALA 135 Ca 0.12 -0.34 -0.27 0.00 0.00 0.00 0.00 53.44 52.95 3hk7 n ALA 135 Cb 0.07 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3hk7 n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hk7 n ASN 136 N -0.52 -1.95 -4.42 0.00 5.15 -0.43 -4.79 115.26 108.31 3hk7 n ASN 136 Ca 0.17 -0.90 -0.39 0.00 -0.60 0.00 0.00 54.58 52.86 3hk7 n ASN 136 Cb 0.29 -3.48 -0.11 0.00 -0.53 0.00 0.00 39.78 35.94 3hk7 n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hk7 s VAL 137 N -3.64 4.62 -0.08 3.44 1.01 -0.39 -0.44 120.40 124.93 3hk7 s VAL 137 Ca 0.25 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 3hk7 s VAL 137 Cb -0.13 -3.43 -0.29 0.00 0.00 0.00 0.00 36.38 32.53 3hk7 s VAL 137 CO 0.86 -0.03 0.71 0.77 0.00 0.00 0.00 175.10 177.40 3hk7 h SER 138 N 8.38 0.43 -3.91 3.32 4.64 -1.29 -3.45 113.55 121.68 3hk7 h SER 138 Ca -0.30 -0.89 -0.52 0.00 -0.47 0.00 0.00 61.79 59.61 3hk7 h SER 138 Cb 1.13 -0.14 -0.31 0.00 -0.31 0.00 0.00 62.40 62.77 3hk7 h SER 138 CO 0.63 1.53 -0.82 -1.81 -0.87 0.00 0.00 176.83 175.49 3hk7 s ASP 139 N -7.02 1.86 -0.14 4.97 1.01 -1.07 -4.73 116.67 111.55 3hk7 s ASP 139 Ca -0.17 -0.30 0.02 0.00 0.71 0.00 0.00 52.55 52.81 3hk7 s ASP 139 Cb 0.03 -0.49 0.01 0.00 1.01 0.00 0.00 42.92 43.48 3hk7 s ASP 139 CO 0.80 0.13 -0.20 -0.69 0.21 0.00 0.00 175.17 175.41 3hk7 s VAL 140 N 0.05 2.22 -0.23 -1.27 1.01 0.23 -0.42 120.40 121.99 3hk7 s VAL 140 Ca -0.03 -0.93 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 3hk7 s VAL 140 Cb -0.10 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3hk7 s VAL 140 CO 0.01 0.54 0.30 -0.69 0.00 0.00 0.00 175.10 175.26 3hk7 s VAL 141 N 0.78 5.26 0.81 2.92 1.01 -0.12 -0.27 120.40 130.79 3hk7 s VAL 141 Ca -0.07 0.47 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 3hk7 s VAL 141 Cb -0.16 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.75 3hk7 s VAL 141 CO -0.01 0.27 1.12 -0.04 0.00 0.00 0.00 175.10 176.45 3hk7 s MET 142 N 1.36 1.29 -0.29 2.72 -1.94 0.14 -1.61 119.30 120.97 3hk7 s MET 142 Ca 0.14 -0.82 0.02 0.00 -1.71 0.00 0.00 55.69 53.32 3hk7 s MET 142 Cb -0.14 -2.14 0.08 0.00 2.01 0.00 0.00 34.83 34.64 3hk7 s MET 142 CO 0.07 -1.82 -0.01 0.99 -0.01 0.00 0.00 175.02 174.25 3hk7 s THR 143 N -3.44 1.91 -0.34 2.05 2.01 -1.15 -3.58 115.64 113.09 3hk7 s THR 143 Ca 0.69 -1.80 -0.08 0.00 0.31 0.00 0.00 61.69 60.81 3hk7 s THR 143 Cb -0.05 -2.26 0.03 0.00 0.01 0.00 0.00 72.50 70.23 3hk7 s THR 143 CO 0.48 -0.36 0.13 0.20 -0.69 0.00 0.00 174.62 174.38 3hk7 s ASN 144 N 1.15 5.42 -0.45 3.53 -0.87 -0.20 -4.96 114.94 118.56 3hk7 s ASN 144 Ca 0.02 -1.05 -0.13 0.00 -1.57 0.00 0.00 52.86 50.13 3hk7 s ASN 144 Cb -0.19 -1.91 0.07 0.00 -0.02 0.00 0.00 41.25 39.20 3hk7 s ASN 144 CO -0.09 -0.33 0.34 -0.62 -2.57 0.00 0.00 177.10 173.84 3hk7 s ASP 145 N 1.46 5.96 0.48 -1.22 2.15 -1.26 -1.71 116.67 122.53 3hk7 s ASP 145 Ca -0.00 -1.37 0.33 0.00 0.43 0.00 0.00 52.55 51.94 3hk7 s ASP 145 Cb -0.19 -2.11 1.65 0.00 -0.30 0.00 0.00 42.92 41.97 3hk7 s ASP 145 CO 0.04 -0.60 1.99 1.55 -0.17 0.00 0.00 175.17 177.98 3hk7 h PRO 146 N 8.63 0.00 -0.00 4.34 0.13 -1.94 -1.71 132.00 141.44 3hk7 h PRO 146 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3hk7 h PRO 146 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3hk7 h PRO 146 CO 0.83 0.00 -0.02 1.19 -0.23 0.00 0.00 178.00 179.77 3hk7 n PHE 147 N -2.71 0.00 -3.17 1.56 3.72 -1.26 -4.39 117.46 111.21 3hk7 n PHE 147 Ca -0.01 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.99 3hk7 n PHE 147 Cb 0.12 -0.33 -0.06 0.00 -0.94 0.00 0.00 39.48 38.27 3hk7 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk7 s ASP 148 N -2.68 6.58 0.19 4.37 2.15 -0.64 -4.96 116.67 121.68 3hk7 s ASP 148 Ca 0.25 0.71 -0.12 0.00 0.43 0.00 0.00 52.55 53.81 3hk7 s ASP 148 Cb 0.20 -2.32 0.21 0.00 -0.30 0.00 0.00 42.92 40.71 3hk7 s ASP 148 CO 0.49 -0.27 1.74 0.44 -0.17 0.00 0.00 175.17 177.39 3hk7 h ASP 149 N 7.66 0.14 -0.81 -0.34 3.32 -1.87 0.12 116.42 124.64 3hk7 h ASP 149 Ca -0.31 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 3hk7 h ASP 149 Cb 1.14 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 3hk7 h ASP 149 CO 0.75 0.10 0.37 0.78 -1.72 0.00 0.00 179.24 179.52 3hk7 h ASN 150 N 0.34 1.08 -0.07 6.45 2.35 -1.94 -0.79 115.58 122.99 3hk7 h ASN 150 Ca 0.26 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 3hk7 h ASN 150 Cb 0.32 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.41 3hk7 h ASN 150 CO -0.29 0.93 -0.32 -0.33 -1.65 0.00 0.00 177.43 175.77 3hk7 h GLU 151 N 1.16 0.35 0.14 0.81 5.08 -1.71 -2.98 114.58 117.43 3hk7 h GLU 151 Ca 0.28 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3hk7 h GLU 151 Cb 0.16 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3hk7 h GLU 151 CO -0.03 0.91 -0.07 -0.09 -1.00 0.00 0.00 179.01 178.74 3hk7 h ARG 152 N -0.14 -0.18 -0.84 2.33 2.43 -0.71 -2.41 114.38 114.86 3hk7 h ARG 152 Ca -0.02 0.01 0.15 0.00 -0.81 0.00 0.00 59.98 59.32 3hk7 h ARG 152 Cb 0.97 0.04 -0.10 0.00 -0.42 0.00 0.00 29.97 30.46 3hk7 h ARG 152 CO 0.07 -0.11 0.42 0.82 -1.51 0.00 0.00 179.97 179.66 3hk7 h ILE 153 N -0.21 0.70 -0.33 1.20 2.04 -1.24 0.62 117.51 120.30 3hk7 h ILE 153 Ca -0.02 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.65 3hk7 h ILE 153 Cb 0.16 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 3hk7 h ILE 153 CO 0.03 0.11 0.20 -1.28 0.00 0.00 0.00 178.15 177.21 3hk7 h SER 154 N 0.59 0.34 -0.25 1.72 0.87 -1.31 -1.29 113.55 114.21 3hk7 h SER 154 Ca 0.47 -0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.90 3hk7 h SER 154 Cb 0.69 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 3hk7 h SER 154 CO -0.38 0.24 -0.28 -0.50 -0.53 0.00 0.00 176.83 175.38 3hk7 h TRP 155 N 0.41 0.87 -0.77 2.24 4.06 -0.77 -3.07 115.95 118.92 3hk7 h TRP 155 Ca 0.13 -0.22 -0.04 0.00 2.06 0.00 0.00 58.89 60.82 3hk7 h TRP 155 Cb -0.02 -0.20 -0.04 0.00 -1.00 0.00 0.00 29.16 27.90 3hk7 h TRP 155 CO -0.07 0.95 0.33 -0.07 -3.56 0.00 0.00 178.44 176.02 3hk7 h LEU 156 N 0.64 1.03 -4.42 -4.49 3.38 -0.63 -2.72 115.31 108.11 3hk7 h LEU 156 Ca 0.08 -0.14 -0.42 0.00 0.09 0.00 0.00 57.88 57.49 3hk7 h LEU 156 Cb 0.80 -0.27 -0.14 0.00 0.09 0.00 0.00 40.66 41.14 3hk7 h LEU 156 CO 0.07 0.90 0.26 -0.62 0.09 0.00 0.00 178.44 179.13 3hk7 n GLU 157 N -4.30 2.36 0.00 1.13 1.02 -0.51 -4.93 120.64 115.41 3hk7 n GLU 157 Ca 0.07 -2.00 0.00 0.00 -0.02 0.00 0.00 57.16 55.21 3hk7 n GLU 157 Cb 0.16 -2.12 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 3hk7 n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hk7 n GLY 158 N 1.37 1.62 2.08 0.62 0.00 -1.03 -4.98 105.19 104.88 3hk7 n GLY 158 Ca 0.48 -0.04 -0.00 0.00 0.00 0.00 0.00 46.02 46.46 3hk7 n GLY 158 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3hk7 n LYS 159 N 0.00 -1.17 -4.46 1.61 3.00 -1.25 -4.42 118.16 111.46 3hk7 n LYS 159 Ca 0.00 0.85 -0.23 0.00 -0.00 0.00 0.00 58.31 58.93 3hk7 n LYS 159 Cb 0.00 -1.45 -0.13 0.00 0.00 0.00 0.00 35.03 33.44 3hk7 n LYS 159 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 3hk7 s GLN 160 N -0.14 1.17 0.43 1.64 -1.52 -1.26 -4.68 119.66 115.31 3hk7 s GLN 160 Ca -0.00 -0.94 -0.19 0.00 -1.95 0.00 0.00 55.36 52.28 3hk7 s GLN 160 Cb 0.00 -1.29 -0.10 0.00 -0.22 0.00 0.00 33.01 31.40 3hk7 s GLN 160 CO 0.00 0.32 0.92 -1.25 -0.25 0.00 0.00 175.29 175.03 3hk7 s PRO 161 N -1.35 4.14 0.82 2.91 0.04 -1.26 -4.94 135.00 135.35 3hk7 s PRO 161 Ca 0.05 1.01 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 3hk7 s PRO 161 Cb -0.09 -2.21 0.08 0.00 0.04 0.00 0.00 34.50 32.32 3hk7 s PRO 161 CO 0.02 -0.05 1.09 0.16 0.04 0.00 0.00 177.00 178.26 3hk7 s ASP 162 N -2.39 4.17 0.31 6.66 -4.77 -1.26 -4.85 116.67 114.55 3hk7 s ASP 162 Ca 0.60 1.66 0.10 0.00 -3.30 0.00 0.00 52.55 51.61 3hk7 s ASP 162 Cb -0.09 -2.36 0.54 0.00 -1.09 0.00 0.00 42.92 39.91 3hk7 s ASP 162 CO 0.17 -2.22 1.16 -1.54 0.70 0.00 0.00 175.17 173.44 3hk7 n SER 163 N -3.63 0.26 0.13 2.11 3.41 -1.26 -0.66 113.62 113.97 3hk7 n SER 163 Ca 0.08 0.48 0.05 0.00 -0.26 0.00 0.00 58.87 59.23 3hk7 n SER 163 Cb 0.54 -0.39 0.03 0.00 -0.26 0.00 0.00 64.21 64.13 3hk7 n SER 163 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3hk7 h ARG 164 N 0.00 0.00 -5.61 4.33 3.08 -1.89 -3.46 114.38 110.84 3hk7 h ARG 164 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 3hk7 h ARG 164 Cb 0.79 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.67 3hk7 h ARG 164 CO 0.00 0.27 -0.62 -0.06 -1.07 0.00 0.00 179.97 178.49 3hk7 s PHE 165 N -3.07 3.15 0.09 3.04 0.08 0.16 -0.60 117.98 120.83 3hk7 s PHE 165 Ca 0.02 0.03 0.10 0.00 0.12 0.00 0.00 56.93 57.20 3hk7 s PHE 165 Cb 0.08 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 3hk7 s PHE 165 CO 0.75 0.25 -0.26 -1.01 -0.10 0.00 0.00 175.22 174.85 3hk7 s HIS 166 N -0.23 2.24 0.29 0.36 3.76 0.63 -4.61 115.29 117.72 3hk7 s HIS 166 Ca 0.06 -0.39 -0.06 0.00 -0.15 0.00 0.00 55.06 54.52 3hk7 s HIS 166 Cb -0.12 -1.27 -0.05 0.00 1.11 0.00 0.00 32.58 32.24 3hk7 s HIS 166 CO 0.02 0.24 0.56 0.00 -0.85 0.00 0.00 174.74 174.71 3hk7 s ALA 167 N -0.96 3.61 -0.06 -1.40 0.00 -1.26 0.26 121.76 121.95 3hk7 s ALA 167 Ca 0.12 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.54 3hk7 s ALA 167 Cb -0.10 -2.33 0.04 0.00 0.00 0.00 0.00 23.12 20.73 3hk7 s ALA 167 CO 0.04 0.27 0.11 0.00 0.00 0.00 0.00 175.76 176.18 3hk7 s ALA 168 N -2.06 -0.00 -0.69 0.00 0.00 -1.24 -1.14 121.76 116.62 3hk7 s ALA 168 Ca 0.45 0.41 -0.27 0.00 0.00 0.00 0.00 51.96 52.55 3hk7 s ALA 168 Cb -0.11 -0.64 0.01 0.00 0.00 0.00 0.00 23.12 22.38 3hk7 s ALA 168 CO 0.29 -0.44 1.49 -1.17 0.00 0.00 0.00 175.76 175.93 3hk7 s LEU 169 N 1.99 3.21 -0.27 0.00 2.96 -0.80 -1.04 118.68 124.73 3hk7 s LEU 169 Ca 0.01 -0.16 -0.24 0.00 -0.22 0.00 0.00 54.13 53.53 3hk7 s LEU 169 Cb -0.12 -2.55 -0.00 0.00 0.50 0.00 0.00 46.19 44.01 3hk7 s LEU 169 CO -0.04 -2.04 0.81 -0.60 -1.32 0.00 0.00 176.35 173.16 3hk7 s ARG 170 N 6.21 4.08 -0.23 1.98 6.06 -0.70 -0.69 118.95 135.67 3hk7 s ARG 170 Ca 0.47 0.77 0.13 0.00 -2.50 0.00 0.00 55.73 54.60 3hk7 s ARG 170 Cb -0.10 -3.68 0.50 0.00 0.06 0.00 0.00 34.95 31.73 3hk7 s ARG 170 CO 0.17 -0.59 1.42 1.28 -2.50 0.00 0.00 175.30 175.08 3hk7 n LEU 171 N 6.10 3.88 -0.17 -0.88 4.77 0.78 -4.41 117.00 127.07 3hk7 n LEU 171 Ca 0.05 -3.40 -0.03 0.00 -0.03 0.00 0.00 56.01 52.60 3hk7 n LEU 171 Cb 0.48 -0.58 0.04 0.00 -2.33 0.00 0.00 43.42 41.03 3hk7 n LEU 171 CO 0.49 0.96 0.76 0.44 -1.33 0.00 0.00 177.39 178.71 3hk7 h ASP 172 N 1.25 -0.50 -0.78 -1.43 5.19 -1.92 -1.08 116.42 117.14 3hk7 h ASP 172 Ca 0.11 0.16 0.03 0.00 -0.62 0.00 0.00 57.03 56.71 3hk7 h ASP 172 Cb 1.52 0.33 -0.05 0.00 0.18 0.00 0.00 39.33 41.31 3hk7 h ASP 172 CO 0.29 -0.18 0.50 -0.65 -3.12 0.00 0.00 179.24 176.08 3hk7 h PRO 173 N -0.01 0.95 0.02 3.56 0.11 -1.95 0.19 132.00 134.88 3hk7 h PRO 173 Ca 0.25 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 3hk7 h PRO 173 Cb 0.39 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.28 3hk7 h PRO 173 CO -0.54 0.63 -0.01 1.25 -0.21 0.00 0.00 178.00 179.12 3hk7 h LEU 174 N 0.98 -0.03 -0.38 2.35 5.85 -1.76 -1.08 115.31 121.24 3hk7 h LEU 174 Ca 0.31 -0.41 -0.19 0.00 0.84 0.00 0.00 57.88 58.43 3hk7 h LEU 174 Cb -0.01 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 3hk7 h LEU 174 CO -0.10 0.40 -0.75 -0.07 -0.34 0.00 0.00 178.44 177.57 3hk7 h LEU 175 N -0.46 0.46 0.00 2.25 4.07 -1.15 -3.18 115.31 117.29 3hk7 h LEU 175 Ca -0.00 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.65 3hk7 h LEU 175 Cb 0.44 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.04 3hk7 h LEU 175 CO 0.01 1.05 -1.83 0.59 -1.08 0.00 0.00 178.44 177.18 3hk7 n ASN 176 N -3.82 0.83 -2.39 -0.43 3.02 0.67 -3.80 115.26 109.35 3hk7 n ASN 176 Ca -0.04 -0.01 -0.15 0.00 -0.03 0.00 0.00 54.58 54.35 3hk7 n ASN 176 Cb 0.72 1.83 0.03 0.00 -0.61 0.00 0.00 39.78 41.75 3hk7 n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hk7 n GLU 177 N -2.13 2.79 -0.20 3.52 1.02 -0.41 -4.91 120.64 120.31 3hk7 n GLU 177 Ca -0.03 -3.91 0.01 0.00 -0.02 0.00 0.00 57.16 53.21 3hk7 n GLU 177 Cb 0.47 -1.98 0.10 0.00 -0.02 0.00 0.00 31.44 30.02 3hk7 n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hk7 h TYR 178 N 2.41 0.01 -1.13 -0.32 3.20 -1.53 0.12 116.97 119.73 3hk7 h TYR 178 Ca 0.15 0.04 0.32 0.00 3.14 0.00 0.00 58.73 62.39 3hk7 h TYR 178 Cb 1.38 0.09 -0.10 0.00 1.54 0.00 0.00 36.73 39.63 3hk7 h TYR 178 CO 0.70 -0.14 0.72 0.93 -1.64 0.00 0.00 178.16 178.74 3hk7 h GLU 179 N 0.14 0.28 0.02 1.82 4.39 -1.91 0.48 114.58 119.80 3hk7 h GLU 179 Ca 0.32 -0.02 -0.31 0.00 0.34 0.00 0.00 59.36 59.69 3hk7 h GLU 179 Cb 0.51 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.05 3hk7 h GLU 179 CO -0.50 0.18 -1.71 1.04 -1.16 0.00 0.00 179.01 176.87 3hk7 n GLN 180 N -4.65 0.60 0.16 2.33 3.00 -0.63 -4.36 117.38 113.83 3hk7 n GLN 180 Ca 0.29 0.45 0.15 0.00 -0.01 0.00 0.00 57.00 57.88 3hk7 n GLN 180 Cb 1.06 -1.67 0.73 0.00 0.00 0.00 0.00 30.24 30.36 3hk7 n GLN 180 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3hk7 h THR 181 N -0.82 0.73 -0.48 5.09 2.02 -0.08 -2.21 112.91 117.15 3hk7 h THR 181 Ca -0.45 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 3hk7 h THR 181 Cb 1.50 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 3hk7 h THR 181 CO -0.22 0.00 0.29 0.07 0.37 0.00 0.00 175.52 176.03 3hk7 h LYS 182 N 0.00 0.65 -0.63 6.66 2.10 -0.26 -2.11 116.57 122.99 3hk7 h LYS 182 Ca 0.11 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.68 3hk7 h LYS 182 Cb 0.47 -0.14 -0.03 0.00 -0.90 0.00 0.00 32.23 31.63 3hk7 h LYS 182 CO -0.00 0.46 0.30 0.45 -2.00 0.00 0.00 179.45 178.66 3hk7 h HIS 183 N 0.66 0.91 -0.35 0.07 3.86 -1.64 -2.30 115.15 116.36 3hk7 h HIS 183 Ca 0.18 -0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.26 3hk7 h HIS 183 Cb -0.03 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.15 3hk7 h HIS 183 CO 0.00 0.69 -0.10 0.00 0.86 0.00 0.00 177.93 179.37 3hk7 h ARG 184 N 0.86 0.60 -0.58 2.45 3.08 -1.52 -1.29 114.38 117.99 3hk7 h ARG 184 Ca 0.22 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 3hk7 h ARG 184 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 3hk7 h ARG 184 CO -0.03 0.70 0.34 -0.07 -1.07 0.00 0.00 179.97 179.84 3hk7 h LEU 185 N 0.55 0.69 -0.29 3.04 4.07 -0.90 -1.34 115.31 121.14 3hk7 h LEU 185 Ca 0.10 -0.04 -0.12 0.00 0.08 0.00 0.00 57.88 57.90 3hk7 h LEU 185 Cb 0.51 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.07 3hk7 h LEU 185 CO 0.03 0.55 -0.29 0.03 -1.08 0.00 0.00 178.44 177.67 3hk7 h ARG 186 N 0.80 0.71 0.00 1.13 3.08 -0.83 0.31 114.38 119.58 3hk7 h ARG 186 Ca 0.21 -0.38 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 3hk7 h ARG 186 Cb -0.01 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3hk7 h ARG 186 CO -0.04 0.99 -0.00 -0.44 -1.07 0.00 0.00 179.97 179.41 3hk7 h ASP 187 N 0.46 0.00 -0.67 7.04 3.32 -0.38 -0.29 116.42 125.90 3hk7 h ASP 187 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3hk7 h ASP 187 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 3hk7 h ASP 187 CO 0.07 0.00 0.00 0.79 -1.72 0.00 0.00 179.24 178.38 3hk7 n TRP 188 N -3.19 1.04 -0.22 4.55 8.01 -0.59 -4.94 117.44 122.09 3hk7 n TRP 188 Ca -0.03 -0.53 0.00 0.00 -1.31 0.00 0.00 57.50 55.63 3hk7 n TRP 188 Cb 0.08 -0.06 0.00 0.00 -2.01 0.00 0.00 31.31 29.32 3hk7 n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3hk7 n GLY 189 N 1.40 0.81 3.47 6.99 0.00 -0.12 -5.01 105.19 112.72 3hk7 n GLY 189 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 3hk7 n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hk7 s TYR 190 N -2.57 2.68 -1.35 1.61 2.02 0.10 -4.94 117.35 114.90 3hk7 s TYR 190 Ca 0.00 -0.46 -0.15 0.00 -0.37 0.00 0.00 57.07 56.09 3hk7 s TYR 190 Cb 0.00 -4.26 -0.01 0.00 -0.40 0.00 0.00 41.96 37.29 3hk7 s TYR 190 CO 0.00 -1.61 2.27 1.63 -1.57 0.00 0.00 175.55 176.26 3hk7 n LYS 191 N 7.71 2.71 -2.69 -0.62 4.76 -1.26 -2.97 118.16 125.79 3hk7 n LYS 191 Ca -0.03 -2.38 -0.39 0.00 -2.87 0.00 0.00 58.31 52.64 3hk7 n LYS 191 Cb 0.46 -3.14 -0.06 0.00 -1.84 0.00 0.00 35.03 30.46 3hk7 n LYS 191 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3hk7 s VAL 192 N 3.38 3.98 0.49 -0.18 -7.23 -1.26 -4.63 120.40 114.95 3hk7 s VAL 192 Ca 0.51 1.83 0.02 0.00 -1.81 0.00 0.00 61.98 62.54 3hk7 s VAL 192 Cb 0.14 -4.11 0.02 0.00 0.56 0.00 0.00 36.38 32.99 3hk7 s VAL 192 CO -0.05 0.32 0.70 0.20 -0.31 0.00 0.00 175.10 175.96 3hk7 s ASN 193 N -1.30 5.54 0.49 4.85 0.01 -1.26 -4.98 114.94 118.30 3hk7 s ASN 193 Ca 0.46 0.02 0.24 0.00 -0.71 0.00 0.00 52.86 52.86 3hk7 s ASN 193 Cb -0.24 -1.07 1.29 0.00 0.41 0.00 0.00 41.25 41.63 3hk7 s ASN 193 CO 0.31 -0.91 2.03 0.44 -1.51 0.00 0.00 177.10 177.45 3hk7 h ASP 194 N 0.30 0.00 -3.13 -1.22 3.45 -2.03 -3.42 116.42 110.36 3hk7 h ASP 194 Ca -0.43 0.00 -0.66 0.00 0.43 0.00 0.00 57.03 56.36 3hk7 h ASP 194 Cb 1.28 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.94 3hk7 h ASP 194 CO 0.53 0.16 -0.58 -1.61 -1.57 0.00 0.00 179.24 176.16 3hk7 s GLU 195 N -4.26 3.05 -0.98 3.56 2.02 -1.26 -5.03 118.70 115.79 3hk7 s GLU 195 Ca -0.03 -0.46 -0.23 0.00 0.02 0.00 0.00 54.97 54.27 3hk7 s GLU 195 Cb 0.14 -2.85 0.03 0.00 0.10 0.00 0.00 34.13 31.55 3hk7 s GLU 195 CO 0.62 0.67 1.53 -0.46 0.02 0.00 0.00 175.26 177.63 3hk7 s TRP 196 N -1.11 2.39 0.45 1.61 -0.11 -1.26 -4.64 118.94 116.26 3hk7 s TRP 196 Ca 0.20 -0.54 0.03 0.00 1.22 0.00 0.00 56.10 57.01 3hk7 s TRP 196 Cb -0.12 -4.58 -0.03 0.00 -1.50 0.00 0.00 33.47 27.25 3hk7 s TRP 196 CO 0.10 -1.92 0.06 0.54 -4.62 0.00 0.00 176.95 171.12 3hk7 s ASN 197 N 5.47 3.43 0.47 5.86 2.20 -1.26 -4.98 114.94 126.13 3hk7 s ASN 197 Ca 0.50 -1.62 0.27 0.00 -0.94 0.00 0.00 52.86 51.06 3hk7 s ASN 197 Cb -0.02 0.41 1.32 0.00 -2.00 0.00 0.00 41.25 40.96 3hk7 s ASN 197 CO -0.07 -0.84 1.81 -0.08 -2.94 0.00 0.00 177.10 174.99 3hk7 h GLU 198 N 1.62 0.19 -0.13 3.55 4.57 -1.99 0.67 114.58 123.05 3hk7 h GLU 198 Ca -0.40 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.75 3hk7 h GLU 198 Cb 1.29 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 3hk7 h GLU 198 CO 0.67 0.12 0.02 0.78 -1.18 0.00 0.00 179.01 179.43 3hk7 h GLY 199 N 0.19 0.24 0.93 1.92 0.00 -1.95 -1.55 103.07 102.85 3hk7 h GLY 199 Ca 0.54 -0.16 -0.05 0.00 0.00 0.00 0.00 47.33 47.66 3hk7 h GLY 199 CO -0.14 0.15 0.06 1.76 0.00 0.00 0.00 176.54 178.37 3hk7 h SER 200 N -0.01 0.61 -0.40 0.19 0.02 -1.20 -1.86 113.55 110.92 3hk7 h SER 200 Ca 0.04 -0.27 0.05 0.00 -0.84 0.00 0.00 61.79 60.78 3hk7 h SER 200 Cb 0.30 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.63 3hk7 h SER 200 CO 0.00 0.72 0.11 0.40 -1.14 0.00 0.00 176.83 176.93 3hk7 h ILE 201 N 0.48 0.85 -0.48 3.27 2.04 -1.09 -0.20 117.51 122.37 3hk7 h ILE 201 Ca 0.12 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 3hk7 h ILE 201 Cb 0.38 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3hk7 h ILE 201 CO 0.01 0.05 -0.11 1.56 0.00 0.00 0.00 178.15 179.65 3hk7 h GLN 202 N 0.26 0.89 -0.29 2.37 1.08 -1.19 -0.61 115.11 117.62 3hk7 h GLN 202 Ca 0.19 -0.31 -0.15 0.00 -1.45 0.00 0.00 58.65 56.92 3hk7 h GLN 202 Cb 0.19 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.55 3hk7 h GLN 202 CO -0.21 0.96 -0.43 0.93 -0.95 0.00 0.00 178.83 179.13 3hk7 h GLU 203 N 0.80 0.73 -0.49 1.46 4.39 -0.90 0.12 114.58 120.70 3hk7 h GLU 203 Ca 0.13 -0.39 -0.13 0.00 0.34 0.00 0.00 59.36 59.31 3hk7 h GLU 203 Cb 0.63 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 3hk7 h GLU 203 CO 0.04 1.02 -0.20 0.28 -1.16 0.00 0.00 179.01 178.99 3hk7 h VAL 204 N 0.59 1.27 -0.83 3.13 2.07 -0.95 -1.71 116.25 119.82 3hk7 h VAL 204 Ca 0.04 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.20 3hk7 h VAL 204 Cb 0.98 