#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hb6 s LYS 5 N 0.00 4.17 0.20 1.97 1.02 -1.26 -5.06 119.74 120.77 3hb6 s LYS 5 Ca 0.00 0.10 -0.31 0.00 0.02 0.00 0.00 55.97 55.77 3hb6 s LYS 5 Cb 0.00 -3.52 -0.11 0.00 -0.52 0.00 0.00 37.83 33.68 3hb6 s LYS 5 CO 0.00 0.02 1.59 -1.17 -0.92 0.00 0.00 175.35 174.88 3hb6 s LEU 6 N 1.13 4.37 0.28 3.17 2.96 -1.26 -5.01 118.68 124.31 3hb6 s LEU 6 Ca 0.16 2.72 0.03 0.00 -0.22 0.00 0.00 54.13 56.82 3hb6 s LEU 6 Cb -0.14 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.89 3hb6 s LEU 6 CO 0.07 -0.86 0.05 0.42 -1.32 0.00 0.00 176.35 174.71 3hb6 s THR 7 N 0.91 0.96 0.82 3.68 -4.23 -1.26 -2.34 115.64 114.19 3hb6 s THR 7 Ca 0.69 -2.01 -0.11 0.00 -1.18 0.00 0.00 61.69 59.08 3hb6 s THR 7 Cb -0.45 -2.61 0.12 0.00 1.34 0.00 0.00 72.50 70.90 3hb6 s THR 7 CO 0.34 -0.10 1.16 0.42 -0.54 0.00 0.00 174.62 175.91 3hb6 s THR 8 N -3.47 2.09 0.44 3.99 -4.23 0.95 -4.85 115.64 110.57 3hb6 s THR 8 Ca 0.34 -0.13 0.30 0.00 -1.18 0.00 0.00 61.69 61.02 3hb6 s THR 8 Cb 0.07 -2.95 0.33 0.00 1.34 0.00 0.00 72.50 71.29 3hb6 s THR 8 CO 0.13 0.00 2.12 0.00 -0.54 0.00 0.00 174.62 176.33 3hb6 h ALA 9 N -1.07 1.26 -0.27 3.99 0.00 -2.00 -1.06 119.26 120.11 3hb6 h ALA 9 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3hb6 h ALA 9 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3hb6 h ALA 9 CO 0.53 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.88 3hb6 n ALA 10 N -2.25 2.48 -0.64 0.00 0.00 -1.26 -4.95 120.51 113.88 3hb6 n ALA 10 Ca -0.02 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.73 3hb6 n ALA 10 Cb 0.20 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3hb6 n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb6 n GLY 11 N 1.24 0.72 3.79 0.00 0.00 -0.40 -5.07 105.19 105.48 3hb6 n GLY 11 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3hb6 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb6 s ALA 12 N -2.40 3.42 0.50 4.61 0.00 -1.26 -4.71 121.76 121.91 3hb6 s ALA 12 Ca 0.00 0.33 -0.24 0.00 0.00 0.00 0.00 51.96 52.05 3hb6 s ALA 12 Cb 0.00 -2.94 -0.07 0.00 0.00 0.00 0.00 23.12 20.11 3hb6 s ALA 12 CO 0.00 0.29 1.38 -2.14 0.00 0.00 0.00 175.76 175.29 3hb6 s PRO 13 N -1.44 3.43 -0.29 0.00 0.02 -1.26 -0.03 135.00 135.43 3hb6 s PRO 13 Ca 0.39 2.30 -0.11 0.00 0.02 0.00 0.00 61.00 63.60 3hb6 s PRO 13 Cb -0.21 -2.46 -0.04 0.00 0.02 0.00 0.00 34.50 31.80 3hb6 s PRO 13 CO 0.25 -0.98 0.19 0.08 -0.33 0.00 0.00 177.00 176.21 3hb6 s VAL 14 N -1.26 5.24 -0.04 3.83 1.01 -0.99 -4.77 120.40 123.42 3hb6 s VAL 14 Ca 0.66 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 62.55 3hb6 s VAL 14 Cb -0.42 -3.52 -0.13 0.00 0.00 0.00 0.00 36.38 32.31 3hb6 s VAL 14 CO 0.51 0.22 0.82 0.58 0.00 0.00 0.00 175.10 177.23 3hb6 h VAL 15 N 5.40 0.56 -3.31 2.92 2.07 -1.94 -3.45 116.25 118.50 3hb6 h VAL 15 Ca -0.35 -0.92 -0.52 0.00 0.82 0.00 0.00 66.70 65.73 3hb6 h VAL 15 Cb 1.18 0.93 -0.39 0.00 -1.52 0.00 0.00 31.29 31.49 3hb6 h VAL 15 CO 0.56 0.14 -0.77 -0.62 0.02 0.00 0.00 177.57 176.90 3hb6 s ASP 16 N -5.27 2.80 0.00 0.57 -1.08 -1.26 -4.97 116.67 107.46 3hb6 s ASP 16 Ca -0.11 -0.72 0.24 0.00 -0.52 0.00 0.00 52.55 51.43 3hb6 s ASP 16 Cb 0.01 -0.68 0.29 0.00 -1.46 0.00 0.00 42.92 41.07 3hb6 s ASP 16 CO 0.40 -0.26 1.32 -3.20 0.52 0.00 0.00 175.17 173.95 3hb6 n ASN 17 N 5.00 3.10 -0.00 -0.34 5.15 -1.26 -4.42 115.26 122.49 3hb6 n ASN 17 Ca -0.09 -1.99 0.02 0.00 -0.60 0.00 0.00 54.58 51.92 3hb6 n ASN 17 Cb 0.47 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.62 3hb6 n ASN 17 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3hb6 n ASN 18 N 1.36 3.28 -3.96 1.20 3.02 -1.26 -5.01 115.26 113.89 3hb6 n ASN 18 Ca 0.16 -0.12 -0.21 0.00 -0.03 0.00 0.00 54.58 54.38 3hb6 n ASN 18 Cb 0.60 1.15 -0.16 0.00 -0.61 0.00 0.00 39.78 40.76 3hb6 n ASN 18 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3hb6 s ASN 19 N -2.26 1.26 0.71 6.41 0.01 -1.26 -5.16 114.94 114.65 3hb6 s ASN 19 Ca -0.01 -0.20 -0.11 0.00 -0.71 0.00 0.00 52.86 51.84 3hb6 s ASN 19 Cb 0.03 -0.53 0.03 0.00 0.41 0.00 0.00 41.25 41.18 3hb6 s ASN 19 CO 0.17 0.01 1.08 0.68 -1.51 0.00 0.00 177.10 177.53 3hb6 s VAL 20 N 0.63 3.12 -0.20 1.60 -7.23 -1.26 -4.85 120.40 112.23 3hb6 s VAL 20 Ca -0.10 0.27 -0.25 0.00 -1.81 0.00 0.00 61.98 60.09 3hb6 s VAL 20 Cb -0.13 -3.35 -0.01 0.00 0.56 0.00 0.00 36.38 33.45 3hb6 s VAL 20 CO 0.01 -0.44 0.83 -0.63 -0.31 0.00 0.00 175.10 174.57 3hb6 s ILE 21 N -3.35 4.87 0.17 -0.62 1.01 -1.26 -5.04 121.20 116.96 3hb6 s ILE 21 Ca 0.58 1.61 0.07 0.00 0.00 0.00 0.00 60.65 62.91 3hb6 s ILE 21 Cb -0.11 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 3hb6 s ILE 21 CO 0.50 -0.01 -0.14 0.42 0.00 0.00 0.00 174.94 175.71 3hb6 s THR 22 N 2.39 1.53 -1.30 2.92 -4.23 -1.26 -1.65 115.64 114.04 3hb6 s THR 22 Ca 0.37 -2.01 -0.16 0.00 -1.18 0.00 0.00 61.69 58.71 3hb6 s THR 22 Cb -0.16 -1.84 0.10 0.00 1.34 0.00 0.00 72.50 71.94 3hb6 s THR 22 CO 0.10 -0.54 1.74 0.00 -0.54 0.00 0.00 174.62 175.38 3hb6 n ALA 23 N -0.01 3.98 0.00 3.99 0.00 0.57 -4.80 120.51 124.25 3hb6 n ALA 23 Ca -0.11 -3.98 0.00 0.00 0.00 0.00 0.00 53.44 49.35 3hb6 n ALA 23 Cb 0.59 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.61 3hb6 n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb6 n GLY 24 N 4.77 0.53 0.37 0.00 0.00 -1.26 -3.50 105.19 106.10 3hb6 n GLY 24 Ca 0.46 -1.78 0.12 0.00 0.00 0.00 0.00 46.02 44.82 3hb6 n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hb6 h PRO 25 N 0.00 0.73 -0.12 1.61 0.13 -2.00 -2.24 132.00 130.11 3hb6 h PRO 25 Ca 0.00 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 3hb6 h PRO 25 Cb 0.00 -0.17 -0.04 0.00 0.13 0.00 0.00 31.00 30.93 3hb6 h PRO 25 CO 0.00 0.49 -0.35 0.54 -0.23 0.00 0.00 178.00 178.45 3hb6 n ARG 26 N -4.62 1.67 -3.01 0.86 1.74 -1.26 -5.05 116.66 106.99 3hb6 n ARG 26 Ca 0.20 -3.26 -0.18 0.00 -0.77 0.00 0.00 57.85 53.84 3hb6 n ARG 26 Cb 0.50 -1.69 0.03 0.00 -1.02 0.00 0.00 32.46 30.28 3hb6 n ARG 26 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3hb6 s GLY 27 N -2.99 1.88 0.80 -0.13 0.00 -0.84 -5.05 107.32 100.97 3hb6 s GLY 27 Ca 0.40 -1.82 -0.11 0.00 0.00 0.00 0.00 44.72 43.20 3hb6 s GLY 27 CO -0.05 -1.54 1.11 -4.14 0.00 0.00 0.00 173.10 168.48 3hb6 s PRO 28 N -4.46 2.02 0.45 2.90 0.02 -1.26 -4.27 135.00 130.40 3hb6 s PRO 28 Ca 0.57 1.27 -0.22 0.00 0.02 0.00 0.00 61.00 62.64 3hb6 s PRO 28 Cb -0.09 -1.86 -0.08 0.00 0.02 0.00 0.00 34.50 32.49 3hb6 s PRO 28 CO 0.35 -1.84 1.07 -1.64 -0.33 0.00 0.00 177.00 174.62 3hb6 s MET 29 N -4.80 3.89 0.00 5.54 -1.94 -1.26 -0.32 119.30 120.42 3hb6 s MET 29 Ca 0.63 1.52 -0.03 0.00 -1.71 0.00 0.00 55.69 56.09 3hb6 s MET 29 Cb -0.19 -2.31 -0.04 0.00 2.01 0.00 0.00 34.83 34.30 3hb6 s MET 29 CO 0.56 -0.38 0.21 -0.51 -0.01 0.00 0.00 175.02 174.88 3hb6 s LEU 30 N -3.11 4.37 0.38 -0.03 1.43 -0.66 -4.85 118.68 116.21 3hb6 s LEU 30 Ca 0.63 0.40 0.14 0.00 -1.03 0.00 0.00 54.13 54.27 3hb6 s LEU 30 Cb -0.21 -2.66 0.75 0.00 0.03 0.00 0.00 46.19 44.10 3hb6 s LEU 30 CO 0.26 0.25 1.83 0.25 0.23 0.00 0.00 176.35 179.17 3hb6 h LEU 31 N 3.80 0.00 0.00 1.79 5.85 -1.97 -3.14 115.31 121.64 3hb6 h LEU 31 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 3hb6 h LEU 31 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 3hb6 h LEU 31 CO 0.69 0.37 0.00 0.00 -0.34 0.00 0.00 178.44 179.15 3hb6 n GLN 32 N -4.00 0.29 -2.53 1.25 10.64 -1.26 -4.28 117.38 117.50 3hb6 n GLN 32 Ca -0.02 0.00 -0.41 0.00 -1.83 0.00 0.00 57.00 54.74 3hb6 n GLN 32 Cb 0.41 -1.49 -0.01 0.00 -0.86 0.00 0.00 30.24 28.29 3hb6 n GLN 32 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 3hb6 s ASP 33 N -1.99 6.61 0.48 2.61 -1.08 -1.19 -4.77 116.67 117.34 3hb6 s ASP 33 Ca 0.14 -2.20 0.25 0.00 -0.52 0.00 0.00 52.55 50.22 3hb6 s ASP 33 Cb 0.06 -2.58 1.20 0.00 -1.46 0.00 0.00 42.92 40.14 3hb6 s ASP 33 CO 0.11 -1.40 1.96 -0.37 0.52 0.00 0.00 175.17 175.98 3hb6 h VAL 34 N 5.84 0.60 -0.20 1.11 -1.51 -1.92 -2.83 116.25 117.34 3hb6 h VAL 34 Ca 0.39 -0.82 -0.19 0.00 -1.23 0.00 0.00 66.70 64.84 3hb6 h VAL 34 Cb 0.90 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 3hb6 h VAL 34 CO 1.43 0.18 -0.65 -0.25 -1.23 0.00 0.00 177.57 177.05 3hb6 h TRP 35 N 0.00 0.96 -0.09 5.19 2.91 -1.96 -1.87 115.95 121.10 3hb6 h TRP 35 Ca -0.00 -0.38 0.01 0.00 1.13 0.00 0.00 58.89 59.65 3hb6 h TRP 35 Cb 0.52 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.00 3hb6 h TRP 35 CO 0.00 1.18 0.04 0.35 -1.03 0.00 0.00 178.44 178.98 3hb6 h PHE 36 N 0.54 0.07 -0.56 2.65 3.57 -1.89 0.14 116.94 121.45 3hb6 h PHE 36 Ca -0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 3hb6 h PHE 36 Cb 1.25 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.94 