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 3hk7 h VAL 204 CO 0.09 0.47 0.48 0.11 0.02 0.00 0.00 177.57 178.75 3hk7 h LYS 205 N 0.86 1.14 -0.29 1.57 1.57 -0.85 -2.27 116.57 118.30 3hk7 h LYS 205 Ca 0.12 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3hk7 h LYS 205 Cb 0.77 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 3hk7 h LYS 205 CO 0.06 0.81 0.00 -0.09 -0.57 0.00 0.00 179.45 179.66 3hk7 h ARG 206 N 1.15 0.51 -0.62 3.15 2.43 -0.66 -1.11 114.38 119.24 3hk7 h ARG 206 Ca 0.30 -0.16 0.11 0.00 -0.81 0.00 0.00 59.98 59.42 3hk7 h ARG 206 Cb -0.02 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.40 3hk7 h ARG 206 CO -0.05 0.66 0.16 0.35 -1.51 0.00 0.00 179.97 179.58 3hk7 h PHE 207 N 0.30 0.27 -0.18 2.20 3.57 -0.95 0.63 116.94 122.79 3hk7 h PHE 207 Ca 0.08 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 3hk7 h PHE 207 Cb 0.43 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 3hk7 h PHE 207 CO 0.04 0.00 0.04 -0.07 -2.23 0.00 0.00 178.31 176.08 3hk7 h LEU 208 N 0.30 0.27 -1.10 0.59 3.38 -1.20 -2.23 115.31 115.33 3hk7 h LEU 208 Ca 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3hk7 h LEU 208 Cb 0.47 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3hk7 h LEU 208 CO -0.39 0.45 0.32 0.74 0.09 0.00 0.00 178.44 179.65 3hk7 h THR 209 N 0.09 1.22 -0.40 0.22 2.02 -0.44 0.16 112.91 115.77 3hk7 h THR 209 Ca 0.05 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 3hk7 h THR 209 Cb 0.29 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 3hk7 h THR 209 CO 0.00 0.26 0.23 0.44 0.37 0.00 0.00 175.52 176.82 3hk7 h ASP 210 N 0.95 0.50 0.69 4.18 3.32 0.46 -1.14 116.42 125.38 3hk7 h ASP 210 Ca 0.23 -0.08 -0.18 0.00 0.02 0.00 0.00 57.03 57.02 3hk7 h ASP 210 Cb 0.11 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3hk7 h ASP 210 CO -0.03 0.43 -0.84 -0.50 -1.72 0.00 0.00 179.24 176.58 3hk7 h TRP 211 N 0.52 0.14 -0.76 4.55 4.06 -1.01 -1.39 115.95 122.07 3hk7 h TRP 211 Ca 0.14 -0.08 -0.03 0.00 2.06 0.00 0.00 58.89 60.99 3hk7 h TRP 211 Cb 0.04 -0.02 -0.04 0.00 -1.00 0.00 0.00 29.16 28.14 3hk7 h TRP 211 CO -0.03 0.89 0.37 0.82 -3.56 0.00 0.00 178.44 176.93 3hk7 h ILE 212 N 0.05 1.24 -0.07 1.49 2.04 -0.52 0.17 117.51 121.91 3hk7 h ILE 212 Ca -0.03 -0.66 -0.17 0.00 1.00 0.00 0.00 64.86 65.00 3hk7 h ILE 212 Cb 1.46 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 3hk7 h ILE 212 CO 0.12 0.28 -0.70 -0.08 0.00 0.00 0.00 178.15 177.77 3hk7 h GLU 213 N 1.08 0.33 0.00 2.37 4.81 -1.05 0.29 114.58 122.41 3hk7 h GLU 213 Ca 0.26 -0.26 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 3hk7 h GLU 213 Cb 0.10 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 3hk7 h GLU 213 CO -0.03 0.90 -0.85 -0.09 -0.73 0.00 0.00 179.01 178.21 3hk7 h ARG 214 N 0.22 0.00 0.00 1.92 2.43 -0.73 -3.37 114.38 114.85 3hk7 h ARG 214 Ca -0.02 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.90 3hk7 h ARG 214 Cb 1.26 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.76 3hk7 h ARG 214 CO 0.11 0.58 -1.99 -1.33 -1.51 0.00 0.00 179.97 175.83 3hk7 n MET 215 N -3.18 1.47 -3.54 0.20 2.81 0.53 -5.02 117.12 110.38 3hk7 n MET 215 Ca -0.02 -0.02 -0.22 0.00 -1.81 0.00 0.00 57.70 55.63 3hk7 n MET 215 Cb 0.82 -1.38 0.05 0.00 -0.71 0.00 0.00 33.22 32.00 3hk7 n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3hk7 n ASP 216 N -2.50 -4.10 -4.77 7.83 2.03 0.10 -4.61 116.55 110.54 3hk7 n ASP 216 Ca -0.22 -0.83 -0.37 0.00 0.52 0.00 0.00 54.79 53.89 3hk7 n ASP 216 Cb 0.93 -4.27 -0.00 0.00 -0.72 0.00 0.00 41.12 37.05 3hk7 n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hk7 s PRO 217 N -5.46 3.62 0.30 -0.67 0.04 -1.26 -4.62 135.00 126.94 3hk7 s PRO 217 Ca 0.28 1.78 0.25 0.00 0.04 0.00 0.00 61.00 63.35 3hk7 s PRO 217 Cb -0.07 -2.31 0.74 0.00 0.04 0.00 0.00 34.50 32.91 3hk7 s PRO 217 CO 0.80 -0.67 1.74 -0.39 0.04 0.00 0.00 177.00 178.52 3hk7 h VAL 218 N 1.69 0.00 -1.69 -0.36 -1.51 -1.49 -3.47 116.25 109.42 3hk7 h VAL 218 Ca -0.50 -0.59 0.21 0.00 -1.23 0.00 0.00 66.70 64.60 3hk7 h VAL 218 Cb 1.25 1.55 -0.18 0.00 -2.13 0.00 0.00 31.29 31.79 3hk7 h VAL 218 CO 0.59 0.00 0.72 -0.72 -1.23 0.00 0.00 177.57 176.94 3hk7 s TYR 219 N -3.19 -0.19 -0.12 5.19 -0.85 -1.26 -4.25 117.35 112.67 3hk7 s TYR 219 Ca 0.08 0.13 -0.07 0.00 -0.52 0.00 0.00 57.07 56.69 3hk7 s TYR 219 Cb 0.10 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.92 3hk7 s TYR 219 CO 0.59 -0.29 0.12 -1.64 -1.52 0.00 0.00 175.55 172.81 3hk7 s MET 220 N -2.55 3.46 0.16 -3.49 -1.94 -0.66 -1.90 119.30 112.36 3hk7 s MET 220 Ca 0.08 -0.17 0.01 0.00 -1.71 0.00 0.00 55.69 53.90 3hk7 s MET 220 Cb -0.01 -3.16 -0.04 0.00 2.01 0.00 0.00 34.83 33.62 3hk7 s MET 220 CO -0.06 0.72 0.01 0.00 -0.01 0.00 0.00 175.02 175.68 3hk7 s ALA 221 N -0.87 1.19 -0.18 3.03 0.00 0.13 0.12 121.76 125.19 3hk7 s ALA 221 Ca 0.14 -1.54 -0.28 0.00 0.00 0.00 0.00 51.96 50.28 3hk7 s ALA 221 Cb -0.12 0.59 0.10 0.00 0.00 0.00 0.00 23.12 23.69 3hk7 s ALA 221 CO 0.03 -0.36 0.85 0.54 0.00 0.00 0.00 175.76 176.82 3hk7 s VAL 222 N -3.76 0.00 -0.12 0.00 0.11 -0.76 -0.15 120.40 115.73 3hk7 s VAL 222 Ca 0.23 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.22 3hk7 s VAL 222 Cb 0.06 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 3hk7 s VAL 222 CO 0.03 0.00 0.11 -0.94 -3.33 0.00 0.00 175.10 170.97 3hk7 s SER 223 N -0.53 6.17 0.18 3.54 1.04 -1.26 -1.22 113.70 121.63 3hk7 s SER 223 Ca -0.03 0.40 0.08 0.00 0.48 0.00 0.00 55.95 56.88 3hk7 s SER 223 Cb -0.02 -1.96 -0.04 0.00 0.10 0.00 0.00 66.02 64.09 3hk7 s SER 223 CO 0.02 0.40 -0.17 -0.76 0.98 0.00 0.00 173.24 173.71 3hk7 s LEU 224 N -0.96 2.47 0.76 2.42 1.43 0.29 -4.91 118.68 120.18 3hk7 s LEU 224 Ca 0.14 -0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 52.22 3hk7 s LEU 224 Cb -0.12 -0.78 0.05 0.00 0.03 0.00 0.00 46.19 45.37 3hk7 s LEU 224 CO 0.04 -0.08 1.13 -2.16 0.23 0.00 0.00 176.35 175.51 3hk7 s PRO 225 N -3.04 2.43 0.58 1.29 0.04 -1.25 -0.42 135.00 134.64 3hk7 s PRO 225 Ca 0.18 0.34 0.29 0.00 0.04 0.00 0.00 61.00 61.84 3hk7 s PRO 225 Cb -0.04 -1.98 1.78 0.00 0.04 0.00 0.00 34.50 34.29 3hk7 s PRO 225 CO 0.07 -1.31 2.25 -1.35 0.04 0.00 0.00 177.00 176.69 3hk7 h PRO 226 N -0.85 0.00 -0.21 0.56 0.11 -1.77 -1.46 132.00 128.38 3hk7 h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hk7 h PRO 226 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hk7 h PRO 226 CO 0.64 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.68 3hk7 n THR 227 N -3.91 0.28 -1.66 -1.15 -2.24 -1.26 -4.02 114.28 100.33 3hk7 n THR 227 Ca -0.03 -0.29 -0.47 0.00 -2.27 0.00 0.00 64.05 60.99 3hk7 n THR 227 Cb 0.08 0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.42 3hk7 n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hk7 n PHE 228 N 0.13 2.18 -4.06 4.78 7.35 -0.55 -4.99 117.46 122.31 3hk7 n PHE 228 Ca 0.09 0.31 -0.09 0.00 -0.76 0.00 0.00 57.45 56.99 3hk7 n PHE 228 Cb 0.20 -2.52 -0.11 0.00 0.35 0.00 0.00 39.48 37.40 3hk7 n PHE 228 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3hk7 s SER 229 N 1.00 0.57 -0.29 -2.13 0.01 -1.26 -4.67 113.70 106.93 3hk7 s SER 229 Ca 0.80 -0.75 -0.19 0.00 1.31 0.00 0.00 55.95 57.12 3hk7 s SER 229 Cb -0.72 0.12 0.14 0.00 0.21 0.00 0.00 66.02 65.78 3hk7 s SER 229 CO 0.40 -0.41 1.00 0.12 0.41 0.00 0.00 173.24 174.76 3hk7 s PHE 230 N -2.58 -0.53 1.03 2.43 2.19 -1.26 -4.53 117.98 114.72 3hk7 s PHE 230 Ca -0.03 1.12 -0.11 0.00 0.33 0.00 0.00 56.93 58.24 3hk7 s PHE 230 Cb -0.02 0.35 0.21 0.00 -1.31 0.00 0.00 43.02 42.26 3hk7 s PHE 230 CO -0.04 -0.26 1.09 -2.14 1.83 0.00 0.00 175.22 175.70 3hk7 s PRO 231 N 1.01 0.13 -0.28 10.12 0.02 -1.26 -4.17 135.00 140.57 3hk7 s PRO 231 Ca -0.05 1.25 -0.17 0.00 0.02 0.00 0.00 61.00 62.05 3hk7 s PRO 231 Cb -0.04 -1.65 0.11 0.00 0.02 0.00 0.00 34.50 32.95 3hk7 s PRO 231 CO -0.13 -3.14 0.85 -2.00 -0.33 0.00 0.00 177.00 172.25 3hk7 s GLU 232 N -4.56 0.54 -1.16 5.54 2.12 -1.26 -5.07 118.70 114.85 3hk7 s GLU 232 Ca 0.68 0.90 -0.20 0.00 0.36 0.00 0.00 54.97 56.70 3hk7 s GLU 232 Cb -0.24 0.13 0.07 0.00 0.26 0.00 0.00 34.13 34.35 3hk7 s GLU 232 CO 0.61 -0.11 1.59 -1.21 -0.54 0.00 0.00 175.26 175.60 3hk7 s GLU 233 N 1.34 3.80 0.22 4.30 0.41 -1.26 -4.02 118.70 123.49 3hk7 s GLU 233 Ca -0.08 -1.62 -0.17 0.00 -0.41 0.00 0.00 54.97 52.69 3hk7 s GLU 233 Cb -0.04 -5.43 0.02 0.00 -1.78 0.00 0.00 34.13 26.90 3hk7 s GLU 233 CO -0.16 -2.21 0.55 -1.54 -0.49 0.00 0.00 175.26 171.41 3hk7 s SER 234 N 4.50 -0.23 0.19 -0.19 1.04 -1.26 -5.00 113.70 112.74 3hk7 s SER 234 Ca 0.50 -0.57 -0.13 0.00 0.48 0.00 0.00 55.95 56.22 3hk7 s SER 234 Cb 0.02 0.61 0.12 0.00 0.10 0.00 0.00 66.02 66.86 3hk7 s SER 234 CO -0.01 -1.12 1.83 0.78 0.98 0.00 0.00 173.24 175.71 3hk7 h ASN 235 N 2.17 0.59 -0.28 7.02 2.35 -1.92 0.19 115.58 125.70 3hk7 h ASN 235 Ca -0.27 -0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.50 3hk7 h ASN 235 Cb 1.26 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 39.48 3hk7 h ASN 235 CO 0.35 0.42 0.15 -0.09 -1.65 0.00 0.00 177.43 176.60 3hk7 h ARG 236 N 0.71 0.31 -0.55 0.81 2.43 -1.90 0.21 114.38 116.40 3hk7 h ARG 236 Ca 0.23 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.32 3hk7 h ARG 236 Cb -0.00 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3hk7 h ARG 236 CO -0.09 0.20 0.11 0.78 -1.51 0.00 0.00 179.97 179.47 3hk7 h GLY 237 N 0.32 0.92 1.29 2.80 0.00 -1.60 -1.03 103.07 105.75 3hk7 h GLY 237 Ca 0.11 -0.55 -0.28 0.00 0.00 0.00 0.00 47.33 46.61 3hk7 h GLY 237 CO -0.06 0.51 -1.15 3.21 0.00 0.00 0.00 176.54 179.05 3hk7 h ARG 238 N 0.82 0.61 -0.72 4.80 3.08 -0.67 -2.21 114.38 120.10 3hk7 h ARG 238 Ca 0.18 -0.75 -0.07 0.00 0.07 0.00 0.00 59.98 59.41 3hk7 h ARG 238 Cb 0.33 0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 3hk7 h ARG 238 CO 0.00 1.33 0.18 0.82 -1.07 0.00 0.00 179.97 181.23 3hk7 h ILE 239 N 0.30 1.26 0.12 2.04 2.04 -0.49 0.13 117.51 122.91 3hk7 h ILE 239 Ca -0.16 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 3hk7 h ILE 239 Cb 1.81 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3hk7 h ILE 239 CO 0.22 0.38 -0.06 0.40 0.00 0.00 0.00 178.15 179.09 3hk7 h ILE 240 N 1.09 1.05 -0.09 -0.67 2.04 -1.24 0.53 117.51 120.22 3hk7 h ILE 240 Ca 0.23 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 3hk7 h ILE 240 Cb 0.37 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 3hk7 h ILE 240 CO 0.00 0.17 0.03 -0.09 0.00 0.00 0.00 178.15 178.26 3hk7 h ARG 241 N -0.49 0.13 0.00 2.37 2.43 -1.29 -1.25 114.38 116.27 3hk7 h ARG 241 Ca -0.02 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 3hk7 h ARG 241 Cb 0.40 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3hk7 h ARG 241 CO 0.03 0.27 -1.10 -0.25 -1.51 0.00 0.00 179.97 177.41 3hk7 n ASP 242 N -4.92 0.86 0.02 -3.80 8.00 0.44 -4.52 116.55 112.63 3hk7 n ASP 242 Ca -0.06 0.34 -0.01 0.00 0.71 0.00 0.00 54.79 55.77 3hk7 n ASP 242 Cb 0.12 0.37 -0.00 0.00 -0.02 0.00 0.00 41.12 41.59 3hk7 n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hk7 h LEU 244 N -0.10 -0.95 -0.30 0.00 7.12 -0.94 -2.04 115.31 118.09 3hk7 h LEU 244 Ca 0.00 0.09 0.07 0.00 0.13 0.00 0.00 57.88 58.16 3hk7 h LEU 244 Cb 0.10 0.33 -0.06 0.00 -0.53 0.00 0.00 40.66 40.50 3hk7 h LEU 244 CO 0.00 -0.39 -0.12 -0.07 -0.13 0.00 0.00 178.44 177.72 3hk7 h LEU 245 N -0.57 -0.42 -0.54 2.25 3.38 -1.48 0.77 115.31 118.70 3hk7 h LEU 245 Ca -0.02 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.10 3hk7 h LEU 245 Cb 0.52 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 3hk7 h LEU 245 CO -0.11 -0.16 0.28 -0.65 0.09 0.00 0.00 178.44 177.90 3hk7 h PRO 246 N -0.07 0.53 -0.24 1.13 0.11 -1.78 0.53 132.00 132.21 3hk7 h PRO 246 Ca 0.15 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 3hk7 h PRO 246 Cb 0.30 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 3hk7 h PRO 246 CO -0.35 0.35 0.09 0.28 -0.21 0.00 0.00 178.00 178.15 3hk7 h VAL 247 N 0.54 1.18 -0.77 3.15 2.07 -0.91 -1.48 116.25 120.04 3hk7 h VAL 247 Ca 0.24 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 67.25 3hk7 h VAL 247 Cb 0.14 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 3hk7 h VAL 247 CO -0.16 0.19 0.46 0.00 0.02 0.00 0.00 177.57 178.08 3hk7 h ALA 248 N 0.92 1.04 -0.53 1.67 0.00 -0.42 -1.07 119.26 120.87 3hk7 h ALA 248 Ca 0.08 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hk7 h ALA 248 Cb 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3hk7 h ALA 248 CO -0.00 0.19 0.06 1.49 0.00 0.00 0.00 179.25 180.99 3hk7 h GLU 249 N 0.86 0.89 0.15 0.00 4.81 -0.73 0.28 114.58 120.83 3hk7 h GLU 249 Ca 0.33 -0.25 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3hk7 h GLU 249 Cb 0.15 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3hk7 h GLU 249 CO -0.16 0.88 -0.18 -0.22 -0.73 0.00 0.00 179.01 178.60 3hk7 h LYS 250 N 0.77 -0.35 -0.01 1.92 3.64 -0.50 -2.28 116.57 119.76 3hk7 h LYS 250 Ca 0.16 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3hk7 h LYS 250 Cb 0.44 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 3hk7 h LYS 250 CO 0.01 -0.24 -0.00 0.72 -2.27 0.00 0.00 179.45 177.68 3hk7 n HIS 251 N -5.30 0.00 -3.67 1.91 8.25 -0.48 -4.91 115.22 111.02 3hk7 n HIS 251 Ca -0.07 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.12 3hk7 n HIS 251 Cb 0.22 -0.01 0.04 0.00 1.12 0.00 0.00 29.99 31.36 3hk7 n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hk7 n ASN 252 N -0.48 -5.40 -4.62 0.41 4.05 0.71 -4.97 115.26 104.96 3hk7 n ASN 252 Ca 0.21 -0.62 -0.35 0.00 0.45 0.00 0.00 54.58 54.28 3hk7 n ASN 252 Cb 0.22 -4.30 -0.10 0.00 1.23 0.00 0.00 39.78 36.83 3hk7 n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hk7 s ILE 253 N -3.26 4.89 0.74 -1.44 -1.09 0.32 -4.87 121.20 116.49 3hk7 s ILE 253 Ca 0.58 0.01 -0.14 0.00 -2.23 0.00 0.00 60.65 58.87 3hk7 s ILE 253 Cb -0.28 -3.23 0.04 0.00 -1.58 0.00 0.00 42.46 37.41 3hk7 s ILE 253 CO 0.72 0.42 1.18 -2.84 -1.23 0.00 0.00 174.94 173.19 3hk7 s PRO 254 N 0.66 2.17 -0.31 2.79 0.02 -1.26 -4.60 135.00 134.46 3hk7 s PRO 254 Ca 0.05 1.65 -0.06 0.00 0.02 0.00 0.00 61.00 62.65 3hk7 s PRO 254 Cb -0.13 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.57 3hk7 s PRO 254 CO 0.01 -1.79 0.07 0.12 -0.33 0.00 0.00 177.00 175.09 3hk7 s PHE 255 N -2.15 3.19 -0.24 6.54 5.36 0.10 -1.66 117.98 129.13 3hk7 s PHE 255 Ca 0.72 -1.28 -0.21 0.00 -0.96 0.00 0.00 56.93 55.20 3hk7 s PHE 255 Cb -0.26 -2.24 -0.02 0.00 -0.34 0.00 0.00 43.02 40.16 3hk7 s PHE 255 CO 0.46 -0.67 0.63 0.00 -1.46 0.00 0.00 175.22 174.18 3hk7 s ALA 256 N 1.43 3.59 -0.20 11.12 0.00 0.33 -1.31 121.76 136.73 3hk7 s ALA 256 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.57 3hk7 s ALA 256 Cb -0.18 -3.02 0.01 0.00 0.00 0.00 0.00 23.12 19.93 3hk7 s ALA 256 CO 0.02 -0.74 -0.13 -1.64 0.00 0.00 0.00 175.76 173.27 3hk7 s MET 257 N 2.34 3.13 -0.43 0.00 1.00 0.66 -1.82 119.30 124.19 3hk7 s MET 257 Ca 0.27 -0.76 -0.05 0.00 0.00 0.00 0.00 55.69 55.15 3hk7 s MET 257 Cb -0.16 -2.77 0.11 0.00 0.00 0.00 0.00 34.83 32.02 3hk7 s MET 257 CO 0.09 -0.22 0.24 -1.64 0.00 0.00 0.00 175.02 173.50 3hk7 s MET 258 N 1.37 2.20 -0.10 2.03 -1.94 -0.36 -2.59 119.30 119.90 3hk7 s MET 258 Ca 0.05 -1.77 -0.04 0.00 -1.71 0.00 0.00 55.69 52.22 3hk7 s MET 258 Cb -0.14 -3.69 -0.04 0.00 2.01 0.00 0.00 34.83 32.98 3hk7 s MET 258 CO -0.09 -1.09 0.07 0.42 -0.01 0.00 0.00 175.02 174.32 3hk7 s ILE 259 N 1.23 4.91 0.00 2.53 1.01 -0.91 0.11 121.20 130.08 3hk7 s ILE 259 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.70 3hk7 s ILE 259 Cb -0.24 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.12 3hk7 s ILE 259 CO -0.03 0.61 0.00 0.61 0.00 0.00 0.00 174.94 176.13 3hk7 n GLY 260 N 2.09 1.05 3.71 6.18 0.00 0.44 -0.86 105.19 117.82 3hk7 n GLY 260 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 3hk7 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk7 s VAL 261 N -1.84 5.07 -0.44 1.61 0.11 -0.77 -1.85 120.40 122.29 3hk7 s VAL 261 Ca 0.00 1.33 -0.11 0.00 -2.93 0.00 0.00 61.98 60.27 3hk7 s VAL 261 Cb 0.00 -3.99 0.09 0.00 -1.53 0.00 0.00 36.38 30.95 3hk7 s VAL 261 CO 0.00 0.25 0.31 -0.75 -3.33 0.00 0.00 175.10 171.59 3hk7 s LYS 262 N 0.86 2.68 0.33 1.54 2.20 0.58 -3.76 119.74 124.17 3hk7 s LYS 262 Ca 0.35 -1.49 -0.28 0.00 -0.36 0.00 0.00 55.97 54.18 3hk7 s LYS 262 Cb -0.17 -3.90 -0.10 0.00 -1.51 0.00 0.00 37.83 32.15 3hk7 s LYS 262 CO 0.16 -1.02 1.22 0.15 -0.36 0.00 0.00 175.35 175.50 3hk7 s LYS 263 N 1.47 4.37 -1.36 4.03 -0.14 -1.26 -0.34 119.74 126.50 3hk7 s LYS 263 Ca 0.04 2.03 -0.04 0.00 -1.36 0.00 0.00 55.97 56.64 3hk7 s LYS 263 Cb -0.24 -3.02 0.02 0.00 -1.68 0.00 0.00 37.83 32.91 3hk7 s LYS 263 CO 0.03 -0.11 0.84 0.54 -0.76 0.00 0.00 175.35 175.88 3hk7 n ARG 264 N 0.76 -5.44 0.25 1.68 1.74 -1.24 -4.90 116.66 109.51 3hk7 n ARG 264 Ca 0.01 0.65 0.15 0.00 -0.77 0.00 0.00 57.85 57.88 3hk7 n ARG 264 Cb 0.43 -5.37 0.48 0.00 -1.02 0.00 0.00 32.46 26.98 3hk7 n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3hk7 h VAL 265 N -1.99 0.04 -2.25 1.55 -1.51 -1.13 -3.31 116.25 107.64 3hk7 h VAL 265 Ca -0.60 -0.74 -0.58 0.00 -1.23 0.00 0.00 66.70 63.55 3hk7 h VAL 265 Cb 1.36 1.72 -0.38 0.00 -2.13 0.00 0.00 31.29 31.86 3hk7 h VAL 265 CO 0.59 0.02 -1.02 1.57 -1.23 0.00 0.00 177.57 177.50 3hk7 n HIS 266 N -3.11 -0.79 -0.29 5.19 -0.00 -0.98 -5.01 115.22 110.24 3hk7 n HIS 266 Ca 0.02 -3.37 0.22 0.00 -0.00 0.00 0.00 57.72 54.58 3hk7 n HIS 266 Cb 0.40 0.09 0.52 0.00 -0.00 0.00 0.00 29.99 31.01 3hk7 n HIS 266 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3hk7 h PRO 267 N 5.15 0.37 -0.64 1.57 0.13 -1.82 -1.74 132.00 135.01 3hk7 h PRO 267 Ca 0.21 -0.02 0.11 0.00 -0.87 0.00 0.00 66.00 65.43 3hk7 h PRO 267 Cb 0.90 -0.08 -0.04 0.00 0.13 0.00 0.00 31.00 31.91 3hk7 h PRO 267 CO 0.40 0.24 0.43 0.00 -0.23 0.00 0.00 178.00 178.84 3hk7 h ALA 268 N 1.60 2.06 0.00 -0.56 0.00 -1.95 -0.55 119.26 119.86 3hk7 h ALA 268 Ca 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3hk7 h ALA 268 Cb 1.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3hk7 h ALA 268 CO -0.22 -0.22 0.00 1.28 0.00 0.00 0.00 179.25 180.09 3hk7 n LEU 269 N -4.47 0.00 0.00 0.00 4.77 -0.65 -4.99 117.00 111.66 3hk7 n LEU 269 Ca 0.11 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 3hk7 n LEU 269 Cb 0.43 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hk7 n LEU 269 CO 0.34 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 3hk7 n GLY 270 N 0.72 3.06 0.09 -0.72 0.00 -0.22 -2.05 105.19 106.07 3hk7 n GLY 270 Ca 0.09 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.99 3hk7 n GLY 270 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hk7 n ASP 271 N 5.74 0.35 -1.03 1.61 8.00 -1.26 -0.76 116.55 129.19 3hk7 n ASP 271 Ca 0.00 0.63 0.10 0.00 0.71 0.00 0.00 54.79 56.23 3hk7 n ASP 271 Cb 0.00 -0.69 0.26 0.00 -0.02 0.00 0.00 41.12 40.67 3hk7 n ASP 271 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hk7 n ALA 272 N -1.66 2.42 -0.48 2.24 0.00 -0.87 -4.39 120.51 117.77 3hk7 n ALA 272 Ca 0.00 -0.96 0.11 0.00 0.00 0.00 0.00 53.44 52.59 3hk7 n ALA 272 Cb 0.08 -0.95 0.34 0.00 0.00 0.00 0.00 19.45 18.92 3hk7 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk7 n GLY 273 N 1.41 2.61 3.86 0.00 0.00 0.06 -4.89 105.19 108.24 3hk7 n GLY 273 Ca 0.19 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 3hk7 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk7 s ASP 274 N -0.96 6.73 0.31 1.61 1.01 -1.26 -0.76 116.67 123.35 3hk7 s ASP 274 Ca 0.51 1.03 0.00 0.00 0.71 0.00 0.00 52.55 54.80 3hk7 s ASP 274 Cb 0.29 -2.27 0.00 0.00 1.01 0.00 0.00 42.92 41.95 3hk7 s ASP 274 CO 0.30 -0.01 0.04 0.33 0.21 0.00 0.00 175.17 176.03 3hk7 n PHE 275 N 0.24 0.47 -4.25 4.23 7.35 0.54 -4.91 117.46 121.12 