3hb6 h PHE 36 CO 0.07 0.04 0.36 -0.07 -2.23 0.00 0.00 178.31 176.48 3hb6 h LEU 37 N 0.09 0.65 -0.06 0.59 3.38 -1.50 -1.48 115.31 116.98 3hb6 h LEU 37 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3hb6 h LEU 37 Cb 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 3hb6 h LEU 37 CO -0.03 0.48 -0.01 -0.08 0.09 0.00 0.00 178.44 178.90 3hb6 h GLU 38 N 0.75 0.11 -0.10 1.13 4.81 -1.13 -1.09 114.58 119.06 3hb6 h GLU 38 Ca 0.20 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3hb6 h GLU 38 Cb -0.07 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 3hb6 h GLU 38 CO -0.04 0.42 0.06 -0.22 -0.73 0.00 0.00 179.01 178.50 3hb6 h LYS 39 N -0.21 0.13 -0.01 1.92 3.64 -0.68 -2.41 116.57 118.95 3hb6 h LYS 39 Ca 0.02 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 3hb6 h LYS 39 Cb 0.38 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 3hb6 h LYS 39 CO 0.00 0.08 -0.63 -0.07 -2.27 0.00 0.00 179.45 176.57 3hb6 h LEU 40 N 0.13 0.02 -0.47 5.20 -0.00 -1.31 -2.38 115.31 116.50 3hb6 h LEU 40 Ca 0.03 -0.01 -0.17 0.00 -0.00 0.00 0.00 57.88 57.73 3hb6 h LEU 40 Cb -0.02 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 40.63 3hb6 h LEU 40 CO -0.01 0.64 -0.56 0.00 -0.00 0.00 0.00 178.44 178.52 3hb6 h ALA 41 N 1.36 0.65 -0.10 1.53 0.00 -1.09 0.21 119.26 121.81 3hb6 h ALA 41 Ca -0.01 -0.52 -0.18 0.00 0.00 0.00 0.00 54.91 54.21 3hb6 h ALA 41 Cb 1.11 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 3hb6 h ALA 41 CO 0.08 0.69 -0.70 0.45 0.00 0.00 0.00 179.25 179.77 3hb6 h HIS 42 N 0.47 0.61 -0.32 0.00 3.86 -1.41 -3.13 115.15 115.22 3hb6 h HIS 42 Ca 0.01 -0.26 -0.02 0.00 -1.16 0.00 0.00 60.37 58.94 3hb6 h HIS 42 Cb 1.11 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.47 3hb6 h HIS 42 CO 0.05 1.01 0.12 0.35 0.86 0.00 0.00 177.93 180.32 3hb6 h PHE 43 N 0.32 0.50 0.00 2.45 3.57 -1.21 -2.38 116.94 120.19 3hb6 h PHE 43 Ca -0.03 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.43 3hb6 h PHE 43 Cb 1.27 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.86 3hb6 h PHE 43 CO 0.05 0.49 0.00 -0.25 -2.23 0.00 0.00 178.31 176.37 3hb6 n ASP 44 N -4.70 0.38 -0.45 0.41 8.00 0.04 -2.69 116.55 117.55 3hb6 n ASP 44 Ca -0.02 0.66 0.07 0.00 0.71 0.00 0.00 54.79 56.22 3hb6 n ASP 44 Cb 0.15 -0.72 0.18 0.00 -0.02 0.00 0.00 41.12 40.71 3hb6 n ASP 44 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3hb6 n ARG 45 N -2.00 1.42 0.09 -1.24 1.74 -0.90 -4.78 116.66 111.00 3hb6 n ARG 45 Ca -0.00 -3.00 -0.06 0.00 -0.77 0.00 0.00 57.85 54.02 3hb6 n ARG 45 Cb 0.05 -1.52 0.06 0.00 -1.02 0.00 0.00 32.46 30.03 3hb6 n ARG 45 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3hb6 h GLU 46 N 0.65 0.15 -6.32 5.56 5.08 -1.44 -3.45 114.58 114.82 3hb6 h GLU 46 Ca -0.01 -0.14 -0.54 0.00 -1.00 0.00 0.00 59.36 57.67 3hb6 h GLU 46 Cb 1.03 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 3hb6 h GLU 46 CO 0.00 0.83 0.20 0.08 -1.00 0.00 0.00 179.01 179.13 3hb6 s VAL 47 N -3.42 4.75 0.31 3.13 1.01 -1.26 -5.09 120.40 119.84 3hb6 s VAL 47 Ca -0.03 1.72 0.09 0.00 0.00 0.00 0.00 61.98 63.77 3hb6 s VAL 47 Cb 0.11 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 3hb6 s VAL 47 CO 0.81 0.32 0.01 0.27 0.00 0.00 0.00 175.10 176.50 3hb6 s ILE 48 N 0.18 2.97 0.48 2.22 -4.36 -1.26 -5.10 121.20 116.34 3hb6 s ILE 48 Ca 0.41 -1.94 -0.23 0.00 -0.26 0.00 0.00 60.65 58.62 3hb6 s ILE 48 Cb -0.21 -2.80 -0.07 0.00 1.25 0.00 0.00 42.46 40.64 3hb6 s ILE 48 CO 0.24 -0.28 1.32 -2.84 0.24 0.00 0.00 174.94 173.62 3hb6 s PRO 49 N -3.70 3.53 0.78 0.37 0.02 -1.26 -5.00 135.00 129.73 3hb6 s PRO 49 Ca 0.34 2.15 -0.12 0.00 0.02 0.00 0.00 61.00 63.39 3hb6 s PRO 49 Cb -0.03 -2.46 0.06 0.00 0.02 0.00 0.00 34.50 32.09 3hb6 s PRO 49 CO 0.20 -0.85 1.12 -1.83 -0.33 0.00 0.00 177.00 175.31 3hb6 s GLU 50 N -2.65 2.25 0.28 5.54 -1.05 -1.26 -4.94 118.70 116.87 3hb6 s GLU 50 Ca 0.65 0.38 -0.30 0.00 -0.15 0.00 0.00 54.97 55.56 3hb6 s GLU 50 Cb -0.38 -1.96 -0.10 0.00 -0.44 0.00 0.00 34.13 31.25 3hb6 s GLU 50 CO 0.47 -1.45 1.40 1.03 0.95 0.00 0.00 175.26 177.67 3hb6 s ARG 51 N -5.37 4.28 0.52 -4.83 0.52 -1.26 -4.89 118.95 107.92 3hb6 s ARG 51 Ca 0.60 2.29 0.18 0.00 -0.52 0.00 0.00 55.73 58.28 3hb6 s ARG 51 Cb -0.12 -3.09 1.33 0.00 0.52 0.00 0.00 34.95 33.58 3hb6 s ARG 51 CO 0.52 -0.36 2.15 -0.09 0.02 0.00 0.00 175.30 177.53 3hb6 h ARG 52 N 4.51 0.00 -3.95 3.54 9.65 -1.98 -3.37 114.38 122.78 3hb6 h ARG 52 Ca -0.47 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.24 3hb6 h ARG 52 Cb 1.22 0.00 -0.22 0.00 -1.39 0.00 0.00 29.97 29.58 3hb6 h ARG 52 CO 0.74 0.02 -0.70 -1.64 2.80 0.00 0.00 179.97 181.19 3hb6 s MET 53 N -4.96 0.28 -1.34 0.20 -1.94 -1.26 -4.87 119.30 105.41 3hb6 s MET 53 Ca -0.05 -0.55 -0.08 0.00 -1.71 0.00 0.00 55.69 53.29 3hb6 s MET 53 Cb 0.17 0.10 0.01 0.00 2.01 0.00 0.00 34.83 37.12 3hb6 s MET 53 CO 0.65 -0.05 1.17 1.19 -0.01 0.00 0.00 175.02 177.98 3hb6 n PHE 54 N 1.73 -2.83 -0.03 -0.03 3.72 -0.89 -4.94 117.46 114.19 3hb6 n PHE 54 Ca -0.23 1.01 -0.04 0.00 -0.05 0.00 0.00 57.45 58.14 3hb6 n PHE 54 Cb 0.55 -5.02 0.19 0.00 -0.94 0.00 0.00 39.48 34.27 3hb6 n PHE 54 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hb6 h ALA 55 N 1.00 1.11 -2.46 4.37 0.00 -1.72 -3.42 119.26 118.14 3hb6 h ALA 55 Ca -0.57 -0.31 -0.62 0.00 0.00 0.00 0.00 54.91 53.42 3hb6 h ALA 55 Cb 1.36 -0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.89 3hb6 h ALA 55 CO 0.55 0.55 0.12 0.21 0.00 0.00 0.00 179.25 180.68 3hb6 s LYS 56 N -4.70 3.99 0.32 0.00 2.47 -1.23 -4.42 119.74 116.18 3hb6 s LYS 56 Ca -0.08 0.37 -0.17 0.00 -1.56 0.00 0.00 55.97 54.53 3hb6 s LYS 56 Cb 0.14 -3.69 0.03 0.00 -1.46 0.00 0.00 37.83 32.85 3hb6 s LYS 56 CO 0.80 -0.48 0.71 0.20 0.16 0.00 0.00 175.35 176.74 3hb6 s GLY 57 N 1.57 0.23 0.02 5.54 0.00 -1.26 -2.05 107.32 111.37 3hb6 s GLY 57 Ca 0.25 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.37 3hb6 s GLY 57 CO 0.10 -0.27 -0.03 -0.56 0.00 0.00 0.00 173.10 172.34 3hb6 s SER 58 N -3.01 0.30 0.18 1.64 0.01 0.43 -4.98 113.70 108.27 3hb6 s SER 58 Ca 0.15 -0.40 -0.00 0.00 1.31 0.00 0.00 55.95 57.00 3hb6 s SER 58 Cb -0.05 0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.21 3hb6 s SER 58 CO 0.10 -0.22 0.08 -0.83 0.41 0.00 0.00 173.24 172.78 3hb6 s GLY 59 N -1.17 1.29 -0.08 3.44 0.00 -1.26 -0.26 107.32 109.27 3hb6 s GLY 59 Ca -0.12 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 42.67 3hb6 s GLY 59 CO -0.01 -1.43 0.80 0.00 0.00 0.00 0.00 173.10 172.47 3hb6 s ALA 60 N -4.00 -1.83 0.20 3.20 0.00 -0.42 -4.55 121.76 114.36 3hb6 s ALA 60 Ca 0.32 1.39 -0.10 0.00 0.00 0.00 0.00 51.96 53.57 3hb6 s ALA 60 Cb 0.07 -0.23 -0.07 0.00 0.00 0.00 0.00 23.12 22.89 3hb6 s ALA 60 CO 0.07 -0.37 0.52 -0.06 0.00 0.00 0.00 175.76 175.92 3hb6 s PHE 61 N -1.27 3.47 0.00 0.00 0.08 0.75 -0.97 117.98 120.04 3hb6 s PHE 61 Ca -0.07 0.85 0.00 0.00 0.12 0.00 0.00 56.93 57.83 3hb6 s PHE 61 Cb -0.00 -2.23 0.00 0.00 -0.57 0.00 0.00 43.02 40.22 3hb6 s PHE 61 CO 0.06 0.33 0.00 0.41 -0.10 0.00 0.00 175.22 175.92 3hb6 n GLY 62 N 0.09 2.66 2.96 4.36 0.00 0.32 -1.42 105.19 114.17 3hb6 n GLY 62 Ca -0.01 -1.08 -0.18 0.00 0.00 0.00 0.00 46.02 44.75 3hb6 n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hb6 s THR 63 N -2.75 0.55 -0.13 2.61 2.01 -0.60 -0.19 115.64 117.14 3hb6 s THR 63 Ca 0.00 -0.25 -0.05 0.00 0.31 0.00 0.00 61.69 61.70 3hb6 s THR 63 Cb 0.00 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 3hb6 s THR 63 CO 0.00 0.18 0.05 0.12 -0.69 0.00 0.00 174.62 174.28 3hb6 s PHE 64 N 0.14 3.28 -0.05 4.92 5.36 0.11 -1.62 117.98 130.11 3hb6 s PHE 64 Ca -0.02 0.19 0.03 0.00 -0.96 0.00 0.00 56.93 56.17 3hb6 s PHE 64 Cb -0.06 -1.94 0.01 0.00 -0.34 0.00 0.00 43.02 40.69 3hb6 s PHE 64 CO -0.00 0.38 -0.12 0.99 -1.46 0.00 0.00 175.22 175.01 3hb6 s THR 65 N -0.39 1.11 -0.03 0.12 2.01 0.47 -0.45 115.64 118.48 3hb6 s THR 65 Ca 0.09 -0.49 -0.25 0.00 0.31 0.00 0.00 61.69 61.35 3hb6 s THR 65 Cb -0.12 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 3hb6 s THR 65 CO 0.02 0.34 0.77 -0.69 -0.69 0.00 0.00 174.62 174.37 3hb6 s VAL 66 N 0.49 4.96 -0.07 3.82 1.01 -0.94 -1.00 120.40 128.68 3hb6 s VAL 66 Ca -0.11 1.60 0.09 0.00 0.00 0.00 0.00 61.98 63.56 3hb6 s VAL 66 Cb -0.14 -4.11 -0.13 0.00 0.00 0.00 0.00 36.38 32.00 3hb6 s VAL 66 CO 0.03 0.25 0.09 0.35 0.00 0.00 0.00 175.10 175.82 3hb6 n THR 67 N 3.65 0.47 -4.28 3.92 -2.24 0.02 -0.21 114.28 115.61 3hb6 n THR 67 Ca 0.00 -0.36 -0.20 0.00 -2.27 0.00 0.00 64.05 61.23 3hb6 n THR 67 Cb 0.51 -0.47 -0.11 0.00 -2.10 0.00 0.00 70.33 68.16 3hb6 n THR 67 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3hb6 s HIS 68 N -2.36 1.58 -0.41 4.78 3.76 -0.09 -4.85 115.29 117.70 3hb6 s HIS 68 Ca -0.04 -0.52 -0.23 0.00 -0.15 0.00 0.00 55.06 54.12 3hb6 s HIS 68 Cb 0.04 -0.81 0.02 0.00 1.11 0.00 0.00 32.58 32.94 3hb6 s HIS 68 CO 0.40 0.22 0.75 0.34 -0.85 0.00 0.00 174.74 175.60 3hb6 s ASP 69 N -2.54 6.45 -0.14 1.40 -1.08 -1.26 -4.80 116.67 114.70 3hb6 s ASP 69 Ca 0.12 0.05 0.15 0.00 -0.52 0.00 0.00 52.55 52.35 3hb6 s ASP 69 Cb -0.05 -2.37 0.32 0.00 -1.46 0.00 0.00 42.92 39.36 3hb6 s ASP 69 CO 0.04 -0.80 1.16 2.30 0.52 0.00 0.00 175.17 178.40 3hb6 n ILE 70 N 5.93 1.72 0.32 4.11 -5.35 -1.26 -4.81 119.36 120.02 3hb6 n ILE 70 Ca 0.02 -2.35 0.21 0.00 -0.27 0.00 0.00 62.75 60.36 3hb6 n ILE 70 Cb 0.48 -0.09 1.09 0.00 -1.74 0.00 0.00 39.64 39.38 3hb6 n ILE 70 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3hb6 h THR 71 N 1.46 0.02 0.00 7.28 1.35 -1.84 -1.12 112.91 120.07 3hb6 h THR 71 Ca -0.02 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 3hb6 h THR 71 Cb 1.10 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 3hb6 h THR 71 CO 0.01 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 175.35 3hb6 h LYS 72 N 0.00 0.00 0.00 4.72 2.10 -2.00 -3.20 116.57 118.19 3hb6 h LYS 72 Ca -0.00 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.36 3hb6 h LYS 72 Cb 0.12 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.40 3hb6 h LYS 72 CO 0.00 0.00 -2.09 0.66 -2.00 0.00 0.00 179.45 176.02 3hb6 n TYR 73 N -2.61 0.00 -3.93 0.07 4.01 -0.47 -4.80 117.16 109.42 3hb6 n TYR 73 Ca 0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.65 3hb6 n TYR 73 Cb 0.31 -0.77 -0.13 0.00 -0.31 0.00 0.00 39.34 38.45 3hb6 n TYR 73 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3hb6 s THR 74 N -2.38 0.08 -2.47 -0.72 -1.32 -0.92 -3.17 115.64 104.74 3hb6 s THR 74 Ca -0.14 -0.34 0.23 0.00 -1.21 0.00 0.00 61.69 60.22 3hb6 s THR 74 Cb 0.05 -0.14 0.42 0.00 -1.51 0.00 0.00 72.50 71.33 3hb6 s THR 74 CO 0.58 -0.16 1.49 -2.11 -2.21 0.00 0.00 174.62 172.21 3hb6 n ARG 75 N 2.54 2.03 -1.68 7.08 1.85 -0.26 -4.29 116.66 123.94 3hb6 n ARG 75 Ca -0.16 -1.53 -0.49 0.00 -1.00 0.00 0.00 57.85 54.67 3hb6 n ARG 75 Cb 0.58 -1.45 -0.05 0.00 -1.05 0.00 0.00 32.46 30.49 3hb6 n ARG 75 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3hb6 n ALA 76 N 0.78 0.83 0.29 2.89 0.00 -1.20 -4.81 120.51 119.29 3hb6 n ALA 76 Ca 0.17 0.34 0.17 0.00 0.00 0.00 0.00 53.44 54.13 3hb6 n ALA 76 Cb 0.45 -2.42 0.97 0.00 0.00 0.00 0.00 19.45 18.45 3hb6 n ALA 76 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3hb6 h LYS 77 N 8.06 0.00 0.00 0.00 1.79 -1.93 -0.99 116.57 123.50 3hb6 h LYS 77 Ca -0.47 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 57.93 3hb6 h LYS 77 Cb 1.27 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.91 3hb6 h LYS 77 CO 0.93 0.00 -0.33 0.97 -1.08 0.00 0.00 179.45 179.94 3hb6 h ILE 78 N 0.00 0.97 -0.02 1.86 2.10 -1.94 -2.96 117.51 117.51 3hb6 h ILE 78 Ca 0.02 -1.24 0.00 0.00 1.08 0.00 0.00 64.86 64.72 3hb6 h ILE 78 Cb 0.13 1.72 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 3hb6 h ILE 78 CO -0.00 0.32 0.00 0.49 -1.08 0.00 0.00 178.15 177.88 3hb6 n PHE 79 N -3.77 0.00 -0.08 2.19 3.72 -0.41 -4.74 117.46 114.37 3hb6 n PHE 79 Ca -0.01 -0.00 0.25 0.00 -0.05 0.00 0.00 57.45 57.64 3hb6 n PHE 79 Cb 0.42 -0.00 0.72 0.00 -0.94 0.00 0.00 39.48 39.67 3hb6 n PHE 79 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3hb6 h SER 80 N 3.40 0.00 -4.99 4.37 4.64 -1.28 -3.43 113.55 116.26 3hb6 h SER 80 Ca 0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 3hb6 h SER 80 Cb 0.72 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.60 3hb6 h SER 80 CO 0.00 0.00 -0.65 -1.61 -0.87 0.00 0.00 176.83 173.70 3hb6 s GLU 81 N -4.92 0.36 0.05 4.77 2.02 -1.26 -4.99 118.70 114.72 3hb6 s GLU 81 Ca -0.05 -0.58 -0.30 0.00 0.02 0.00 0.00 54.97 54.06 3hb6 s GLU 81 Cb 0.20 0.13 -0.05 0.00 0.10 0.00 0.00 34.13 34.52 3hb6 s GLU 81 CO 0.72 -0.07 1.07 0.08 0.02 0.00 0.00 175.26 177.08 3hb6 s VAL 82 N -1.51 4.46 0.00 2.63 1.01 -1.26 -2.99 120.40 122.74 3hb6 s VAL 82 Ca -0.15 1.81 0.00 0.00 0.00 0.00 0.00 61.98 63.64 3hb6 s VAL 82 Cb -0.09 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3hb6 s VAL 82 CO -0.01 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.87 3hb6 n GLY 83 N 2.89 1.25 3.69 4.51 0.00 0.70 -5.00 105.19 113.23 3hb6 n GLY 83 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3hb6 n GLY 83 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hb6 s LYS 84 N -0.81 4.15 -0.15 1.61 2.20 -1.16 -4.66 119.74 120.92 3hb6 s LYS 84 Ca 0.00 2.53 -0.07 0.00 -0.36 0.00 0.00 55.97 58.06 3hb6 s LYS 84 Cb 0.00 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 3hb6 s LYS 84 CO 0.00 -0.80 0.10 0.15 -0.36 0.00 0.00 175.35 174.43 3hb6 s LYS 85 N 2.56 3.73 -0.06 4.03 1.02 -1.26 -2.20 119.74 127.56 3hb6 s LYS 85 Ca 0.78 -0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.54 3hb6 s LYS 85 Cb -0.45 -3.20 0.02 0.00 -0.52 0.00 0.00 37.83 33.68 3hb6 s LYS 85 CO 0.35 0.50 -0.10 0.99 -0.92 0.00 0.00 175.35 176.17 3hb6 s THR 86 N -0.24 0.95 0.36 2.17 2.01 0.40 -4.97 115.64 116.32 3hb6 s THR 86 Ca 0.09 -0.36 -0.27 0.00 0.31 0.00 0.00 61.69 61.47 3hb6 s THR 86 Cb -0.12 -0.89 -0.09 0.00 0.01 0.00 0.00 72.50 71.41 3hb6 s THR 86 CO 0.01 0.32 1.13 -1.61 -0.69 0.00 0.00 174.62 173.78 3hb6 s GLU 87 N 0.78 4.28 0.25 4.92 0.41 -1.26 0.06 118.70 128.13 3hb6 s GLU 87 Ca -0.13 1.79 -0.04 0.00 -0.41 0.00 0.00 54.97 56.18 3hb6 s GLU 87 Cb -0.15 -2.84 -0.02 0.00 -1.78 0.00 0.00 34.13 29.34 3hb6 s GLU 87 CO 0.02 -0.11 0.29 0.00 -0.49 0.00 0.00 175.26 174.98 3hb6 s MET 88 N -2.04 1.46 0.02 1.61 0.23 0.73 -1.25 119.30 120.05 3hb6 s MET 88 Ca 0.53 -1.58 0.01 0.00 -1.03 0.00 0.00 55.69 53.61 3hb6 s MET 88 Cb -0.30 0.36 -0.01 0.00 -1.53 0.00 0.00 34.83 33.34 3hb6 s MET 88 CO 0.38 -0.55 -0.04 0.12 -2.03 0.00 0.00 175.02 172.91 3hb6 s PHE 89 N -3.89 0.31 0.00 3.16 5.36 0.16 -0.52 117.98 122.56 3hb6 s PHE 89 Ca 0.33 -0.35 0.02 0.00 -0.96 0.00 0.00 56.93 55.97 3hb6 s PHE 89 Cb 0.03 -0.20 -0.01 0.00 -0.34 0.00 0.00 43.02 42.50 3hb6 s PHE 89 CO 0.14 -0.10 -0.06 0.00 -1.46 0.00 0.00 175.22 173.74 3hb6 s ALA 90 N -0.95 0.48 -0.09 11.12 0.00 -0.14 0.06 121.76 132.25 3hb6 s ALA 90 Ca -0.09 -0.32 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 3hb6 s ALA 90 Cb -0.07 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.98 3hb6 s ALA 90 CO -0.00 0.09 -0.05 0.50 0.00 0.00 0.00 175.76 176.30 3hb6 s ARG 91 N -0.36 1.16 0.07 0.00 3.52 -0.05 -1.30 118.95 122.00 3hb6 s ARG 91 Ca 0.00 -0.13 0.04 0.00 -0.13 0.00 0.00 55.73 55.51 3hb6 s ARG 91 Cb -0.03 -1.28 -0.04 0.00 -1.56 0.00 0.00 34.95 32.03 3hb6 s ARG 91 CO -0.00 -0.23 0.01 -0.06 -0.81 0.00 0.00 175.30 174.21 3hb6 s PHE 92 N 1.61 3.02 0.33 5.12 0.40 0.64 -1.72 117.98 127.38 3hb6 s PHE 92 Ca 0.01 0.00 -0.13 0.00 -0.60 0.00 0.00 56.93 56.21 3hb6 s PHE 92 Cb -0.13 -1.57 0.03 0.00 0.51 0.00 0.00 43.02 41.86 3hb6 s PHE 92 CO -0.05 0.48 0.65 -1.54 0.70 0.00 0.00 175.22 175.46 3hb6 s SER 93 N -2.18 0.13 0.31 1.36 1.04 -1.04 -0.43 113.70 112.88 3hb6 s SER 93 Ca 0.25 -1.07 0.05 0.00 0.48 0.00 0.00 55.95 55.66 3hb6 s SER 93 Cb -0.12 0.74 0.05 0.00 0.10 0.00 0.00 66.02 66.79 3hb6 s SER 93 CO 0.17 -1.43 0.42 0.35 0.98 0.00 0.00 173.24 173.73 3hb6 n THR 94 N -0.50 0.00 -0.04 2.02 -2.24 -0.87 -0.19 114.28 112.47 3hb6 n THR 94 Ca -0.04 -1.04 -0.06 0.00 -2.27 0.00 0.00 64.05 60.64 3hb6 n THR 94 Cb 0.60 -0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 3hb6 n THR 94 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3hb6 n VAL 95 N -1.65 1.39 0.05 2.28 0.31 -1.24 -4.00 118.33 115.46 3hb6 n VAL 95 Ca 0.08 0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 64.53 3hb6 n VAL 95 Cb 0.32 -2.05 -0.01 0.00 -0.91 0.00 0.00 33.84 31.19 3hb6 n VAL 95 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hb6 h ALA 96 N -0.61 0.47 -2.92 3.52 0.00 -1.92 -2.36 119.26 115.44 3hb6 h ALA 96 Ca -0.00 -0.64 -0.54 0.00 0.00 0.00 0.00 54.91 53.73 3hb6 h ALA 96 Cb 0.62 -0.04 0.11 0.00 0.00 0.00 0.00 17.79 18.47 3hb6 h ALA 96 CO -0.00 0.77 0.63 0.20 0.00 0.00 0.00 179.25 180.84 3hb6 s GLY 97 N -4.32 2.90 0.86 0.00 0.00 -1.26 -4.82 107.32 100.68 3hb6 s GLY 97 Ca -0.06 1.30 -0.13 0.00 0.00 0.00 0.00 44.72 45.83 3hb6 s GLY 97 CO 0.86 1.86 1.22 -0.54 0.00 0.00 0.00 173.10 176.50 3hb6 s GLU 98 N -2.52 1.45 0.11 2.90 8.01 -1.26 -3.49 118.70 123.90 3hb6 s GLU 98 Ca 0.63 -0.17 0.05 0.00 0.01 0.00 0.00 54.97 55.49 3hb6 s GLU 98 Cb -0.39 -1.94 0.27 0.00 -4.31 0.00 0.00 34.13 27.76 3hb6 s GLU 98 CO 0.49 -1.89 1.01 2.89 0.01 0.00 0.00 175.26 177.78 3hb6 n ARG 99 N -3.45 0.03 -0.02 1.61 1.85 -1.26 -1.13 116.66 114.29 3hb6 n