3hk7 n PHE 275 Ca -0.02 -1.49 -0.14 0.00 -0.76 0.00 0.00 57.45 55.04 3hk7 n PHE 275 Cb 0.52 -0.21 -0.10 0.00 0.35 0.00 0.00 39.48 40.04 3hk7 n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hk7 s VAL 276 N -2.03 1.19 0.02 -2.13 0.11 -1.26 -0.31 120.40 115.99 3hk7 s VAL 276 Ca 0.03 -2.03 -0.25 0.00 -2.93 0.00 0.00 61.98 56.80 3hk7 s VAL 276 Cb -0.00 -1.81 0.06 0.00 -1.53 0.00 0.00 36.38 33.09 3hk7 s VAL 276 CO 0.02 -0.72 0.56 -0.83 -3.33 0.00 0.00 175.10 170.80 3hk7 s GLY 277 N -3.10 -0.47 0.15 6.54 0.00 -0.77 -4.84 107.32 104.82 3hk7 s GLY 277 Ca 0.16 0.79 -0.30 0.00 0.00 0.00 0.00 44.72 45.37 3hk7 s GLY 277 CO 0.01 0.47 0.96 1.25 0.00 0.00 0.00 173.10 175.79 3hk7 s LYS 278 N -2.10 4.75 0.27 2.90 2.20 -1.26 -4.38 119.74 122.11 3hk7 s LYS 278 Ca -0.07 1.47 0.07 0.00 -0.36 0.00 0.00 55.97 57.07 3hk7 s LYS 278 Cb -0.01 -3.35 -0.03 0.00 -1.51 0.00 0.00 37.83 32.93 3hk7 s LYS 278 CO 0.01 0.30 0.26 0.00 -0.36 0.00 0.00 175.35 175.57 3hk7 s ALA 279 N -0.35 3.74 0.38 3.13 0.00 -1.26 -4.78 121.76 122.61 3hk7 s ALA 279 Ca 0.45 -1.42 -0.23 0.00 0.00 0.00 0.00 51.96 50.77 3hk7 s ALA 279 Cb -0.24 -1.40 -0.10 0.00 0.00 0.00 0.00 23.12 21.38 3hk7 s ALA 279 CO 0.31 0.19 0.93 0.45 0.00 0.00 0.00 175.76 177.64 3hk7 s SER 280 N -3.92 7.09 0.00 0.00 0.15 -1.26 -4.96 113.70 110.80 3hk7 s SER 280 Ca 0.35 1.71 0.26 0.00 0.70 0.00 0.00 55.95 58.98 3hk7 s SER 280 Cb -0.08 -2.54 0.73 0.00 -1.71 0.00 0.00 66.02 62.43 3hk7 s SER 280 CO 0.26 -0.23 1.55 0.23 1.20 0.00 0.00 173.24 176.26 3hk7 n MET 281 N -0.12 0.96 -0.10 5.44 2.81 -1.26 -4.40 117.12 120.45 3hk7 n MET 281 Ca 0.05 -0.59 -0.05 0.00 -1.81 0.00 0.00 57.70 55.30 3hk7 n MET 281 Cb 0.52 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.56 3hk7 n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3hk7 h ASP 282 N 1.43 -0.16 -0.97 7.83 3.32 -1.93 0.14 116.42 126.08 3hk7 h ASP 282 Ca 0.00 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.14 3hk7 h ASP 282 Cb 0.53 0.15 -0.05 0.00 0.22 0.00 0.00 39.33 40.18 3hk7 h ASP 282 CO 0.00 -0.04 0.64 1.23 -1.72 0.00 0.00 179.24 179.34 3hk7 h GLY 283 N 0.09 1.38 1.07 2.75 0.00 -1.77 0.12 103.07 106.71 3hk7 h GLY 283 Ca 0.17 -0.52 -0.17 0.00 0.00 0.00 0.00 47.33 46.81 3hk7 h GLY 283 CO -0.29 0.51 -0.53 -2.08 0.00 0.00 0.00 176.54 174.15 3hk7 h VAL 284 N 1.32 1.29 -0.06 4.60 2.07 -1.69 -2.06 116.25 121.72 3hk7 h VAL 284 Ca 0.36 -1.73 0.02 0.00 0.82 0.00 0.00 66.70 66.16 3hk7 h VAL 284 Cb -0.14 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3hk7 h VAL 284 CO -0.08 0.55 -0.05 -0.08 0.02 0.00 0.00 177.57 177.94 3hk7 h GLU 285 N 0.51 -0.06 -0.04 1.57 4.81 -0.30 -1.66 114.58 119.41 3hk7 h GLU 285 Ca -0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 3hk7 h GLU 285 Cb 1.14 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3hk7 h GLU 285 CO 0.12 -0.04 -0.13 1.25 -0.73 0.00 0.00 179.01 179.48 3hk7 h HIS 286 N -0.06 -0.32 -0.60 0.92 2.76 -0.73 -1.47 115.15 115.64 3hk7 h HIS 286 Ca 0.04 0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3hk7 h HIS 286 Cb 0.13 0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 3hk7 h HIS 286 CO -0.15 -0.19 0.29 -0.07 -1.30 0.00 0.00 177.93 176.51 3hk7 h LEU 287 N -0.19 0.39 0.00 0.26 3.38 -1.15 0.77 115.31 118.77 3hk7 h LEU 287 Ca 0.06 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3hk7 h LEU 287 Cb 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3hk7 h LEU 287 CO -0.15 0.25 -0.00 -0.07 0.09 0.00 0.00 178.44 178.56 3hk7 h LEU 288 N 0.54 -0.01 -0.09 1.67 3.38 -1.01 -1.86 115.31 117.93 3hk7 h LEU 288 Ca 0.28 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 3hk7 h LEU 288 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hk7 h LEU 288 CO -0.21 0.11 -0.04 -0.09 0.09 0.00 0.00 178.44 178.30 3hk7 h ARG 289 N -0.12 0.19 0.00 1.13 2.43 -1.03 -3.30 114.38 113.68 3hk7 h ARG 289 Ca -0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3hk7 h ARG 289 Cb 0.12 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3hk7 h ARG 289 CO 0.00 0.54 0.00 0.39 -1.51 0.00 0.00 179.97 179.39 3hk7 n GLU 290 N -4.75 0.15 -3.20 0.20 -0.58 0.24 -4.01 120.64 108.69 3hk7 n GLU 290 Ca -0.07 0.22 -0.24 0.00 -0.42 0.00 0.00 57.16 56.65 3hk7 n GLU 290 Cb 0.26 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.37 3hk7 n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hk7 n TYR 291 N -1.97 1.61 0.31 -0.32 4.01 -0.70 -4.93 117.16 115.15 3hk7 n TYR 291 Ca 0.05 -3.85 0.19 0.00 -0.16 0.00 0.00 57.90 54.12 3hk7 n TYR 291 Cb 0.33 -0.45 1.03 0.00 -0.31 0.00 0.00 39.34 39.94 3hk7 n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hk7 h PRO 292 N 3.62 0.00 -0.01 -0.72 0.13 -1.70 -1.37 132.00 131.95 3hk7 h PRO 292 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3hk7 h PRO 292 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3hk7 h PRO 292 CO 0.63 0.00 -0.20 0.09 -0.23 0.00 0.00 178.00 178.29 3hk7 n ASN 293 N -3.34 1.08 -4.87 1.44 5.03 -1.26 -4.87 115.26 108.46 3hk7 n ASN 293 Ca -0.02 -0.98 -0.31 0.00 0.87 0.00 0.00 54.58 54.13 3hk7 n ASN 293 Cb 0.17 0.10 -0.05 0.00 -1.02 0.00 0.00 39.78 38.97 3hk7 n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hk7 s ASN 294 N -2.41 6.09 -0.11 6.41 -0.87 -0.52 -4.80 114.94 118.74 3hk7 s ASN 294 Ca 0.27 0.20 -0.03 0.00 -1.57 0.00 0.00 52.86 51.73 3hk7 s ASN 294 Cb 0.20 -1.82 -0.03 0.00 -0.02 0.00 0.00 41.25 39.58 3hk7 s ASN 294 CO 0.48 0.19 -0.00 -0.54 -2.57 0.00 0.00 177.10 174.66 3hk7 s LYS 295 N -2.34 3.23 -0.08 -0.60 1.02 -1.26 -4.85 119.74 114.86 3hk7 s LYS 295 Ca 0.31 -0.43 0.02 0.00 0.02 0.00 0.00 55.97 55.90 3hk7 s LYS 295 Cb -0.13 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 34.34 3hk7 s LYS 295 CO 0.24 0.56 -0.15 -0.06 -0.92 0.00 0.00 175.35 175.02 3hk7 s PHE 296 N -0.48 1.74 -0.20 3.18 0.08 -0.42 0.02 117.98 121.89 3hk7 s PHE 296 Ca 0.08 -0.71 -0.07 0.00 0.12 0.00 0.00 56.93 56.35 3hk7 s PHE 296 Cb -0.12 -1.25 -0.04 0.00 -0.57 0.00 0.00 43.02 41.04 3hk7 s PHE 296 CO 0.02 -0.35 0.06 -0.51 -0.10 0.00 0.00 175.22 174.34 3hk7 s LEU 297 N 0.72 3.66 0.01 -0.37 1.43 -0.42 -0.93 118.68 122.77 3hk7 s LEU 297 Ca -0.13 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 3hk7 s LEU 297 Cb -0.16 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 3hk7 s LEU 297 CO 0.03 0.10 -0.09 -0.69 0.23 0.00 0.00 176.35 175.93 3hk7 s VAL 298 N 0.80 0.69 -0.07 -1.59 1.01 -0.62 -0.24 120.40 120.38 3hk7 s VAL 298 Ca 0.03 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 3hk7 s VAL 298 Cb -0.14 -0.61 0.02 0.00 0.00 0.00 0.00 36.38 35.65 3hk7 s VAL 298 CO 0.02 0.08 0.19 0.28 0.00 0.00 0.00 175.10 175.67 3hk7 s THR 299 N -0.44 0.00 0.12 3.92 -1.32 -1.07 -1.15 115.64 115.70 3hk7 s THR 299 Ca 0.01 -0.01 0.10 0.00 -1.21 0.00 0.00 61.69 60.59 3hk7 s THR 299 Cb -0.05 -0.27 -0.04 0.00 -1.51 0.00 0.00 72.50 70.63 3hk7 s THR 299 CO 0.00 -0.00 -0.26 -0.04 -2.21 0.00 0.00 174.62 172.11 3hk7 s MET 300 N 0.08 1.35 0.05 7.08 -1.94 -1.26 -2.13 119.30 122.53 3hk7 s MET 300 Ca -0.00 -1.31 0.03 0.00 -1.71 0.00 0.00 55.69 52.70 3hk7 s MET 300 Cb -0.01 -1.79 -0.25 0.00 2.01 0.00 0.00 34.83 34.79 3hk7 s MET 300 CO 0.00 0.42 1.03 1.25 -0.01 0.00 0.00 175.02 177.71 3hk7 h LEU 301 N 3.94 0.19 -9.78 -0.03 5.85 -1.31 -3.42 115.31 110.75 3hk7 h LEU 301 Ca -0.50 -0.25 -0.49 0.00 0.84 0.00 0.00 57.88 57.49 3hk7 h LEU 301 Cb 1.17 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 3hk7 h LEU 301 CO 0.39 1.20 0.36 -0.55 -0.34 0.00 0.00 178.44 179.50 3hk7 s SER 302 N -6.77 7.56 0.30 1.25 0.15 -1.26 -4.49 113.70 110.43 3hk7 s SER 302 Ca -0.04 1.95 0.02 0.00 0.70 0.00 0.00 55.95 58.59 3hk7 s SER 302 Cb 0.08 -2.61 0.46 0.00 -1.71 0.00 0.00 66.02 62.25 3hk7 s SER 302 CO 0.84 0.09 1.79 -0.09 1.20 0.00 0.00 173.24 177.07 3hk7 h ARG 303 N 3.93 0.58 0.00 5.44 2.43 -1.94 -2.84 114.38 121.97 3hk7 h ARG 303 Ca -0.45 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 58.55 3hk7 h ARG 303 Cb 1.20 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 3hk7 h ARG 303 CO 0.67 0.67 0.00 0.39 -1.51 0.00 0.00 179.97 180.19 3hk7 n GLU 304 N -4.21 0.34 -0.00 0.20 4.71 -1.26 -2.85 120.64 117.57 3hk7 n GLU 304 Ca 0.01 0.08 0.11 0.00 -0.01 0.00 0.00 57.16 57.35 3hk7 n GLU 304 Cb 0.32 -1.50 -0.15 0.00 -1.01 0.00 0.00 31.44 29.10 3hk7 n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hk7 n ASN 305 N -1.24 0.18 -0.10 1.62 5.03 -1.07 -4.68 115.26 115.01 3hk7 n ASN 305 Ca 0.10 -0.09 -0.06 0.00 0.87 0.00 0.00 54.58 55.41 3hk7 n ASN 305 Cb 0.14 1.75 0.01 0.00 -1.02 0.00 0.00 39.78 40.67 3hk7 n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3hk7 h GLN 306 N 0.00 0.13 -0.19 3.52 1.08 -1.60 -1.71 115.11 116.34 3hk7 h GLN 306 Ca 0.00 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 3hk7 h GLN 306 Cb 0.94 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.33 3hk7 h GLN 306 CO 0.00 0.09 -0.02 1.25 -0.95 0.00 0.00 178.83 179.20 3hk7 h HIS 307 N 0.14 0.38 0.00 2.96 2.76 -1.83 -2.51 115.15 117.05 3hk7 h HIS 307 Ca 0.16 -0.07 -0.04 0.00 -2.20 0.00 0.00 60.37 58.22 3hk7 h HIS 307 Cb 0.21 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 3hk7 h HIS 307 CO -0.21 0.57 -0.19 1.05 -1.30 0.00 0.00 177.93 177.84 3hk7 h GLU 308 N 0.08 0.00 -0.30 5.26 4.11 -1.84 -1.26 114.58 120.64 3hk7 h GLU 308 Ca 0.05 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.36 3hk7 h GLU 308 Cb 0.43 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3hk7 h GLU 308 CO 0.01 0.19 -0.30 1.25 0.07 0.00 0.00 179.01 180.24 3hk7 h LEU 309 N 0.00 0.64 -0.37 3.06 5.85 -1.12 -0.57 115.31 122.80 3hk7 h LEU 309 Ca -0.00 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 3hk7 h LEU 309 Cb 0.42 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 3hk7 h LEU 309 CO 0.03 0.91 0.09 0.58 -0.34 0.00 0.00 178.44 179.70 3hk7 h VAL 310 N 0.54 1.22 -0.52 