ARG 99 Ca 0.11 0.42 0.01 0.00 -1.00 0.00 0.00 57.85 57.39 3hb6 n ARG 99 Cb 0.60 -1.81 0.02 0.00 -1.05 0.00 0.00 32.46 30.22 3hb6 n ARG 99 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3hb6 n GLY 100 N -1.31 0.39 3.71 2.89 0.00 -1.26 -4.84 105.19 104.77 3hb6 n GLY 100 Ca -0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 3hb6 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb6 s ALA 101 N -0.52 1.56 0.22 4.61 0.00 -0.29 -4.97 121.76 122.37 3hb6 s ALA 101 Ca 0.04 0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 3hb6 s ALA 101 Cb 0.02 -3.22 -0.11 0.00 0.00 0.00 0.00 23.12 19.82 3hb6 s ALA 101 CO 0.03 -2.36 1.56 0.00 0.00 0.00 0.00 175.76 175.00 3hb6 s ALA 102 N -2.89 3.76 0.15 0.00 0.00 -1.26 -4.86 121.76 116.66 3hb6 s ALA 102 Ca 0.63 1.43 -0.10 0.00 0.00 0.00 0.00 51.96 53.93 3hb6 s ALA 102 Cb -0.18 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 3hb6 s ALA 102 CO 0.57 -0.83 1.47 -0.44 0.00 0.00 0.00 175.76 176.53 3hb6 h ASP 103 N 5.97 0.96 -1.04 0.00 3.32 -1.51 -3.35 116.42 120.77 3hb6 h ASP 103 Ca -0.44 -0.46 -0.74 0.00 0.02 0.00 0.00 57.03 55.42 3hb6 h ASP 103 Cb 1.21 -0.27 -0.11 0.00 0.22 0.00 0.00 39.33 40.38 3hb6 h ASP 103 CO 0.86 1.25 2.54 0.00 -1.72 0.00 0.00 179.24 182.17 3hb6 n ALA 104 N -2.55 6.69 -2.68 3.45 0.00 -1.26 -4.92 120.51 119.25 3hb6 n ALA 104 Ca -0.03 -4.05 -0.24 0.00 0.00 0.00 0.00 53.44 49.13 3hb6 n ALA 104 Cb 0.56 -2.88 -0.07 0.00 0.00 0.00 0.00 19.45 17.06 3hb6 n ALA 104 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hb6 s GLU 105 N -0.51 2.43 -0.51 0.00 2.02 -1.26 -4.82 118.70 116.06 3hb6 s GLU 105 Ca 0.54 -1.27 -0.28 0.00 0.02 0.00 0.00 54.97 53.98 3hb6 s GLU 105 Cb 0.17 -2.28 0.02 0.00 0.10 0.00 0.00 34.13 32.14 3hb6 s GLU 105 CO -0.08 0.40 1.34 0.50 0.02 0.00 0.00 175.26 177.44 3hb6 s ARG 106 N -3.49 3.47 0.19 1.61 3.52 -1.26 -4.75 118.95 118.23 3hb6 s ARG 106 Ca 0.30 0.57 -0.23 0.00 -0.13 0.00 0.00 55.73 56.24 3hb6 s ARG 106 Cb -0.07 -4.05 0.06 0.00 -1.56 0.00 0.00 34.95 29.33 3hb6 s ARG 106 CO 0.20 -1.71 0.94 0.34 -0.81 0.00 0.00 175.30 174.26 3hb6 s ASP 107 N 3.78 -0.14 0.45 -2.12 -1.08 -0.75 -5.02 116.67 111.78 3hb6 s ASP 107 Ca 0.53 -0.52 -0.20 0.00 -0.52 0.00 0.00 52.55 51.83 3hb6 s ASP 107 Cb -0.10 0.54 -0.10 0.00 -1.46 0.00 0.00 42.92 41.79 3hb6 s ASP 107 CO 0.28 -1.01 0.96 -0.63 0.52 0.00 0.00 175.17 175.29 3hb6 s ILE 108 N -3.10 4.35 -0.17 4.11 1.01 -1.26 -4.58 121.20 121.55 3hb6 s ILE 108 Ca 0.14 1.41 -0.04 0.00 0.00 0.00 0.00 60.65 62.16 3hb6 s ILE 108 Cb -0.02 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 3hb6 s ILE 108 CO 0.04 -0.37 -0.03 -0.13 0.00 0.00 0.00 174.94 174.46 3hb6 s ARG 109 N -3.32 3.63 0.35 2.79 1.81 -1.26 -3.68 118.95 119.28 3hb6 s ARG 109 Ca 0.62 -0.53 -0.27 0.00 -1.72 0.00 0.00 55.73 53.83 3hb6 s ARG 109 Cb -0.10 -2.97 -0.09 0.00 -0.45 0.00 0.00 34.95 31.33 3hb6 s ARG 109 CO 0.16 0.14 1.23 0.20 -0.68 0.00 0.00 175.30 176.35 3hb6 s GLY 110 N 0.65 2.96 -0.48 -3.53 0.00 0.74 -0.62 107.32 107.03 3hb6 s GLY 110 Ca -0.02 1.10 0.05 0.00 0.00 0.00 0.00 44.72 45.86 3hb6 s GLY 110 CO 0.02 1.69 0.44 0.33 0.00 0.00 0.00 173.10 175.59 3hb6 n PHE 111 N 0.55 0.35 -3.53 1.90 -0.00 0.17 -2.51 117.46 114.39 3hb6 n PHE 111 Ca 0.02 -3.62 -0.38 0.00 -0.00 0.00 0.00 57.45 53.47 3hb6 n PHE 111 Cb 0.44 -0.10 -0.09 0.00 -0.00 0.00 0.00 39.48 39.73 3hb6 n PHE 111 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3hb6 s ALA 112 N -0.69 3.58 -0.03 3.13 0.00 -0.70 -0.84 121.76 126.21 3hb6 s ALA 112 Ca 0.32 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.53 3hb6 s ALA 112 Cb 0.06 -2.50 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 3hb6 s ALA 112 CO -0.16 -0.37 -0.26 -0.51 0.00 0.00 0.00 175.76 174.46 3hb6 s LEU 113 N 1.43 2.06 -0.22 0.00 1.43 0.19 -0.87 118.68 122.70 3hb6 s LEU 113 Ca 0.12 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 3hb6 s LEU 113 Cb -0.15 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.78 3hb6 s LEU 113 CO 0.07 0.31 -0.08 -0.75 0.23 0.00 0.00 176.35 176.14 3hb6 s LYS 114 N -0.55 1.81 -0.27 1.70 2.20 0.11 -0.34 119.74 124.39 3hb6 s LYS 114 Ca 0.08 -0.95 -0.10 0.00 -0.36 0.00 0.00 55.97 54.65 3hb6 s LYS 114 Cb -0.10 -2.53 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 3hb6 s LYS 114 CO -0.00 -0.53 0.15 -0.06 -0.36 0.00 0.00 175.35 174.55 3hb6 s PHE 115 N 1.38 3.19 -1.29 4.03 0.08 0.38 -0.67 117.98 125.08 3hb6 s PHE 115 Ca -0.04 -0.03 -0.14 0.00 0.12 0.00 0.00 56.93 56.84 3hb6 s PHE 115 Cb -0.18 -2.32 0.12 0.00 -0.57 0.00 0.00 43.02 40.07 3hb6 s PHE 115 CO -0.07 -0.19 1.74 0.66 -0.10 0.00 0.00 175.22 177.26 3hb6 n TYR 116 N 4.91 4.21 -1.87 0.36 4.01 -0.38 -1.10 117.16 127.30 3hb6 n TYR 116 Ca -0.15 -3.03 -0.30 0.00 -0.16 0.00 0.00 57.90 54.26 3hb6 n TYR 116 Cb 0.52 -2.31 0.06 0.00 -0.31 0.00 0.00 39.34 37.30 3hb6 n TYR 116 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3hb6 s THR 117 N 2.26 2.93 -1.68 -0.72 -4.23 -0.92 -4.47 115.64 108.81 3hb6 s THR 117 Ca 0.46 0.30 0.21 0.00 -1.18 0.00 0.00 61.69 61.48 3hb6 s THR 117 Cb 0.04 -3.29 0.48 0.00 1.34 0.00 0.00 72.50 71.08 3hb6 s THR 117 CO 0.01 -0.40 1.68 -1.84 -0.54 0.00 0.00 174.62 173.53 3hb6 n GLU 118 N -3.14 0.47 -0.84 3.99 0.28 -1.26 -2.55 120.64 117.58 3hb6 n GLU 118 Ca 0.07 0.05 0.05 0.00 -0.16 0.00 0.00 57.16 57.18 3hb6 n GLU 118 Cb 0.58 -1.50 0.16 0.00 1.43 0.00 0.00 31.44 32.11 3hb6 n GLU 118 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3hb6 n GLU 119 N -1.16 1.14 0.00 3.44 1.02 -1.26 -4.69 120.64 119.13 3hb6 n GLU 119 Ca 0.13 -2.93 0.00 0.00 -0.02 0.00 0.00 57.16 54.34 3hb6 n GLU 119 Cb 0.13 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 3hb6 n GLU 119 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hb6 n GLY 120 N -0.67 1.93 3.65 0.62 0.00 -1.06 -4.58 105.19 105.08 3hb6 n GLY 120 Ca 0.15 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 3hb6 n GLY 120 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hb6 s ASN 121 N 0.00 6.88 -0.31 1.61 0.02 -1.26 -2.18 114.94 119.70 3hb6 s ASN 121 Ca 0.00 1.09 -0.11 0.00 -1.02 0.00 0.00 52.86 52.82 3hb6 s ASN 121 Cb 0.00 -2.44 -0.02 0.00 0.02 0.00 0.00 41.25 38.81 3hb6 s ASN 121 CO 0.00 -0.48 0.18 0.86 0.02 0.00 0.00 177.10 177.69 3hb6 s TRP 122 N 2.60 3.20 -0.26 2.20 -0.00 -0.25 -4.11 118.94 122.31 3hb6 s TRP 122 Ca 0.36 -0.32 -0.11 0.00 -0.00 0.00 0.00 56.10 56.03 3hb6 s TRP 122 Cb -0.16 -2.39 -0.05 0.00 -0.00 0.00 0.00 33.47 30.87 3hb6 s TRP 122 CO 0.09 -0.37 0.18 -0.51 -0.00 0.00 0.00 176.95 176.34 3hb6 s ASP 123 N 1.67 6.07 -0.65 5.86 1.01 -0.01 -0.47 116.67 130.15 3hb6 s ASP 123 Ca 0.06 0.05 -0.07 0.00 0.71 0.00 0.00 52.55 53.29 3hb6 s ASP 123 Cb -0.17 -2.12 0.17 0.00 1.01 0.00 0.00 42.92 41.81 3hb6 s ASP 123 CO 0.08 -0.00 0.51 -0.32 0.21 0.00 0.00 175.17 175.65 3hb6 s MET 124 N 1.47 2.83 -1.07 8.23 1.75 0.53 -4.62 119.30 128.42 3hb6 s MET 124 Ca 0.07 -2.35 -0.15 0.00 -1.25 0.00 0.00 55.69 52.01 3hb6 s MET 124 Cb -0.15 -3.96 0.17 0.00 2.84 0.00 0.00 34.83 33.73 3hb6 s MET 124 CO 0.08 -1.21 1.24 0.08 -0.65 0.00 0.00 175.02 174.57 3hb6 s VAL 125 N 0.30 5.08 0.01 10.11 1.01 -1.26 -0.64 120.40 135.00 3hb6 s VAL 125 Ca 0.15 -2.35 0.00 0.00 0.00 0.00 0.00 61.98 59.78 3hb6 s VAL 125 Cb -0.19 -4.80 0.00 0.00 0.00 0.00 0.00 36.38 31.40 3hb6 s VAL 125 CO -0.04 -1.49 0.01 0.61 0.00 0.00 0.00 175.10 174.18 3hb6 n GLY 126 N 4.41 2.62 3.36 4.51 0.00 -0.02 -4.94 105.19 115.14 3hb6 n GLY 126 Ca 0.29 -2.16 -0.19 0.00 0.00 0.00 0.00 46.02 43.97 3hb6 n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hb6 s ASN 127 N -1.04 1.66 -0.01 1.61 0.01 -0.92 -0.65 114.94 115.59 3hb6 s ASN 127 Ca 0.01 -1.48 0.06 0.00 -0.71 0.00 0.00 52.86 50.73 3hb6 s ASN 127 Cb -0.00 0.25 0.19 0.00 0.41 0.00 0.00 41.25 42.10 3hb6 s ASN 127 CO 0.00 -0.79 1.08 -0.46 -1.51 0.00 0.00 177.10 175.42 3hb6 n ASN 128 N -0.76 1.35 -4.11 -1.22 6.94 0.21 -1.09 115.26 116.58 3hb6 n ASN 128 Ca -0.01 -2.06 -0.20 0.00 -0.02 0.00 0.00 54.58 52.30 3hb6 n ASN 128 Cb 0.66 -0.23 -0.14 0.00 -2.36 0.00 0.00 39.78 37.71 3hb6 n ASN 128 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 3hb6 s THR 129 N -1.67 1.01 -0.99 5.53 -1.32 -1.26 -4.60 115.64 112.33 3hb6 s THR 129 Ca 0.14 -0.82 0.24 0.00 -1.21 0.00 0.00 61.69 60.03 3hb6 s THR 129 Cb 0.08 -0.90 0.20 0.00 -1.51 0.00 0.00 72.50 70.37 3hb6 s THR 129 CO 0.08 0.07 1.76 -0.81 -2.21 0.00 0.00 174.62 173.51 3hb6 n PRO 130 N 2.19 0.01 -2.81 7.08 -0.04 -1.26 -4.54 135.00 135.63 3hb6 n PRO 130 Ca -0.17 0.10 -0.09 0.00 -0.04 0.00 0.00 63.50 63.30 3hb6 n PRO 130 Cb 0.55 -1.51 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 3hb6 n PRO 130 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3hb6 n VAL 131 N -1.52 0.00 -3.95 0.52 0.24 -1.26 -4.38 118.33 107.98 3hb6 n VAL 131 Ca 0.06 -0.79 -0.09 0.00 -2.04 0.00 0.00 64.34 61.48 3hb6 n VAL 131 Cb 0.28 0.26 -0.04 0.00 -1.47 0.00 0.00 33.84 32.87 3hb6 n VAL 131 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3hb6 s PHE 132 N -1.97 0.22 0.32 6.34 5.36 -1.08 -5.00 117.98 122.17 3hb6 s PHE 132 Ca 0.06 -0.61 0.06 0.00 -0.96 0.00 0.00 56.93 55.47 3hb6 s PHE 132 Cb 0.00 0.36 0.54 0.00 -0.34 0.00 0.00 43.02 43.58 3hb6 s PHE 132 CO 0.04 -1.10 1.77 1.88 -1.46 0.00 0.00 175.22 176.36 3hb6 h TYR 133 N 2.16 0.35 -2.21 10.12 0.05 -1.90 -3.39 116.97 122.16 3hb6 h TYR 133 Ca -0.24 -0.07 -0.55 0.00 0.05 0.00 0.00 58.73 57.91 3hb6 h TYR 133 Cb 1.25 -0.09 -0.09 0.00 1.01 0.00 0.00 36.73 38.81 3hb6 h TYR 133 CO 0.49 0.56 -0.63 -0.51 -1.05 0.00 0.00 178.16 177.02 3hb6 s LEU 134 N -8.54 3.26 -0.02 3.88 1.43 -1.26 -3.03 118.68 114.40 3hb6 s LEU 134 Ca -0.05 -0.60 0.12 0.00 -1.03 0.00 0.00 54.13 52.57 3hb6 s LEU 134 Cb 0.14 -1.78 -0.19 0.00 0.03 0.00 0.00 46.19 44.39 3hb6 s LEU 134 CO 0.77 -0.00 0.26 0.54 0.23 0.00 0.00 176.35 178.15 3hb6 n ARG 135 N -0.92 0.45 -4.68 1.70 1.74 -1.26 -4.45 116.66 109.24 3hb6 n ARG 135 Ca -0.07 -0.11 -0.26 0.00 -0.77 0.00 0.00 57.85 56.65 3hb6 n ARG 135 Cb 0.59 -1.30 -0.17 0.00 -1.02 0.00 0.00 32.46 30.57 3hb6 n ARG 135 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hb6 s ASP 136 N -3.48 1.97 0.65 0.55 -1.08 -1.26 -4.16 116.67 109.86 3hb6 s ASP 136 Ca -0.05 -0.34 0.43 0.00 -0.52 0.00 0.00 52.55 52.08 3hb6 s ASP 136 Cb 0.08 -0.91 2.36 0.00 -1.46 0.00 0.00 42.92 43.00 3hb6 s ASP 136 CO 0.52 0.05 2.33 1.55 0.52 0.00 0.00 175.17 180.14 3hb6 h PRO 137 N 6.92 0.00 0.00 4.34 0.13 -1.89 -2.20 132.00 139.29 3hb6 h PRO 137 Ca -0.29 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 3hb6 h PRO 137 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 3hb6 h PRO 137 CO 0.47 0.00 -0.09 -0.07 -0.23 0.00 0.00 178.00 178.08 3hb6 h LEU 138 N 0.00 0.00 -0.38 1.56 3.38 -1.96 -2.26 115.31 115.65 3hb6 h LEU 138 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hb6 h LEU 138 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hb6 h LEU 138 CO 0.00 0.09 -0.07 0.29 0.09 0.00 0.00 178.44 178.85 3hb6 n LYS 139 N -3.40 1.01 -0.12 1.13 4.76 -0.83 -4.18 118.16 116.53 3hb6 n LYS 139 Ca -0.01 -0.38 -0.11 0.00 -2.87 0.00 0.00 58.31 54.94 3hb6 n LYS 139 Cb 0.26 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.93 3hb6 n LYS 139 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3hb6 h PHE 140 N 0.93 0.70 -0.45 2.13 3.57 -1.58 -0.67 116.94 121.58 3hb6 h PHE 140 Ca 0.00 -0.13 -0.05 0.00 3.53 0.00 0.00 57.97 61.32 3hb6 h PHE 140 Cb 0.32 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 3hb6 h PHE 140 CO 0.00 0.76 0.08 -1.35 -2.23 0.00 0.00 178.31 175.57 3hb6 h PRO 141 N 0.44 0.68 -0.45 6.41 0.11 -1.79 -1.88 132.00 135.51 3hb6 h PRO 141 Ca 0.10 -0.14 -0.08 0.00 0.11 0.00 0.00 66.00 65.99 3hb6 h PRO 141 Cb 0.50 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 3hb6 h PRO 141 CO 0.02 0.65 -0.05 -0.44 -0.21 0.00 0.00 178.00 177.97 3hb6 h ASP 142 N 0.66 0.76 -0.30 -2.05 3.32 -1.76 -0.56 116.42 116.48 3hb6 h ASP 142 Ca 0.15 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3hb6 h ASP 142 Cb 0.30 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3hb6 h ASP 142 CO 0.00 0.86 -0.02 0.25 -1.72 0.00 0.00 179.24 178.61 3hb6 h LEU 143 N 0.72 0.54 -1.15 1.55 5.85 -0.71 -2.80 115.31 119.31 3hb6 h LEU 143 Ca 0.13 -0.32 -0.09 0.00 0.84 0.00 0.00 57.88 58.44 3hb6 h LEU 143 Cb 0.52 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3hb6 h LEU 143 CO 0.03 0.73 -0.41 -1.13 -0.34 0.00 0.00 178.44 177.32 3hb6 h ASN 144 N 0.33 0.03 0.75 1.25 -1.24 -1.01 -1.33 115.58 114.36 3hb6 h ASN 144 Ca 0.08 -0.01 -0.04 0.00 0.71 0.00 0.00 56.30 57.04 3hb6 h ASN 144 Cb 0.47 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.51 3hb6 h ASN 144 CO 0.02 0.43 -0.19 0.45 -1.29 0.00 0.00 177.43 176.86 3hb6 h HIS 145 N 0.02 0.00 0.00 0.67 3.86 -0.91 -2.64 115.15 116.15 3hb6 h HIS 145 Ca -0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 3hb6 h HIS 145 Cb 0.74 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.19 3hb6 h HIS 145 CO 0.00 0.19 -2.02 0.44 0.86 0.00 0.00 177.93 177.39 3hb6 n ILE 146 N -3.44 0.35 0.21 2.45 -6.64 -0.93 -4.28 119.36 107.08 3hb6 n ILE 146 Ca -0.00 -0.55 0.12 0.00 -1.77 0.00 0.00 62.75 60.54 3hb6 n ILE 146 Cb 0.37 -0.11 0.13 0.00 -1.44 0.00 0.00 39.64 38.59 3hb6 n ILE 146 CO 0.00 0.00 0.00 -0.37 -1.77 0.00 0.00 176.55 174.41 3hb6 h VAL 147 N 0.00 0.00 -2.63 7.28 -1.51 -1.27 -3.39 116.25 114.73 3hb6 h VAL 147 Ca -0.14 -0.96 0.00 0.00 -1.23 0.00 0.00 66.70 64.37 3hb6 h VAL 147 Cb 1.26 1.80 0.00 0.00 -2.13 0.00 0.00 31.29 32.22 3hb6 h VAL 147 CO 0.01 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.64 3hb6 n LYS 148 N -2.91 3.01 -2.56 5.19 5.02 -1.00 -4.82 118.16 120.09 3hb6 n LYS 148 Ca 0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.94 3hb6 n LYS 148 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.49 3hb6 n LYS 148 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3hb6 s ARG 149 N 2.93 4.45 0.25 1.97 0.52 -1.26 -4.20 118.95 123.61 3hb6 s ARG 149 Ca 0.00 1.60 -0.30 0.00 -0.52 0.00 0.00 55.73 56.51 3hb6 s ARG 149 Cb 0.00 -2.88 -0.10 0.00 0.52 0.00 0.00 34.95 32.49 3hb6 s ARG 149 CO 0.00 0.10 1.41 0.34 0.02 0.00 0.00 175.30 177.17 3hb6 s ASP 150 N -1.28 6.69 0.62 0.23 -1.08 -0.12 -4.85 116.67 116.88 3hb6 s ASP 150 Ca 0.50 2.64 0.31 0.00 -0.52 0.00 0.00 52.55 55.49 3hb6 s ASP 150 Cb -0.26 -2.62 1.73 0.00 -1.46 0.00 0.00 42.92 40.31 3hb6 s ASP 150 CO 0.33 -0.67 2.08 1.55 0.52 0.00 0.00 175.17 178.97 3hb6 h PRO 151 N 4.92 0.00 0.00 4.34 0.13 -1.92 -1.66 132.00 137.81 3hb6 h PRO 151 Ca -0.46 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.42 3hb6 h PRO 151 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 3hb6 h PRO 151 CO 0.76 0.00 -1.75 -2.13 -0.23 0.00 0.00 178.00 174.66 3hb6 n ARG 152 N -3.51 0.37 0.20 0.86 0.63 -1.26 -4.73 116.66 109.23 3hb6 n ARG 152 Ca 0.01 0.16 0.14 0.00 -0.92 0.00 0.00 57.85 57.24 3hb6 n ARG 152 Cb 0.34 -1.13 0.40 0.00 0.45 0.00 0.00 32.46 32.53 3hb6 n ARG 152 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 3hb6 h THR 153 N -0.64 0.00 -1.84 5.15 1.35 -1.97 -3.47 112.91 111.48 3hb6 h THR 153 Ca -0.37 -0.67 -0.38 0.00 -0.55 0.00 0.00 66.41 64.44 3hb6 h THR 153 Cb 1.26 1.63 -0.08 0.00 -1.73 0.00 0.00 68.15 69.23 3hb6 h THR 153 CO -0.22 0.00 -0.42 -3.20 -0.25 0.00 0.00 175.52 171.42 3hb6 n ASN 154 N -2.83 -5.39 -4.22 5.36 5.15 -0.62 -4.94 115.26 107.77 3hb6 n ASN 154 Ca 0.03 0.22 -0.19 0.00 -0.60 0.00 0.00 54.58 54.03 3hb6 n ASN 154 Cb 0.41 -4.49 -0.12 0.00 -0.53 0.00 0.00 39.78 35.05 3hb6 n ASN 154 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3hb6 s MET 155 N -4.30 0.95 -0.12 1.20 -1.94 -1.26 -4.72 119.30 109.11 3hb6 s MET 155 Ca 0.00 -1.09 -0.29 0.00 -1.71 0.00 0.00 55.69 52.60 3hb6 s MET 155 Cb 0.00 -0.97 -0.05 0.00 2.01 0.00 0.00 34.83 35.82 3hb6 s MET 155 CO 0.00 0.21 1.86 1.03 -0.01 0.00 0.00 175.02 178.10 3hb6 s ARG 156 N -2.08 3.81 -0.41 2.03 0.52 -1.26 -0.94 118.95 120.62 3hb6 s ARG 156 Ca 0.03 2.10 -0.21 0.00 -0.52 0.00 0.00 55.73 57.13 3hb6 s ARG 156 Cb -0.08 -4.14 0.02 0.00 0.52 0.00 0.00 34.95 31.26 3hb6 s ARG 156 CO 0.03 -1.31 0.68 1.21 0.02 0.00 0.00 175.30 175.94 3hb6 s ASN 157 N 5.04 6.39 0.45 0.23 3.04 -1.26 -4.94 114.94 123.90 3hb6 s ASN 157 Ca 0.83 -0.07 0.28 0.00 0.04 0.00 0.00 52.86 53.93 3hb6 s ASN 157 Cb -0.33 -2.34 0.84 0.00 -1.54 0.00 0.00 41.25 37.88 3hb6 s ASN 157 CO 0.34 -0.74 1.78 0.24 -3.04 0.00 0.00 177.10 175.68 3hb6 h MET 158 N 8.73 0.00 -0.18 0.43 2.86 -1.90 -2.10 114.93 122.77 3hb6 h MET 158 Ca -0.26 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.22 3hb6 h MET 158 Cb 1.