1.05 2.07 -0.81 -1.81 116.25 117.99 3hk7 h VAL 310 Ca 0.07 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 3hk7 h VAL 310 Cb 0.78 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 3hk7 h VAL 310 CO 0.06 0.26 0.15 0.58 0.02 0.00 0.00 177.57 178.64 3hk7 h VAL 311 N 0.45 1.21 -0.14 2.57 2.07 -1.10 -1.37 116.25 119.94 3hk7 h VAL 311 Ca 0.12 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 3hk7 h VAL 311 Cb 0.30 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3hk7 h VAL 311 CO 0.00 0.28 -0.23 0.25 0.02 0.00 0.00 177.57 177.89 3hk7 h LEU 312 N 0.76 0.24 -1.19 2.57 5.85 -0.81 -1.17 115.31 121.55 3hk7 h LEU 312 Ca 0.17 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 3hk7 h LEU 312 Cb 0.25 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3hk7 h LEU 312 CO -0.01 0.48 -0.38 0.00 -0.34 0.00 0.00 178.44 178.19 3hk7 h ALA 313 N 1.55 1.22 0.00 1.25 0.00 -0.41 -1.22 119.26 121.65 3hk7 h ALA 313 Ca 0.04 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 3hk7 h ALA 313 Cb 0.53 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hk7 h ALA 313 CO 0.04 0.47 -0.28 0.00 0.00 0.00 0.00 179.25 179.47 3hk7 h ARG 314 N 0.00 0.00 0.22 0.00 3.08 -0.53 -3.23 114.38 113.92 3hk7 h ARG 314 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.71 3hk7 h ARG 314 Cb 0.74 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.82 3hk7 h ARG 314 CO 0.05 0.28 -1.51 0.87 -1.07 0.00 0.00 179.97 178.59 3hk7 h LYS 315 N 0.00 0.47 -4.46 0.04 1.79 -0.89 -3.46 116.57 110.05 3hk7 h LYS 315 Ca -0.00 -0.81 -0.56 0.00 -2.18 0.00 0.00 60.65 57.11 3hk7 h LYS 315 Cb 0.70 0.30 -0.36 0.00 -1.58 0.00 0.00 32.23 31.29 3hk7 h LYS 315 CO 0.04 1.38 -0.82 -0.06 -1.08 0.00 0.00 179.45 178.91 3hk7 s PHE 316 N -2.60 1.75 -0.24 -1.35 0.08 -0.90 -5.00 117.98 109.71 3hk7 s PHE 316 Ca -0.10 -0.88 0.28 0.00 0.12 0.00 0.00 56.93 56.35 3hk7 s PHE 316 Cb 0.05 -1.35 1.15 0.00 -0.57 0.00 0.00 43.02 42.30 3hk7 s PHE 316 CO 0.92 -0.53 1.83 0.66 -0.10 0.00 0.00 175.22 178.00 3hk7 h SER 317 N 7.89 0.00 -0.20 1.36 4.64 -1.90 -2.25 113.55 123.09 3hk7 h SER 317 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3hk7 h SER 317 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3hk7 h SER 317 CO 0.46 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.96 3hk7 n ASN 318 N -2.59 1.12 -4.34 4.97 6.94 -1.26 -4.71 115.26 115.39 3hk7 n ASN 318 Ca 0.01 -2.01 -0.34 0.00 -0.02 0.00 0.00 54.58 52.22 3hk7 n ASN 318 Cb 0.26 -0.15 -0.14 0.00 -2.36 0.00 0.00 39.78 37.39 3hk7 n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hk7 s LEU 319 N -0.99 2.85 -0.24 -4.53 2.96 -0.85 -1.31 118.68 116.58 3hk7 s LEU 319 Ca 0.13 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 53.72 3hk7 s LEU 319 Cb 0.07 -1.70 0.05 0.00 0.50 0.00 0.00 46.19 45.12 3hk7 s LEU 319 CO 0.09 0.06 -0.11 -0.32 -1.32 0.00 0.00 176.35 174.75 3hk7 s MET 320 N 1.00 2.22 0.23 1.98 -2.45 -0.11 -4.93 119.30 117.24 3hk7 s MET 320 Ca -0.00 -1.19 -0.18 0.00 -1.25 0.00 0.00 55.69 53.07 3hk7 s MET 320 Cb -0.15 -2.76 -0.08 0.00 1.25 0.00 0.00 34.83 33.09 3hk7 s MET 320 CO -0.00 -0.52 0.69 0.96 1.05 0.00 0.00 175.02 177.20 3hk7 s ILE 321 N 1.19 4.65 0.00 10.11 -4.36 -1.26 -1.59 121.20 129.94 3hk7 s ILE 321 Ca -0.06 1.12 -0.02 0.00 -0.26 0.00 0.00 60.65 61.43 3hk7 s ILE 321 Cb -0.19 -3.78 -0.01 0.00 1.25 0.00 0.00 42.46 39.73 3hk7 s ILE 321 CO -0.06 0.13 0.03 0.72 0.24 0.00 0.00 174.94 176.00 3hk7 s PHE 322 N -1.61 0.11 0.29 1.37 -0.12 -0.30 -2.13 117.98 115.58 3hk7 s PHE 322 Ca 0.44 -0.22 0.00 0.00 -0.05 0.00 0.00 56.93 57.10 3hk7 s PHE 322 Cb -0.15 -0.09 0.00 0.00 -0.63 0.00 0.00 43.02 42.15 3hk7 s PHE 322 CO 0.20 -0.15 0.00 0.41 -0.05 0.00 0.00 175.22 175.63 3hk7 n GLY 323 N 2.08 -1.57 2.88 1.99 0.00 0.27 -4.37 105.19 106.47 3hk7 n GLY 323 Ca -0.20 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 3hk7 n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hk7 s TRP 325 N -0.43 3.12 0.00 0.00 -0.00 -1.26 -2.81 118.94 117.56 3hk7 s TRP 325 Ca 0.19 0.99 0.00 0.00 -0.00 0.00 0.00 56.10 57.28 3hk7 s TRP 325 Cb -0.20 -3.60 0.00 0.00 -0.00 0.00 0.00 33.47 29.67 3hk7 s TRP 325 CO -0.04 -2.10 0.00 1.87 -0.00 0.00 0.00 176.95 176.68 3hk7 n TRP 326 N 4.60 0.00 0.42 5.86 -0.00 -1.26 -0.28 117.44 126.78 3hk7 n TRP 326 Ca 0.12 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.70 3hk7 n TRP 326 Cb 0.44 0.00 0.35 0.00 -0.00 0.00 0.00 31.31 32.10 3hk7 n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hk7 n PHE 327 N 0.00 0.26 0.40 5.87 3.72 -1.26 -0.95 117.46 125.49 3hk7 n PHE 327 Ca 0.00 0.10 0.12 0.00 -0.05 0.00 0.00 57.45 57.62 3hk7 n PHE 327 Cb 0.00 -0.67 0.05 0.00 -0.94 0.00 0.00 39.48 37.92 3hk7 n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hk7 n MET 328 N -1.74 0.41 -0.98 -1.08 2.81 0.62 -4.57 117.12 112.59 3hk7 n MET 328 Ca 0.03 0.05 -0.24 0.00 -1.81 0.00 0.00 57.70 55.73 3hk7 n MET 328 Cb 0.17 -1.69 -0.07 0.00 -0.71 0.00 0.00 33.22 30.92 3hk7 n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hk7 n ASN 329 N -2.24 6.12 -4.05 7.83 5.15 -0.12 -3.70 115.26 124.25 3hk7 n ASN 329 Ca 0.01 -2.41 -0.18 0.00 -0.60 0.00 0.00 54.58 51.40 3hk7 n ASN 329 Cb 0.48 -1.30 -0.14 0.00 -0.53 0.00 0.00 39.78 38.29 3hk7 n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hk7 s ASN 330 N 2.48 1.14 0.25 1.20 0.01 -1.26 -4.97 114.94 113.78 3hk7 s ASN 330 Ca 0.57 -0.26 -0.14 0.00 -0.71 0.00 0.00 52.86 52.32 3hk7 s ASN 330 Cb 0.19 -0.10 0.32 0.00 0.41 0.00 0.00 41.25 42.08 3hk7 s ASN 330 CO -0.03 0.06 1.55 -2.65 -1.51 0.00 0.00 177.10 174.52 3hk7 n PRO 331 N 2.53 -0.18 -0.36 -0.60 -0.02 -1.26 -0.36 135.00 134.75 3hk7 n PRO 331 Ca -0.15 1.54 0.05 0.00 -2.02 0.00 0.00 63.50 62.92 3hk7 n PRO 331 Cb 0.56 -2.29 0.21 0.00 -0.02 0.00 0.00 33.50 31.97 3hk7 n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hk7 h GLU 332 N 0.00 1.01 0.11 -0.52 4.57 -1.98 -0.77 114.58 117.00 3hk7 h GLU 332 Ca 0.39 -0.06 -0.17 0.00 -1.18 0.00 0.00 59.36 58.34 3hk7 h GLU 332 Cb 0.64 -0.23 0.01 0.00 -0.16 0.00 0.00 28.75 29.02 3hk7 h GLU 332 CO -1.00 0.67 -0.79 0.82 -1.18 0.00 0.00 179.01 177.53 3hk7 h ILE 333 N 1.04 1.46 -0.92 2.32 1.08 -1.30 -3.14 117.51 118.05 3hk7 h ILE 333 Ca 0.47 -2.47 0.12 0.00 -0.39 0.00 0.00 64.86 62.59 3hk7 h ILE 333 Cb 0.38 3.12 -0.09 0.00 -3.07 0.00 0.00 36.82 37.16 3hk7 h ILE 333 CO -0.23 0.68 0.54 0.40 -0.69 0.00 0.00 178.15 178.85 3hk7 h ILE 334 N -0.50 0.86 0.34 -0.67 2.04 -0.52 0.19 117.51 119.25 3hk7 h ILE 334 Ca -0.15 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 3hk7 h ILE 334 Cb 1.54 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3hk7 h ILE 334 CO 0.10 0.15 -0.16 -1.13 0.00 0.00 0.00 178.15 177.11 3hk7 h ASN 335 N 0.84 -0.38 -0.35 1.72 -1.24 -1.24 -1.01 115.58 113.92 3hk7 h ASN 335 Ca 0.47 -0.10 -0.07 0.00 0.71 0.00 0.00 56.30 57.32 3hk7 h ASN 335 Cb 0.53 0.10 -0.02 0.00 0.73 0.00 0.00 38.32 39.65 3hk7 h ASN 335 CO -0.29 -0.13 -0.00 1.05 -1.29 0.00 0.00 177.43 176.77 3hk7 h GLU 336 N -0.63 0.72 0.01 6.67 4.11 -1.41 -1.70 114.58 122.34 3hk7 h GLU 336 Ca -0.05 -0.18 -0.00 0.00 0.07 0.00 0.00 59.36 59.20 3hk7 h GLU 336 Cb 0.45 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3hk7 h GLU 336 CO 0.08 0.74 -0.01 0.52 0.07 0.00 0.00 179.01 180.41 3hk7 h MET 337 N 0.68 -0.02 -0.54 1.06 2.86 -0.96 -1.28 114.93 116.74 3hk7 h MET 337 Ca 0.13 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 3hk7 h MET 337 Cb 0.42 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 3hk7 h MET 337 CO 0.02 0.24 0.22 1.15 1.06 0.00 0.00 176.91 179.60 3hk7 h THR 338 N -0.27 1.20 -0.15 2.22 2.02 -1.07 -0.96 112.91 115.89 3hk7 h THR 338 Ca -0.00 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.51 3hk7 h THR 338 Cb 0.27 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 3hk7 h THR 338 CO 0.00 0.24 -0.13 0.03 0.37 0.00 0.00 175.52 176.04 3hk7 h ARG 339 N 0.77 0.35 -0.59 6.66 3.08 -1.22 -1.44 114.38 121.99 3hk7 h ARG 339 Ca 0.18 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 3hk7 h ARG 339 Cb 0.15 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 3hk7 h ARG 339 CO -0.02 0.72 0.34 0.52 -1.07 0.00 0.00 179.97 180.46 3hk7 h MET 340 N -0.01 0.82 -0.24 0.04 2.86 -1.01 -1.44 114.93 115.94 3hk7 h MET 340 Ca 0.03 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3hk7 h MET 340 Cb 0.64 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 3hk7 h MET 340 CO 0.03 0.61 0.16 0.00 1.06 0.00 0.00 176.91 178.77 3hk7 h ARG 341 N 0.80 0.32 -0.33 1.72 3.08 -1.16 -2.11 114.38 116.69 3hk7 h ARG 341 Ca 0.21 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.10 3hk7 h ARG 341 Cb 0.02 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3hk7 h ARG 341 CO -0.04 0.22 -0.34 1.98 -1.07 0.00 0.00 179.97 180.73 3hk7 h MET 342 N 0.32 0.75 0.00 0.04 4.05 -1.13 0.21 114.93 119.17 3hk7 h MET 342 Ca 0.09 -0.36 -0.05 0.00 -0.28 0.00 0.00 59.70 59.10 3hk7 h MET 342 Cb -0.03 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.76 3hk7 h MET 342 CO -0.02 0.97 -0.24 0.93 0.23 0.00 0.00 176.91 178.79 3hk7 h GLU 343 N 0.62 0.00 0.00 0.39 5.08 -1.12 0.11 114.58 119.66 3hk7 h GLU 343 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3hk7 h GLU 343 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3hk7 h GLU 343 CO 0.08 0.24 -0.80 -1.33 -1.00 0.00 0.00 179.01 176.19 3hk7 n MET 344 N -4.03 2.26 0.00 2.33 2.81 -0.81 -4.65 117.12 115.02 3hk7 n MET 344 Ca -0.02 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 3hk7 n MET 344 Cb 0.31 -1.16 0.00 0.00 -0.71 0.00 0.00 33.22 31.66 3hk7 n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hk7 n LEU 345 N -1.43 0.67 0.00 4.03 4.77 0.74 -4.89 117.00 120.88 3hk7 n LEU 345 Ca 0.02 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 3hk7 n LEU 345 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3hk7 n LEU 345 CO 0.27 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 3hk7 n GLY 346 N -0.07 4.10 0.78 -0.72 0.00 0.37 -1.47 105.19 108.17 3hk7 n GLY 346 Ca 0.00 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.16 3hk7 n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hk7 n THR 347 N 0.00 1.12 -1.35 2.61 -2.24 -1.26 -4.30 114.28 108.87 3hk7 n THR 347 Ca 0.00 -1.07 -0.26 0.00 -2.27 0.00 0.00 64.05 60.45 3hk7 n THR 347 Cb 0.00 0.43 -0.09 0.00 -2.10 0.00 0.00 70.33 68.58 3hk7 n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hk7 n SER 348 N 0.60 6.76 -3.87 3.42 3.41 -0.54 -4.70 113.62 118.69 3hk7 n SER 348 Ca 0.14 -2.79 -0.07 0.00 -0.26 0.00 0.00 58.87 55.89 3hk7 n SER 348 Cb 0.50 -1.