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.76 3hb6 h MET 158 CO 0.89 0.00 -0.53 0.00 1.06 0.00 0.00 176.91 178.33 3hb6 h ALA 159 N 2.07 0.30 -0.36 6.32 0.00 -1.84 -2.68 119.26 123.08 3hb6 h ALA 159 Ca 0.00 -0.51 -0.15 0.00 0.00 0.00 0.00 54.91 54.25 3hb6 h ALA 159 Cb 0.73 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3hb6 h ALA 159 CO 0.00 0.50 -0.36 1.88 0.00 0.00 0.00 179.25 181.27 3hb6 h TYR 160 N 0.36 1.06 0.15 0.00 0.05 -1.90 -2.16 116.97 114.52 3hb6 h TYR 160 Ca -0.02 -0.32 0.01 0.00 0.05 0.00 0.00 58.73 58.45 3hb6 h TYR 160 Cb 1.15 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.65 3hb6 h TYR 160 CO 0.09 1.13 -0.15 -0.22 -1.05 0.00 0.00 178.16 177.96 3hb6 h LYS 161 N 0.68 -0.32 0.00 4.88 3.64 -1.39 -2.44 116.57 121.63 3hb6 h LYS 161 Ca 0.06 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3hb6 h LYS 161 Cb 0.95 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3hb6 h LYS 161 CO 0.09 -0.21 0.00 -1.49 -2.27 0.00 0.00 179.45 175.57 3hb6 h TRP 162 N -0.33 0.00 -0.24 1.91 4.06 -1.52 -2.53 115.95 117.29 3hb6 h TRP 162 Ca 0.01 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.89 3hb6 h TRP 162 Cb 0.32 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.47 3hb6 h TRP 162 CO -0.14 0.00 -0.09 0.22 -3.56 0.00 0.00 178.44 174.87 3hb6 h ASP 163 N 0.00 0.50 0.31 -3.49 3.58 -1.17 -0.62 116.42 115.54 3hb6 h ASP 163 Ca 0.00 -0.39 -0.02 0.00 0.42 0.00 0.00 57.03 57.04 3hb6 h ASP 163 Cb 0.83 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.75 3hb6 h ASP 163 CO 0.00 0.78 -0.15 0.15 -2.88 0.00 0.00 179.24 177.14 3hb6 h PHE 164 N 0.22 -0.39 0.00 0.28 3.57 -1.34 -3.03 116.94 116.25 3hb6 h PHE 164 Ca 0.06 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 3hb6 h PHE 164 Cb 0.58 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 3hb6 h PHE 164 CO 0.06 -0.23 -0.25 0.74 -2.23 0.00 0.00 178.31 176.40 3hb6 h PHE 165 N -0.44 0.00 0.00 0.41 0.04 -1.42 -2.65 116.94 112.88 3hb6 h PHE 165 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3hb6 h PHE 165 Cb 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 3hb6 h PHE 165 CO -0.05 0.25 0.00 0.66 -0.60 0.00 0.00 178.31 178.57 3hb6 h SER 166 N 0.00 0.00 0.15 2.17 4.64 -0.98 -1.92 113.55 117.61 3hb6 h SER 166 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hb6 h SER 166 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3hb6 h SER 166 CO 0.03 0.00 -0.60 1.41 -0.87 0.00 0.00 176.83 176.80 3hb6 n HIS 167 N -2.95 0.00 -3.88 4.77 8.25 -1.00 -4.70 115.22 115.72 3hb6 n HIS 167 Ca 0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.17 3hb6 n HIS 167 Cb 0.28 -0.08 -0.14 0.00 1.12 0.00 0.00 29.99 31.18 3hb6 n HIS 167 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hb6 s LEU 168 N -2.75 3.90 0.43 2.41 1.43 -0.72 -4.97 118.68 118.41 3hb6 s LEU 168 Ca 0.15 -3.00 0.30 0.00 -1.03 0.00 0.00 54.13 50.55 3hb6 s LEU 168 Cb 0.18 -1.47 1.36 0.00 0.03 0.00 0.00 46.19 46.28 3hb6 s LEU 168 CO 0.68 -0.23 1.90 -0.65 0.23 0.00 0.00 176.35 178.29 3hb6 h PRO 169 N 6.44 0.00 0.00 1.29 0.11 -1.84 -2.67 132.00 135.33 3hb6 h PRO 169 Ca -0.04 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 3hb6 h PRO 169 Cb 0.89 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 3hb6 h PRO 169 CO 0.64 0.00 -0.10 1.05 -0.21 0.00 0.00 178.00 179.38 3hb6 h GLU 170 N 0.00 0.00 0.00 1.05 9.09 -1.87 -2.80 114.58 120.05 3hb6 h GLU 170 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hb6 h GLU 170 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.42 3hb6 h GLU 170 CO 0.00 0.10 0.00 -1.13 0.05 0.00 0.00 179.01 178.03 3hb6 n SER 171 N -3.38 0.39 -0.04 3.06 3.41 -1.01 -3.88 113.62 112.17 3hb6 n SER 171 Ca -0.01 0.57 0.13 0.00 -0.26 0.00 0.00 58.87 59.30 3hb6 n SER 171 Cb 0.27 -0.66 0.55 0.00 -0.26 0.00 0.00 64.21 64.10 3hb6 n SER 171 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hb6 h LEU 172 N 0.00 0.27 -0.14 1.04 3.38 -1.70 -0.71 115.31 117.45 3hb6 h LEU 172 Ca 0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3hb6 h LEU 172 Cb 0.44 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3hb6 h LEU 172 CO 0.00 0.16 0.04 -0.74 0.09 0.00 0.00 178.44 177.99 3hb6 h HIS 173 N 0.30 0.22 -0.08 1.13 2.76 -1.83 -2.16 115.15 115.50 3hb6 h HIS 173 Ca 0.25 -0.02 -0.20 0.00 -2.20 0.00 0.00 60.37 58.20 3hb6 h HIS 173 Cb 0.59 -0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.49 3hb6 h HIS 173 CO -0.00 0.35 -0.76 0.37 -1.30 0.00 0.00 177.93 176.58 3hb6 h GLN 174 N 0.04 0.47 -0.23 5.26 5.75 -1.65 -2.89 115.11 121.85 3hb6 h GLN 174 Ca 0.04 -0.39 -0.05 0.00 -0.15 0.00 0.00 58.65 58.10 3hb6 h GLN 174 Cb 0.23 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 3hb6 h GLN 174 CO -0.00 1.03 -0.08 -0.07 -2.65 0.00 0.00 178.83 177.07 3hb6 h LEU 175 N 0.31 0.33 -0.62 -2.39 3.38 -1.12 0.92 115.31 116.12 3hb6 h LEU 175 Ca -0.04 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 3hb6 h LEU 175 Cb 1.36 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 3hb6 h LEU 175 CO 0.14 0.45 -0.35 0.74 0.09 0.00 0.00 178.44 179.51 3hb6 h THR 176 N 0.34 1.29 -0.23 0.22 2.02 -1.31 -0.67 112.91 114.56 3hb6 h THR 176 Ca 0.07 -1.50 -0.13 0.00 0.77 0.00 0.00 66.41 65.62 3hb6 h THR 176 Cb 0.35 1.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.18 3hb6 h THR 176 CO 0.02 0.49 -0.37 0.40 0.37 0.00 0.00 175.52 176.43 3hb6 h ILE 177 N 0.58 1.31 -1.00 3.11 2.04 -1.18 -2.20 117.51 120.18 3hb6 h ILE 177 Ca 0.06 -1.57 0.02 0.00 1.00 0.00 0.00 64.86 64.37 3hb6 h ILE 177 Cb 0.87 1.75 -0.05 0.00 -0.74 0.00 0.00 36.82 38.65 3hb6 h ILE 177 CO 0.08 0.49 0.66 0.44 0.00 0.00 0.00 178.15 179.82 3hb6 h ASP 178 N 0.37 1.13 0.95 1.72 3.32 -0.56 -2.61 116.42 120.74 3hb6 h ASP 178 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hb6 h ASP 178 Cb 0.96 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.23 3hb6 h ASP 178 CO 0.08 0.80 -0.35 0.23 -1.72 0.00 0.00 179.24 178.28 3hb6 n MET 179 N -4.41 0.18 -1.67 3.56 2.81 -0.28 -4.10 117.12 113.21 3hb6 n MET 179 Ca 0.12 0.08 -0.29 0.00 -1.81 0.00 0.00 57.70 55.80 3hb6 n MET 179 Cb 0.04 -1.64 0.16 0.00 -0.71 0.00 0.00 33.22 31.06 3hb6 n MET 179 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3hb6 s SER 180 N -3.84 3.22 0.49 7.83 1.04 -0.83 -4.30 113.70 117.31 3hb6 s SER 180 Ca 0.09 0.66 0.15 0.00 0.48 0.00 0.00 55.95 57.33 3hb6 s SER 180 Cb 0.15 -0.99 1.17 0.00 0.10 0.00 0.00 66.02 66.45 3hb6 s SER 180 CO 0.66 -2.70 2.11 0.44 0.98 0.00 0.00 173.24 174.73 3hb6 h ASP 181 N -1.61 0.13 0.27 7.02 3.32 -1.89 -1.90 116.42 121.76 3hb6 h ASP 181 Ca -0.47 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3hb6 h ASP 181 Cb 1.29 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3hb6 h ASP 181 CO 0.51 0.09 0.00 0.54 -1.72 0.00 0.00 179.24 178.66 3hb6 n ARG 182 N -4.51 0.30 0.07 3.56 1.74 -1.26 -2.47 116.66 114.09 3hb6 n ARG 182 Ca 0.00 0.10 0.13 0.00 -0.77 0.00 0.00 57.85 57.31 3hb6 n ARG 182 Cb 0.14 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.56 3hb6 n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hb6 n GLY 183 N 0.18 -1.58 2.48 -0.13 0.00 -0.71 -4.28 105.19 101.15 3hb6 n GLY 183 Ca 0.09 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 3hb6 n GLY 183 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hb6 s LEU 184 N -3.93 1.64 0.84 0.99 0.20 -1.03 -1.82 118.68 115.57 3hb6 s LEU 184 Ca 0.11 -2.84 -0.11 0.00 0.69 0.00 0.00 54.13 51.98 3hb6 s LEU 184 Cb 0.14 -0.56 0.09 0.00 -0.43 0.00 0.00 46.19 45.44 3hb6 s LEU 184 CO 0.55 -0.21 1.09 -2.84 -0.29 0.00 0.00 176.35 174.64 3hb6 s PRO 185 N 0.26 1.73 0.15 0.98 0.02 -1.26 -0.85 135.00 136.03 3hb6 s PRO 185 Ca 0.27 0.92 -0.09 0.00 0.02 0.00 0.00 61.00 62.12 3hb6 s PRO 185 Cb -0.07 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.59 3hb6 s PRO 185 CO -0.12 -1.94 1.47 1.25 -0.33 0.00 0.00 177.00 177.33 3hb6 h LEU 186 N -1.34 0.91 0.00 -5.54 5.85 -1.55 -3.39 115.31 110.25 3hb6 h LEU 186 Ca -0.47 -0.45 0.05 0.00 0.84 0.00 0.00 57.88 57.85 3hb6 h LEU 186 Cb 1.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 3hb6 h LEU 186 CO 0.54 1.22 0.17 -1.54 -0.34 0.00 0.00 178.44 178.49 3hb6 n SER 187 N -4.03 -0.48 0.24 1.25 3.41 -1.26 -4.81 113.62 107.94 3hb6 n SER 187 Ca -0.03 -1.25 0.14 0.00 -0.26 0.00 0.00 58.87 57.48 3hb6 n SER 187 Cb 0.58 0.77 0.43 0.00 -0.26 0.00 0.00 64.21 65.73 3hb6 n SER 187 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3hb6 h TYR 188 N 1.27 0.00 0.00 7.33 0.05 -1.93 -3.14 116.97 120.56 3hb6 h TYR 188 Ca -0.07 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.71 3hb6 h TYR 188 Cb 0.