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.03 3hk7 n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hk7 s PHE 349 N 0.22 -0.11 -0.40 7.33 -0.12 -1.26 -4.82 117.98 118.82 3hk7 s PHE 349 Ca 0.64 -0.33 -0.05 0.00 -0.05 0.00 0.00 56.93 57.14 3hk7 s PHE 349 Cb 0.29 0.62 0.09 0.00 -0.63 0.00 0.00 43.02 43.39 3hk7 s PHE 349 CO -0.09 -1.19 0.19 0.42 -0.05 0.00 0.00 175.22 174.51 3hk7 s ILE 350 N -3.93 3.56 0.24 -4.49 1.01 -0.91 -4.67 121.20 112.01 3hk7 s ILE 350 Ca 0.13 -1.74 -0.05 0.00 0.00 0.00 0.00 60.65 58.98 3hk7 s ILE 350 Cb -0.05 -3.29 0.20 0.00 0.01 0.00 0.00 42.46 39.33 3hk7 s ILE 350 CO 0.07 -0.54 1.80 1.55 0.00 0.00 0.00 174.94 177.82 3hk7 h PRO 351 N 8.17 0.72 -3.71 2.79 0.13 -1.86 0.78 132.00 139.03 3hk7 h PRO 351 Ca -0.18 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.83 3hk7 h PRO 351 Cb 1.06 -0.16 -0.12 0.00 0.13 0.00 0.00 31.00 31.91 3hk7 h PRO 351 CO 0.70 0.48 -0.23 -1.14 -0.23 0.00 0.00 178.00 177.57 3hk7 s GLN 352 N -6.05 1.14 0.06 0.86 2.00 -1.26 -3.16 119.66 113.26 3hk7 s GLN 352 Ca -0.12 -1.03 -0.09 0.00 -2.00 0.00 0.00 55.36 52.11 3hk7 s GLN 352 Cb 0.19 0.41 0.00 0.00 0.80 0.00 0.00 33.01 34.41 3hk7 s GLN 352 CO 0.77 -0.43 0.19 -3.38 -0.50 0.00 0.00 175.29 171.95 3hk7 s HIS 353 N -3.91 0.10 -0.08 1.67 -3.43 -1.26 -4.62 115.29 103.75 3hk7 s HIS 353 Ca 0.12 -0.41 0.03 0.00 -0.80 0.00 0.00 55.06 53.99 3hk7 s HIS 353 Cb 0.03 -0.04 -0.25 0.00 -1.43 0.00 0.00 32.58 30.89 3hk7 s HIS 353 CO -0.04 -0.48 0.52 -1.13 -2.00 0.00 0.00 174.74 171.61 3hk7 n SER 354 N 0.33 1.52 -1.19 7.38 3.41 -1.25 -4.79 113.62 119.04 3hk7 n SER 354 Ca -0.17 0.31 -0.14 0.00 -0.26 0.00 0.00 58.87 58.61 3hk7 n SER 354 Cb 0.61 -0.48 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 3hk7 n SER 354 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hk7 n ASP 355 N -3.27 -4.62 -4.67 4.04 -0.08 -0.41 -4.91 116.55 102.63 3hk7 n ASP 355 Ca -0.24 0.28 -0.48 0.00 -1.51 0.00 0.00 54.79 52.83 3hk7 n ASP 355 Cb 1.05 -3.45 -0.05 0.00 2.34 0.00 0.00 41.12 41.01 3hk7 n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hk7 n ALA 356 N 0.66 0.99 0.13 -1.67 0.00 -1.26 -4.40 120.51 114.95 3hk7 n ALA 356 Ca -0.15 0.38 0.09 0.00 0.00 0.00 0.00 53.44 53.77 3hk7 n ALA 356 Cb 0.50 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 17.42 3hk7 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk7 n ARG 357 N 4.74 0.65 -4.43 0.00 1.74 -1.26 0.26 116.66 118.36 3hk7 n ARG 357 Ca 0.20 -0.14 -0.27 0.00 -0.77 0.00 0.00 57.85 56.87 3hk7 n ARG 357 Cb 0.28 -1.42 -0.17 0.00 -1.02 0.00 0.00 32.46 30.14 3hk7 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk7 s VAL 358 N -3.17 1.33 0.19 1.55 1.01 -1.26 -4.38 120.40 115.67 3hk7 s VAL 358 Ca -0.05 -0.55 -0.19 0.00 0.00 0.00 0.00 61.98 61.20 3hk7 s VAL 358 Cb 0.12 -1.23 0.15 0.00 0.00 0.00 0.00 36.38 35.42 3hk7 s VAL 358 CO 0.75 0.41 1.41 -0.11 0.00 0.00 0.00 175.10 177.56 3hk7 n LEU 359 N 4.18 -0.68 0.32 3.92 7.94 0.08 -1.12 117.00 131.64 3hk7 n LEU 359 Ca -0.19 1.59 0.21 0.00 -1.11 0.00 0.00 56.01 56.51 3hk7 n LEU 359 Cb 0.51 -0.33 1.14 0.00 0.53 0.00 0.00 43.42 45.27 3hk7 n LEU 359 CO 0.23 -1.40 1.14 -0.33 -1.11 0.00 0.00 177.39 175.93 3hk7 h GLU 360 N 0.00 0.00 0.00 1.96 3.07 -1.94 -2.58 114.58 115.09 3hk7 h GLU 360 Ca 0.28 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.13 3hk7 h GLU 360 Cb 0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3hk7 h GLU 360 CO -0.89 0.00 -0.02 1.96 -1.40 0.00 0.00 179.01 178.66 3hk7 h GLN 361 N 0.00 0.00 -0.69 2.33 4.20 -1.53 -1.15 115.11 118.27 3hk7 h GLN 361 Ca 0.00 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.85 3hk7 h GLN 361 Cb 0.01 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.75 3hk7 h GLN 361 CO 0.00 0.02 0.47 -0.07 -0.67 0.00 0.00 178.83 178.58 3hk7 h LEU 362 N 0.00 0.31 0.89 1.46 3.38 -1.64 0.45 115.31 120.16 3hk7 h LEU 362 Ca -0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3hk7 h LEU 362 Cb 0.08 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3hk7 h LEU 362 CO 0.00 0.17 -0.43 0.40 0.09 0.00 0.00 178.44 178.67 3hk7 h ILE 363 N 0.33 0.00 -0.20 1.22 2.04 -1.45 -2.73 117.51 116.72 3hk7 h ILE 363 Ca 0.33 -0.06 -0.18 0.00 1.00 0.00 0.00 64.86 65.96 3hk7 h ILE 363 Cb 0.84 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3hk7 h ILE 363 CO -0.09 0.00 -0.61 0.10 0.00 0.00 0.00 178.15 177.55 3hk7 h TYR 364 N -1.25 0.87 -0.43 1.37 -0.00 -1.59 -1.55 116.97 114.38 3hk7 h TYR 364 Ca -0.12 -0.33 0.05 0.00 0.00 0.00 0.00 58.73 58.33 3hk7 h TYR 364 Cb 0.92 -0.15 -0.05 0.00 0.00 0.00 0.00 36.73 37.44 3hk7 h TYR 364 CO 0.02 1.11 0.16 0.87 -0.00 0.00 0.00 178.16 180.32 3hk7 h LYS 365 N 0.50 0.33 0.00 0.10 1.79 -1.01 0.14 116.57 118.43 3hk7 h LYS 365 Ca -0.00 -0.02 -0.19 0.00 -2.18 0.00 0.00 60.65 58.25 3hk7 h LYS 365 Cb 1.19 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.74 3hk7 h LYS 365 CO 0.12 0.22 -0.93 -1.49 -1.08 0.00 0.00 179.45 176.29 3hk7 h TRP 366 N 0.34 0.00 -0.17 -1.35 4.06 -1.51 -2.36 115.95 114.95 3hk7 h TRP 366 Ca 0.20 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.08 3hk7 h TRP 366 Cb 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.33 3hk7 h TRP 366 CO -0.14 0.93 -0.14 1.25 -3.56 0.00 0.00 178.44 176.77 3hk7 h HIS 367 N 0.00 0.48 -0.47 0.49 2.76 -0.95 0.45 115.15 117.91 3hk7 h HIS 367 Ca -0.01 -0.14 -0.08 0.00 -2.20 0.00 0.00 60.37 57.95 3hk7 h HIS 367 Cb 1.71 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.55 3hk7 h HIS 367 CO 0.00 0.76 0.00 0.45 -1.30 0.00 0.00 177.93 177.84 3hk7 h HIS 368 N 0.06 0.91 -0.16 5.26 3.86 -0.80 -2.79 115.15 121.49 3hk7 h HIS 368 Ca 0.03 -0.16 -0.18 0.00 -1.16 0.00 0.00 60.37 58.91 3hk7 h HIS 368 Cb 0.67 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.91 3hk7 h HIS 368 CO 0.08 0.87 -0.59 0.77 0.86 0.00 0.00 177.93 179.91 3hk7 h SER 369 N 0.69 0.81 -0.45 2.45 0.02 -1.43 -3.14 113.55 112.50 3hk7 h SER 369 Ca 0.13 -0.61 0.01 0.00 -0.84 0.00 0.00 61.79 60.49 3hk7 h SER 369 Cb 0.51 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 3hk7 h SER 369 CO 0.02 1.28 0.30 0.11 -1.14 0.00 0.00 176.83 177.40 3hk7 h LYS 370 N 0.39 0.58 -0.14 3.45 1.57 -0.93 0.23 116.57 121.71 3hk7 h LYS 370 Ca -0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3hk7 h LYS 370 Cb 1.22 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 3hk7 h LYS 370 CO 0.13 0.38 0.09 0.77 -0.57 0.00 0.00 179.45 180.24 3hk7 h SER 371 N 0.60 0.16 -0.07 0.86 0.02 -1.47 0.05 113.55 113.70 3hk7 h SER 371 Ca 0.17 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3hk7 h SER 371 Cb -0.05 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 3hk7 h SER 371 CO -0.04 0.15 -0.02 0.40 -1.14 0.00 0.00 176.83 176.18 3hk7 h ILE 372 N 0.17 1.30 -0.98 3.27 2.04 -1.36 -2.62 117.51 119.33 3hk7 h ILE 372 Ca 0.05 -0.97 0.03 0.00 1.00 0.00 0.00 64.86 64.96 3hk7 h ILE 372 Cb 0.01 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3hk7 h ILE 372 CO -0.01 0.27 0.64 0.40 0.00 0.00 0.00 178.15 179.45 3hk7 h ILE 373 N -0.21 1.20 -0.61 -0.67 2.04 -0.92 -1.35 117.51 116.99 3hk7 h ILE 373 Ca 0.02 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 3hk7 h ILE 373 Cb 0.44 -0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 3hk7 h ILE 373 CO 0.01 0.23 0.35 0.00 0.00 0.00 0.00 178.15 178.74 3hk7 h ALA 374 N 1.38 0.78 -0.60 1.87 0.00 -0.94 -0.30 119.26 121.46 3hk7 h ALA 374 Ca 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3hk7 h ALA 374 Cb -0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 3hk7 h ALA 374 CO -0.11 0.28 0.28 0.93 0.00 0.00 0.00 179.25 180.64 3hk7 h GLU 375 N 0.83 0.87 -0.06 0.00 4.39 -0.98 0.63 114.58 120.25 3hk7 h GLU 375 Ca 0.22 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.78 3hk7 h GLU 375 Cb 0.02 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.51 3hk7 h GLU 375 CO -0.04 0.71 0.04 0.28 -1.16 0.00 0.00 179.01 178.84 3hk7 h VAL 376 N 0.82 1.01 -0.58 3.13 2.07 -0.95 -1.79 116.25 119.96 3hk7 h VAL 376 Ca 0.20 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.76 3hk7 h VAL 376 Cb 0.13 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 3hk7 h VAL 376 CO -0.02 0.01 0.29 -0.07 0.02 0.00 0.00 177.57 177.80 3hk7 h LEU 377 N 0.07 0.40 -0.71 2.57 3.38 -0.66 -1.42 115.31 118.95 3hk7 h LEU 377 Ca 0.02 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3hk7 h LEU 377 Cb -0.01 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 3hk7 h LEU 377 CO -0.01 0.26 0.43 0.40 0.09 0.00 0.00 178.44 179.61 3hk7 h ILE 378 N 0.54 1.05 -0.25 1.22 2.04 -0.60 0.86 117.51 122.38 3hk7 h ILE 378 Ca 0.27 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3hk7 h ILE 378 Cb 0.21 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 3hk7 h ILE 378 CO -0.20 0.15 0.12 0.44 0.00 0.00 0.00 178.15 178.66 3hk7 h ASP 379 N 0.82 0.32 -0.36 1.72 3.32 -0.59 -0.17 116.42 121.48 3hk7 h ASP 379 Ca 0.30 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 57.12 3hk7 h ASP 379 Cb 0.09 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3hk7 h ASP 379 CO -0.14 0.35 -0.15 0.11 -1.72 0.00 0.00 179.24 177.69 3hk7 h LYS 380 N 0.26 0.83 -0.44 3.56 6.56 -0.89 -1.16 116.57 125.29 3hk7 h LYS 380 Ca 0.08 -0.30 -0.13 0.00 -1.06 0.00 0.00 60.65 59.24 3hk7 h LYS 380 Cb 0.12 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.71 3hk7 h LYS 380 CO -0.01 0.93 -0.23 1.88 -2.06 0.00 0.00 179.45 179.96 3hk7 h TYR 381 N 0.74 1.07 -0.54 -1.35 0.05 -0.76 -2.79 116.97 113.40 3hk7 h TYR 381 Ca 0.11 -0.27 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 3hk7 h TYR 381 Cb 0.66 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 3hk7 h TYR 381 CO 0.04 1.08 0.23 0.22 -1.05 0.00 0.00 178.16 178.68 3hk7 h ASP 382 N 0.76 0.69 -0.50 3.88 3.58 -0.83 -0.23 116.42 123.78 3hk7 h ASP 382 Ca 0.10 -0.07 -0.04 0.00 0.42 0.00 0.00 57.03 57.43 3hk7 h ASP 382 Cb 0.80 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 3hk7 h ASP 382 CO 0.07 0.61 0.17 0.44 -2.88 0.00 0.00 179.24 177.64 3hk7 h ASP 383 N 0.76 0.71 1.24 2.28 3.32 -0.99 -1.05 116.42 122.69 3hk7 h ASP 383 Ca 0.19 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 3hk7 h ASP 383 Cb 0.12 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3hk7 h ASP 383 CO -0.02 0.72 -0.51 0.16 -1.72 0.00 0.00 179.24 177.86 3hk7 h ILE 384 N 0.67 0.95 -0.75 0.35 3.07 -1.21 -2.30 117.51 118.29 3hk7 h ILE 384 Ca 0.16 -2.12 -0.04 0.00 1.55 0.00 0.00 64.86 64.41 3hk7 h ILE 384 Cb 0.25 2.31 -0.03 0.00 -0.27 0.00 0.00 36.82 39.08 3hk7 h ILE 384 CO -0.01 0.50 0.29 -0.07 -1.05 0.00 0.00 178.15 177.81 3hk7 h LEU 385 N 0.00 1.03 -1.36 0.16 4.07 -0.81 0.60 115.31 118.99 3hk7 h LEU 385 Ca -0.01 -0.16 -0.07 0.00 0.08 0.00 0.00 57.88 57.73 3hk7 h LEU 385 Cb 1.27 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.73 3hk7 h LEU 385 CO 0.07 0.91 -0.32 1.56 -1.08 0.00 0.00 178.44 179.58 3hk7 h GLN 386 N 1.08 0.00 -0.03 1.13 1.08 -0.91 -1.57 115.11 115.89 3hk7 h GLN 386 Ca 0.25 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.45 3hk7 h GLN 386 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 3hk7 h GLN 386 CO -0.02 0.32 0.00 0.00 -0.95 0.00 0.00 178.83 178.18 3hk7 n ALA 387 N -2.44 2.61 -0.26 3.87 0.00 -0.54 -4.87 120.51 118.87 3hk7 n ALA 387 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3hk7 n ALA 387 Cb 0.37 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3hk7 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk7 n GLY 388 N 0.93 0.78 3.75 0.00 0.00 -0.59 -5.06 105.19 104.99 3hk7 n GLY 388 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3hk7 n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hk7 s TRP 389 N -2.19 3.91 -0.57 1.61 -0.11 0.09 -4.99 118.94 116.68 3hk7 s TRP 389 Ca 0.00 1.82 -0.16 0.00 1.22 0.00 0.00 56.10 58.98 3hk7 s TRP 389 Cb 0.00 -2.97 0.14 0.00 -1.50 0.00 0.00 33.47 29.14 3hk7 s TRP 389 CO 0.00 0.37 0.54 -2.00 -4.62 0.00 0.00 176.95 171.24 3hk7 s GLU 390 N -0.71 3.06 0.13 5.86 2.12 -1.26 -4.07 118.70 123.82 3hk7 s GLU 390 Ca 0.42 -1.77 -0.27 0.00 0.36 0.00 0.00 54.97 53.71 3hk7 s GLU 390 Cb -0.24 -4.31 -0.07 0.00 0.26 0.00 0.00 34.13 29.76 3hk7 s GLU 390 CO 0.30 -1.34 0.82 0.08 -0.54 0.00 0.00 175.26 174.59 3hk7 s VAL 391 N 1.50 4.46 0.07 3.70 1.01 -1.26 -5.06 120.40 124.82 3hk7 s VAL 391 Ca 0.05 1.79 0.04 0.00 0.00 0.00 0.00 61.98 63.85 3hk7 s VAL 391 Cb -0.28 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 3hk7 s VAL 391 CO 0.02 0.44 0.03 0.42 0.00 0.00 0.00 175.10 176.00 3hk7 s THR 392 N -0.64 4.21 0.47 3.92 -4.23 -1.26 -4.47 115.64 113.65 3hk7 s THR 392 Ca 0.39 -0.84 0.16 0.00 -1.18 0.00 0.00 61.69 60.22 3hk7 s THR 392 Cb -0.23 -2.99 0.32 0.00 1.34 0.00 0.00 72.50 70.94 3hk7 s THR 392 CO 0.27 0.17 2.03 -0.08 -0.54 0.00 0.00 174.62 176.47 3hk7 h GLU 393 N 3.58 0.25 -0.34 3.99 4.81 -1.99 -0.19 114.58 124.69 3hk7 h GLU 393 Ca -0.48 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 58.60 3hk7 h GLU 393 Cb 1.17 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 3hk7 h GLU 393 CO 0.61 0.17 -0.35 1.49 -0.73 0.00 0.00 179.01 180.20 3hk7 h GLU 394 N 0.26 0.78 -0.25 1.92 4.57 -1.99 -1.25 114.58 118.61 3hk7 h GLU 394 Ca 0.20 -0.38 -0.11 0.00 -1.18 0.00 0.00 59.36 57.89 3hk7 h GLU 394 Cb 0.44 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 3hk7 h GLU 394 CO -0.04 1.00 -0.32 0.93 -1.18 0.00 0.00 179.01 179.41 3hk7 h GLU 395 N 0.65 0.52 -0.43 1.92 5.08 -1.49 -1.23 114.58 119.60 3hk7 h GLU 395 Ca 0.06 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 3hk7 h GLU 395 Cb 0.89 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 3hk7 h GLU 395 CO 0.08 0.78 0.19 0.82 -1.00 0.00 0.00 179.01 179.87 3hk7 h ILE 396 N 0.45 1.19 -0.78 3.13 2.04 -0.89 0.34 117.51 122.98 3hk7 h ILE 396 Ca 0.05 -0.57 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 3hk7 h ILE 396 Cb 0.77 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 3hk7 h ILE 396 CO 0.06 0.21 0.38 0.11 0.00 0.00 0.00 178.15 178.91 3hk7 h LYS 397 N 0.55 1.12 0.52 2.37 1.57 -0.97 0.12 116.57 121.86 3hk7 h LYS 397 Ca 0.15 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3hk7 h LYS 397 Cb 0.16 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3hk7 h LYS 397 CO -0.01 0.87 -0.28 -0.09 -0.57 0.00 0.00 179.45 179.37 3hk7 h ARG 398 N 1.10 -0.71 -0.64 3.15 2.43 -0.78 -0.01 114.38 118.91 3hk7 h ARG 398 Ca 0.27 0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.56 3hk7 h ARG 398 Cb 0.11 0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 3hk7 h ARG 398 CO -0.03 -0.48 0.31 -0.44 -1.51 0.00 0.00 179.97 177.82 3hk7 h ASP 399 N -0.74 0.41 -0.53 -3.80 3.32 -0.69 -0.87 116.42 113.52 3hk7 h ASP 399 Ca -0.07 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3hk7 h ASP 399 Cb 0.58 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 3hk7 h ASP 399 CO 0.10 0.25 0.25 0.58 -1.72 0.00 0.00 179.24 178.70 3hk7 h VAL 400 N 0.56 1.19 -0.57 -1.35 2.07 -0.78 -2.06 116.25 115.31 3hk7 h VAL 400 Ca 0.31 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 3hk7 h VAL 400 Cb 0.29 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3hk7 h VAL 400 CO -0.24 0.23 -0.02 0.00 0.02 0.00 0.00 177.57 177.56 3hk7 h ALA 401 N 1.49 0.88 0.07 1.67 0.00 0.32 -2.46 119.26 121.23 3hk7 h ALA 401 Ca 0.19 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3hk7 h ALA 401 Cb 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hk7 h ALA 401 CO -0.02 0.65 -0.03 -0.44 0.00 0.00 0.00 179.25 179.41 3hk7 h ASP 402 N 0.92 -0.08 -0.30 0.00 3.32 -0.61 -0.09 116.42 119.58 3hk7 h ASP 402 Ca 0.16 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3hk7 h ASP 402 Cb 0.57 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 3hk7 h ASP 402 CO 0.03 0.06 0.20 -0.07 -1.72 0.00 0.00 179.24 177.74 3hk7 h LEU 403 N -0.21 0.35 -0.24 1.55 3.38 -1.36 0.36 115.31 119.15 3hk7 h LEU 403 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3hk7 h LEU 403 Cb 0.18 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3hk7 h LEU 403 CO 0.02 0.25 -0.31 0.49 0.09 0.00 0.00 178.44 178.98 3hk7 n PHE 404 N -4.88 0.00 0.11 1.13 3.72 -0.93 -4.25 117.46 112.36 3hk7 n PHE 404 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3hk7 n PHE 404 Cb 0.02 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 3hk7 n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hk7 n SER 405 N -1.07 -1.89 -0.15 4.37 2.88 -0.57 -1.77 113.62 115.41 3hk7 n SER 405 Ca 0.10 0.41 -0.00 0.00 -1.33 0.00 0.00 58.87 58.05 3hk7 n SER 405 Cb 0.33 2.02 0.25 0.00 -0.75 0.00 0.00 64.21 66.07 3hk7 n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hk7 h ARG 406 N 0.00 0.86 -0.96 -1.46 3.08 -1.07 -2.77 114.38 112.06 3hk7 h ARG 406 Ca 0.00 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 59.97 3hk7 h ARG 406 Cb 0.00 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 29.83 3hk7 h ARG 406 CO 0.00 0.64 0.63 -0.91 -1.07 0.00 0.00 179.97 179.26 3hk7 h ASN 407 N 0.86 1.08 0.36 7.04 2.35 -1.13 -0.81 115.58 125.33 3hk7 h ASN 407 Ca 0.22 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 3hk7 h ASN 407 Cb 0.04 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.15 3hk7 h ASN 407 CO -0.03 0.77 -0.18 0.15 -1.65 0.00 0.00 177.43 176.50 3hk7 h PHE 408 N 1.27 -0.45 -0.39 1.19 3.57 -1.72 -1.25 116.94 119.17 3hk7 h PHE 408 Ca 0.36 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.88 3hk7 h PHE 408 Cb -0.11 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 3hk7 h PHE 408 CO -0.00 -0.12 0.26 -1.49 -2.23 0.00 0.00 178.31 174.73 3hk7 h TRP 409 N -0.92 0.40 -0.39 0.41 4.06 -1.50 -0.11 115.95 117.91 3hk7 h TRP 409 Ca -0.05 0.01 -0.11 0.00 2.06 0.00 0.00 58.89 60.80 3hk7 h TRP 409 Cb 0.54 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.55 3hk7 h TRP 409 CO 0.03 0.24 -0.22 -0.09 -3.56 0.00 0.00 178.44 174.84 3hk7 h ARG 410 N 0.42 0.78 -0.09 0.49 2.43 -1.13 -0.93 114.38 116.35 3hk7 h ARG 410 Ca 0.16 -0.31 -0.14 0.00 -0.81 0.00 0.00 59.98 58.87 3hk7 h ARG 410 Cb 0.10 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3hk7 h ARG 410 CO -0.04 0.93 -0.50 0.35 -1.51 0.00 0.00 179.97 179.20 3hk7 h PHE 411 N 0.68 0.68 0.00 2.20 3.57 0.14 -3.20 116.94 121.01 3hk7 h PHE 411 Ca 0.09 -0.30 0.00 0.00 3.53 0.00 0.00 57.97 61.29 3hk7 h PHE 411 Cb 0.73 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.37 3hk7 h PHE 411 CO 0.04 1.08 0.00 -0.39 -2.23 0.00 0.00 178.31 176.81 3hk7 h VAL 412 N 0.08 0.00 -1.53 1.41 -1.51 -1.08 -3.47 116.25 110.15 3hk7 h VAL 412 Ca -0.04 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 3hk7 h VAL 412 Cb 1.15 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.80 3hk7 h VAL 412 CO 0.10 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.05 3hk7 n GLY 413 N 0.36 0.55 0.00 5.19 0.00 -0.50 -4.79 105.19 106.00 3hk7 n GLY 413 Ca 0.02 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3hk7 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86