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.07 3hb6 h TYR 188 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.11 3hb6 h ARG 189 N 0.00 0.00 -0.77 4.88 3.08 -1.96 -3.33 114.38 116.28 3hb6 h ARG 189 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 3hb6 h ARG 189 Cb 0.74 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.46 3hb6 h ARG 189 CO 0.00 0.00 -0.15 1.19 -1.07 0.00 0.00 179.97 179.94 3hb6 n PHE 190 N -2.36 2.63 -4.25 3.04 3.72 -1.18 -4.54 117.46 114.52 3hb6 n PHE 190 Ca 0.05 -2.38 -0.19 0.00 -0.05 0.00 0.00 57.45 54.88 3hb6 n PHE 190 Cb 0.42 -0.73 -0.11 0.00 -0.94 0.00 0.00 39.48 38.13 3hb6 n PHE 190 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3hb6 s VAL 191 N -4.44 1.40 0.35 -4.37 -7.23 -1.25 -3.51 120.40 101.34 3hb6 s VAL 191 Ca 0.54 -1.69 -0.06 0.00 -1.81 0.00 0.00 61.98 58.97 3hb6 s VAL 191 Cb 0.44 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.81 3hb6 s VAL 191 CO 0.02 -0.35 0.64 -1.00 -0.31 0.00 0.00 175.10 174.09 3hb6 s HIS 192 N -1.96 3.49 0.11 2.82 3.76 -1.26 -4.38 115.29 117.87 3hb6 s HIS 192 Ca 0.08 0.74 0.10 0.00 -0.15 0.00 0.00 55.06 55.84 3hb6 s HIS 192 Cb -0.06 -2.20 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 3hb6 s HIS 192 CO 0.03 0.03 -0.26 0.20 -0.85 0.00 0.00 174.74 173.89 3hb6 s GLY 193 N -3.39 1.55 0.06 -2.22 0.00 0.85 -4.24 107.32 99.93 3hb6 s GLY 193 Ca 0.46 -1.42 -0.06 0.00 0.00 0.00 0.00 44.72 43.70 3hb6 s GLY 193 CO 0.33 -1.38 0.12 -1.36 0.00 0.00 0.00 173.10 170.82 3hb6 s PHE 194 N -1.01 0.23 -0.42 1.90 0.40 -0.25 0.65 117.98 119.48 3hb6 s PHE 194 Ca 0.14 -0.62 0.23 0.00 -0.60 0.00 0.00 56.93 56.08 3hb6 s PHE 194 Cb -0.10 -0.14 0.17 0.00 0.51 0.00 0.00 43.02 43.46 3hb6 s PHE 194 CO 0.05 -0.45 1.21 0.78 0.70 0.00 0.00 175.22 177.51 3hb6 h GLY 195 N 3.16 0.00 0.00 4.36 0.00 -1.55 -2.44 103.07 106.60 3hb6 h GLY 195 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hb6 h GLY 195 CO 0.56 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.54 3hb6 n SER 196 N -2.48 0.00 -4.84 0.19 7.64 -1.26 -4.78 113.62 108.09 3hb6 n SER 196 Ca 0.02 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.60 3hb6 n SER 196 Cb 0.50 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.78 3hb6 n SER 196 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3hb6 s HIS 197 N 0.00 3.02 -0.03 1.43 3.76 -1.26 -4.75 115.29 117.46 3hb6 s HIS 197 Ca 0.00 1.06 -0.23 0.00 -0.15 0.00 0.00 55.06 55.74 3hb6 s HIS 197 Cb 0.00 -3.15 -0.05 0.00 1.11 0.00 0.00 32.58 30.50 3hb6 s HIS 197 CO 0.00 -1.56 0.68 0.99 -0.85 0.00 0.00 174.74 174.00 3hb6 s THR 198 N -3.28 4.94 0.00 1.30 2.01 -1.26 -4.63 115.64 114.72 3hb6 s THR 198 Ca 0.60 1.42 0.00 0.00 0.31 0.00 0.00 61.69 64.02 3hb6 s THR 198 Cb -0.13 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.36 3hb6 s THR 198 CO 0.53 0.33 0.00 -1.22 -0.69 0.00 0.00 174.62 173.56 3hb6 n TYR 199 N 3.26 -0.11 -4.05 4.92 4.02 0.47 -4.25 117.16 121.42 3hb6 n TYR 199 Ca -0.03 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.73 3hb6 n TYR 199 Cb 0.51 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.72 3hb6 n TYR 199 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3hb6 s SER 200 N -0.63 0.80 -0.05 7.72 1.04 -0.61 -0.98 113.70 120.98 3hb6 s SER 200 Ca 0.00 -0.54 0.05 0.00 0.48 0.00 0.00 55.95 55.93 3hb6 s SER 200 Cb 0.00 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 3hb6 s SER 200 CO 0.00 -0.21 -0.20 -0.36 0.98 0.00 0.00 173.24 173.45 3hb6 s PHE 201 N -1.39 2.55 -0.11 5.02 0.08 0.12 -0.88 117.98 123.38 3hb6 s PHE 201 Ca -0.11 -0.44 0.02 0.00 0.12 0.00 0.00 56.93 56.53 3hb6 s PHE 201 Cb -0.10 -1.61 0.01 0.00 -0.57 0.00 0.00 43.02 40.75 3hb6 s PHE 201 CO 0.00 -0.02 -0.17 0.42 -0.10 0.00 0.00 175.22 175.35 3hb6 s ILE 202 N -0.42 1.65 0.65 0.64 -1.09 -0.19 -0.94 121.20 121.50 3hb6 s ILE 202 Ca 0.04 -0.74 0.01 0.00 -2.23 0.00 0.00 60.65 57.73 3hb6 s ILE 202 Cb -0.12 -1.48 0.13 0.00 -1.58 0.00 0.00 42.46 39.41 3hb6 s ILE 202 CO 0.02 0.47 0.89 -0.46 -1.23 0.00 0.00 174.94 174.63 3hb6 n ASN 203 N 4.06 1.29 0.29 3.58 0.23 -1.00 -1.10 115.26 122.61 3hb6 n ASN 203 Ca -0.20 -2.07 0.15 0.00 -0.53 0.00 0.00 54.58 51.94 3hb6 n ASN 203 Cb 0.52 -0.57 0.86 0.00 -2.08 0.00 0.00 39.78 38.50 3hb6 n ASN 203 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3hb6 h LYS 204 N 0.00 0.00 -0.64 -3.83 2.10 -1.87 -2.26 116.57 110.06 3hb6 h LYS 204 Ca -0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 3hb6 h LYS 204 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 3hb6 h LYS 204 CO 0.33 0.06 0.00 -0.25 -2.00 0.00 0.00 179.45 177.58 3hb6 n ASP 205 N -3.60 3.69 -2.68 7.07 8.00 -1.26 -4.92 116.55 122.85 3hb6 n ASP 205 Ca -0.02 -2.41 -0.22 0.00 0.71 0.00 0.00 54.79 52.85 3hb6 n ASP 205 Cb 0.17 -0.53 0.01 0.00 -0.02 0.00 0.00 41.12 40.75 3hb6 n ASP 205 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3hb6 n ASN 206 N 0.61 -6.05 -4.72 -2.24 3.02 -0.85 -5.00 115.26 100.03 3hb6 n ASN 206 Ca 0.18 -0.14 -0.36 0.00 -0.03 0.00 0.00 54.58 54.23 3hb6 n ASN 206 Cb 0.73 -4.96 -0.07 0.00 -0.61 0.00 0.00 39.78 34.87 3hb6 n ASN 206 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hb6 s GLU 207 N -5.35 4.24 -0.05 3.52 2.02 -1.26 -4.62 118.70 117.21 3hb6 s GLU 207 Ca 0.14 0.02 -0.17 0.00 0.02 0.00 0.00 54.97 54.98 3hb6 s GLU 207 Cb -0.06 -3.43 -0.05 0.00 0.10 0.00 0.00 34.13 30.69 3hb6 s GLU 207 CO 0.17 0.24 0.46 0.50 0.02 0.00 0.00 175.26 176.65 3hb6 s ARG 208 N 0.49 4.16 -0.05 1.61 3.52 -1.26 -2.39 118.95 125.03 3hb6 s ARG 208 Ca 0.14 0.46 0.02 0.00 -0.13 0.00 0.00 55.73 56.22 3hb6 s ARG 208 Cb -0.13 -3.33 0.02 0.00 -1.56 0.00 0.00 34.95 29.96 3hb6 s ARG 208 CO 0.03 0.43 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.81 3hb6 s PHE 209 N -0.28 1.03 0.17 5.12 0.08 -0.12 -2.20 117.98 121.79 3hb6 s PHE 209 Ca 0.25 -0.33 -0.29 0.00 0.12 0.00 0.00 56.93 56.68 3hb6 s PHE 209 Cb -0.16 -0.82 -0.07 0.00 -0.57 0.00 0.00 43.02 41.40 3hb6 s PHE 209 CO 0.12 -0.22 0.90 -1.58 -0.10 0.00 0.00 175.22 174.35 3hb6 s TRP 210 N 0.76 3.89 0.04 0.36 0.52 0.16 0.14 118.94 124.82 3hb6 s TRP 210 Ca -0.13 1.79 0.03 0.00 0.02 0.00 0.00 56.10 57.81 3hb6 s TRP 210 Cb -0.15 -2.96 -0.02 0.00 -1.15 0.00 0.00 33.47 29.19 3hb6 s TRP 210 CO 0.02 0.37 -0.08 0.54 0.02 0.00 0.00 176.95 177.81 3hb6 s VAL 211 N -0.67 0.60 -0.08 4.03 0.11 -0.15 -0.68 120.40 123.55 3hb6 s VAL 211 Ca 0.42 -1.02 0.04 0.00 -2.93 0.00 0.00 61.98 58.49 3hb6 s VAL 211 Cb -0.24 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 33.96 3hb6 s VAL 211 CO 0.29 -0.31 -0.22 -0.54 -3.33 0.00 0.00 175.10 170.99 3hb6 s LYS 212 N -1.45 2.87 -0.22 1.54 -0.14 -0.98 -0.39 119.74 120.97 3hb6 s LYS 212 Ca -0.08 -0.85 -0.10 0.00 -1.36 0.00 0.00 55.97 53.58 3hb6 s LYS 212 Cb -0.09 -2.30 -0.05 0.00 -1.68 0.00 0.00 37.83 33.71 3hb6 s LYS 212 CO 0.01 0.29 0.14 -0.06 -0.76 0.00 0.00 175.35 174.97 3hb6 s PHE 213 N 0.07 3.36 -0.09 3.18 0.08 -1.26 -2.51 117.98 120.81 3hb6 s PHE 213 Ca -0.10 0.27 0.02 0.00 0.12 0.00 0.00 56.93 57.25 3hb6 s PHE 213 Cb -0.16 -2.21 0.01 0.00 -0.57 0.00 0.00 43.02 40.10 3hb6 s PHE 213 CO 0.06 0.18 -0.16 -1.01 -0.10 0.00 0.00 175.22 174.19 3hb6 s HIS 214 N 0.69 1.86 -0.36 0.36 3.76 0.07 -1.50 115.29 120.17 3hb6 s HIS 214 Ca 0.08 -0.78 0.01 0.00 -0.15 0.00 0.00 55.06 54.22 3hb6 s HIS 214 Cb -0.12 -1.33 0.10 0.00 1.11 0.00 0.00 32.58 32.34 3hb6 s HIS 214 CO 0.01 -0.38 0.10 -0.06 -0.85 0.00 0.00 174.74 173.56 3hb6 s PHE 215 N 0.73 3.67 -0.14 1.40 0.40 0.21 0.01 117.98 124.25 3hb6 s PHE 215 Ca -0.12 -2.72 -0.29 0.00 -0.60 0.00 0.00 56.93 53.19 3hb6 s PHE 215 Cb -0.16 -2.98 -0.01 0.00 0.51 0.00 0.00 43.02 40.38 3hb6 s PHE 215 CO 0.03 -0.95 1.06 1.03 0.70 0.00 0.00 175.22 177.09 3hb6 s ARG 216 N 1.01 4.35 0.01 0.44 1.81 0.76 -0.11 118.95 127.22 3hb6 s ARG 216 Ca 0.09 1.44 -0.30 0.00 -1.72 0.00 0.00 55.73 55.23 3hb6 s ARG 216 Cb -0.20 -3.59 -0.06 0.00 -0.45 0.00 0.00 34.95 30.64 3hb6 s ARG 216 CO -0.06 -0.46 1.53 0.00 -0.68 0.00 0.00 175.30 175.63 3hb6 n GLN 218 N 5.86 1.81 0.00 0.00 1.13 -0.77 -3.66 117.38 121.75 3hb6 n GLN 218 Ca 0.15 -1.22 0.07 0.00 -1.94 0.00 0.00 57.00 54.07 3hb6 n GLN 218 Cb 0.42 -1.42 -0.02 0.00 0.11 0.00 0.00 30.24 29.34 3hb6 n GLN 218 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3hb6 n GLN 219 N 0.45 1.84 0.00 -1.09 3.00 -1.26 -4.94 117.38 115.37 3hb6 n GLN 219 Ca 0.17 -0.63 0.00 0.00 -0.01 0.00 0.00 57.00 56.53 3hb6 n GLN 219 Cb 0.37 -1.23 0.00 0.00 0.00 0.00 0.00 30.24 29.37 3hb6 n GLN 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hb6 n GLY 220 N 1.16 -1.38 3.60 1.08 0.00 -1.24 -4.88 105.19 103.53 3hb6 n GLY 220 Ca 0.06 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 44.09 3hb6 n GLY 220 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb6 s ILE 221 N -2.53 5.05 -0.09 -0.61 -1.09 -1.26 -4.49 121.20 116.18 3hb6 s ILE 221 Ca 0.00 0.70 0.03 0.00 -2.23 0.00 0.00 60.65 59.15 3hb6 s ILE 221 Cb 0.00 -3.87 0.01 0.00 -1.58 0.00 0.00 42.46 37.02 3hb6 s ILE 221 CO 0.00 -0.02 -0.18 -0.54 -1.23 0.00 0.00 174.94 172.98 3hb6 s LYS 222 N 2.35 2.35 0.36 2.79 1.02 -1.23 -5.09 119.74 122.28 3hb6 s LYS 222 Ca 0.20 -0.63 0.07 0.00 0.02 0.00 0.00 55.97 55.63 3hb6 s LYS 222 Cb -0.15 -1.85 -0.07 0.00 -0.52 0.00 0.00 37.83 35.23 3hb6 s LYS 222 CO 0.11 0.08 -0.01 -0.80 -0.92 0.00 0.00 175.35 173.81 3hb6 s ASN 223 N 0.57 3.33 -0.07 2.83 0.01 -1.26 -1.59 114.94 118.75 3hb6 s ASN 223 Ca -0.15 -1.31 0.05 0.00 -0.71 0.00 0.00 52.86 50.73 3hb6 s ASN 223 Cb -0.17 -0.28 -0.01 0.00 0.41 0.00 0.00 41.25 41.20 3hb6 s ASN 223 CO 0.05 -0.43 -0.24 -0.76 -1.51 0.00 0.00 177.10 174.21 3hb6 s LEU 224 N -3.60 2.11 0.59 0.60 1.43 -0.03 -4.60 118.68 115.17 3hb6 s LEU 224 Ca 0.34 -0.52 -0.13 0.00 -1.03 0.00 0.00 54.13 52.80 3hb6 s LEU 224 Cb 0.07 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 3hb6 s LEU 224 CO 0.16 0.22 1.02 -0.04 0.23 0.00 0.00 176.35 177.94 3hb6 s MET 225 N -0.01 3.70 0.31 1.70 -1.94 -1.26 -4.74 119.30 117.06 3hb6 s MET 225 Ca -0.08 0.83 0.08 0.00 -1.71 0.00 0.00 55.69 54.80 3hb6 s MET 225 Cb -0.15 -2.10 0.80 0.00 2.01 0.00 0.00 34.83 35.40 3hb6 s MET 225 CO 0.05 -0.48 1.76 -0.44 -0.01 0.00 0.00 175.02 175.90 3hb6 h ASP 226 N 0.09 0.74 0.09 3.03 3.32 -1.98 -0.10 116.42 121.62 3hb6 h ASP 226 Ca -0.45 0.11 -0.17 0.00 0.02 0.00 0.00 57.03 56.54 3hb6 h ASP 226 Cb 1.19 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 3hb6 h ASP 226 CO 0.62 0.21 -0.63 -2.24 -1.72 0.00 0.00 179.24 175.47 3hb6 h ASP 227 N 0.69 0.60 0.00 6.45 3.04 -1.99 -1.60 116.42 123.61 3hb6 h ASP 227 Ca 0.61 -0.35 -0.17 0.00 -3.24 0.00 0.00 57.03 53.87 3hb6 h ASP 227 Cb 1.04 -0.17 -0.00 0.00 -1.04 0.00 0.00 39.33 39.15 3hb6 h ASP 227 CO -0.42 1.08 -0.60 -0.33 -2.04 0.00 0.00 179.24 176.93 3hb6 h GLU 228 N 0.38 0.60 -0.23 4.15 5.08 -1.66 -2.40 114.58 120.50 3hb6 h GLU 228 Ca -0.01 -0.40 -0.18 0.00 -1.00 0.00 0.00 59.36 57.76 3hb6 h GLU 228 Cb 1.20 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 3hb6 h GLU 228 CO 0.12 1.02 -0.59 0.00 -1.00 0.00 0.00 179.01 178.56 3hb6 h ALA 229 N 0.89 0.54 -0.33 3.43 0.00 -1.02 -2.36 119.26 120.41 3hb6 h ALA 229 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 3hb6 h ALA 229 Cb 1.16 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3hb6 h ALA 229 CO 0.11 0.69 0.18 0.93 0.00 0.00 0.00 179.25 181.16 3hb6 h GLU 230 N 0.55 0.46 -0.80 0.00 5.08 -1.22 0.23 114.58 118.87 3hb6 h GLU 230 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3hb6 h GLU 230 Cb 1.17 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 3hb6 h GLU 230 CO 0.12 0.39 0.41 0.00 -1.00 0.00 0.00 179.01 178.93 3hb6 h ALA 231 N 1.04 1.21 -0.24 3.43 0.00 -1.41 -0.86 119.26 122.43 3hb6 h ALA 231 Ca 0.11 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3hb6 h ALA 231 Cb 0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3hb6 h ALA 231 CO -0.02 0.62 -0.34 1.25 0.00 0.00 0.00 179.25 180.76 3hb6 h LEU 232 N 1.13 0.71 -0.98 0.00 5.85 -1.09 -2.86 115.31 118.08 3hb6 h LEU 232 Ca 0.28 -0.51 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 3hb6 h LEU 232 Cb 0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 3hb6 h LEU 232 CO -0.04 1.08 0.19 0.58 -0.34 0.00 0.00 178.44 179.91 3hb6 h VAL 233 N 0.35 1.23 -0.19 1.05 2.07 -0.69 0.35 116.25 120.42 3hb6 h VAL 233 Ca 0.02 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.70 3hb6 h VAL 233 Cb 0.93 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 3hb6 h VAL 233 CO 0.08 0.31 -0.06 1.23 0.02 0.00 0.00 177.57 179.14 3hb6 h GLY 234 N 1.02 0.32 0.60 2.17 0.00 -1.09 -3.13 103.07 102.96 3hb6 h GLY 234 Ca 0.20 -0.18 -0.34 0.00 0.00 0.00 0.00 47.33 47.01 3hb6 h GLY 234 CO -0.01 0.17 -1.99 0.28 0.00 0.00 0.00 176.54 174.98 3hb6 n LYS 235 N -4.31 0.69 -3.67 4.80 5.02 -0.92 -4.95 118.16 114.81 3hb6 n LYS 235 Ca -0.00 0.23 -0.08 0.00 -2.02 0.00 0.00 58.31 56.43 3hb6 n LYS 235 Cb 0.23 -1.70 -0.09 0.00 -0.02 0.00 0.00 35.03 33.46 3hb6 n LYS 235 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3hb6 s ASP 236 N -6.42 -0.46 0.05 4.39 2.15 0.12 -5.01 116.67 111.49 3hb6 s ASP 236 Ca -0.16 1.05 0.25 0.00 0.43 0.00 0.00 52.55 54.12 3hb6 s ASP 236 Cb 0.07 1.27 0.42 0.00 -0.30 0.00 0.00 42.92 44.37 3hb6 s ASP 236 CO 0.78 -0.22 1.35 0.54 -0.17 0.00 0.00 175.17 177.45 3hb6 n ARG 237 N 4.98 0.15 -0.83 4.34 3.00 -1.26 -3.99 116.66 123.06 3hb6 n ARG 237 Ca -0.14 0.03 -0.05 0.00 -0.01 0.00 0.00 57.85 57.69 3hb6 n ARG 237 Cb 0.52 -1.58 0.22 0.00 0.00 0.00 0.00 32.46 31.62 3hb6 n ARG 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3hb6 n GLU 238 N -1.79 2.38 -0.34 5.56 -0.58 -1.26 -1.30 120.64 123.31 3hb6 n GLU 238 Ca 0.04 -3.07 0.06 0.00 -0.42 0.00 0.00 57.16 53.77 3hb6 n GLU 238 Cb 0.39 -1.93 0.22 0.00 -0.57 0.00 0.00 31.44 29.54 3hb6 n GLU 238 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hb6 h SER 239 N 1.39 0.82 0.39 1.62 4.64 -1.94 -0.66 113.55 119.81 3hb6 h SER 239 Ca 0.25 0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 61.45 3hb6 h SER 239 Cb 1.90 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.87 3hb6 h SER 239 CO 0.52 0.43 -0.71 0.28 -0.87 0.00 0.00 176.83 176.48 3hb6 h SER 240 N 0.90 0.32 -0.29 4.97 0.02 -1.87 -0.75 113.55 116.86 3hb6 h SER 240 Ca 0.47 -0.21 -0.15 0.00 -0.84 0.00 0.00 61.79 61.05 3hb6 h SER 240 Cb 0.47 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 3hb6 h SER 240 CO -0.27 0.93 -0.41 -0.61 -1.14 0.00 0.00 176.83 175.33 3hb6 h GLN 241 N 0.19 0.79 -0.49 3.45 5.75 -1.83 -1.60 115.11 121.36 3hb6 h GLN 241 Ca -0.02 -0.46 -0.02 0.00 -0.15 0.00 0.00 58.65 57.99 3hb6 h GLN 241 Cb 1.27 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.84 3hb6 h GLN 241 CO 0.11 1.09 0.22 -0.09 -2.65 0.00 0.00 178.83 177.51 3hb6 h ARG 242 N 0.55 0.72 0.01 1.69 2.43 -1.03 -0.99 114.38 117.75 3hb6 h ARG 242 Ca 0.03 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3hb6 h ARG 242 Cb 1.01 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 3hb6 h ARG 242 CO 0.10 0.62 -0.01 0.22 -1.51 0.00 0.00 179.97 179.39 3hb6 h ASP 243 N 0.65 -0.02 -0.25 -3.80 3.58 -1.07 -1.62 116.42 113.89 3hb6 h ASP 243 Ca 0.17 -0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 3hb6 h ASP 243 Cb 0.15 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 3hb6 h ASP 243 CO -0.02 0.19 0.03 0.25 -2.88 0.00 0.00 179.24 176.81 3hb6 h LEU 244 N -0.22 0.41 0.01 2.28 5.85 -1.22 -1.99 115.31 120.43 3hb6 h LEU 244 Ca -0.00 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 3hb6 h LEU 244 Cb 0.21 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3hb6 h LEU 244 CO 0.00 0.58 -0.00 0.15 -0.34 0.00 0.00 178.44 178.83 3hb6 h PHE 245 N 0.23 -0.01 0.00 1.25 3.04 -1.21 -2.71 116.94 117.52 3hb6 h PHE 245 Ca 0.08 -0.00 -0.06 0.00 3.98 0.00 0.00 57.97 61.97 3hb6 h PHE 245 Cb 0.35 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.86 3hb6 h PHE 245 CO 0.03 0.10 -0.28 0.93 -2.02 0.00 0.00 178.31 177.06 3hb6 h GLU 246 N -0.11 0.00 -0.17 1.11 5.08 -1.32 -2.04 114.58 117.12 3hb6 h GLU 246 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 3hb6 h GLU 246 Cb 0.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3hb6 h GLU 246 CO 0.00 0.28 -0.19 0.00 -1.00 0.00 0.00 179.01 178.11 3hb6 h ALA 247 N 1.72 0.25 -0.13 3.43 0.00 -1.22 -2.73 119.26 120.59 3hb6 h ALA 247 Ca -0.00 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 3hb6 h ALA 247 Cb 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3hb6 h ALA 247 CO 0.04 0.17 -0.55 0.82 0.00 0.00 0.00 179.25 179.73 3hb6 h ILE 248 N 0.07 1.35 -0.70 0.00 2.04 -1.40 0.14 117.51 119.01 3hb6 h ILE 248 Ca 0.02 -1.83 -0.03 0.00 1.00 0.00 0.00 64.86 64.02 3hb6 h ILE 248 Cb 0.73 1.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.63 3hb6 h ILE 248 CO 0.05 0.55 0.30 -0.08 0.00 0.00 0.00 178.15 178.97 3hb6 h GLU 249 N 0.29 1.02 -0.01 2.37 4.81 -1.33 -2.47 114.58 119.26 3hb6 h GLU 249 Ca 0.00 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3hb6 h GLU 249 Cb 1.05 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.25 3hb6 h GLU 249 CO 0.09 0.81 -0.20 2.89 -0.73 0.00 0.00 179.01 181.87 3hb6 n ARG 250 N -4.31 0.95 -0.31 1.92 1.85 -1.03 -4.95 116.66 110.78 3hb6 n ARG 250 Ca 0.06 -0.53 0.00 0.00 -1.00 0.00 0.00 57.85 56.38 3hb6 n ARG 250 Cb 0.16 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.08 3hb6 n ARG 250 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3hb6 n GLY 251 N 1.31 0.85 2.95 2.89 0.00 -0.93 -5.00 105.19 107.25 3hb6 n GLY 251 Ca 0.13 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 3hb6 n GLY 251 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hb6 n ASP 252 N 0.02 5.25 -4.63 1.61 -0.08 0.47 -4.99 116.55 114.20 3hb6 n ASP 252 Ca 0.00 -3.13 -0.43 0.00 -1.51 0.00 0.00 54.79 49.73 3hb6 n ASP 252 Cb 0.00 -1.47 -0.03 0.00 2.34 0.00 0.00 41.12 41.97 3hb6 n ASP 252 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 3hb6 s TYR 253 N 0.16 1.99 0.23 -0.67 2.02 -1.26 -4.27 117.35 115.55 3hb6 s TYR 253 Ca 0.39 0.48 -0.30 0.00 -0.37 0.00 0.00 57.07 57.27 3hb6 s TYR 253 Cb 0.08 -4.00 -0.09 0.00 -0.40 0.00 0.00 41.96 37.55 3hb6 s TYR 253 CO 0.01 -3.18 1.29 -1.25 -1.57 0.00 0.00 175.55 170.86 3hb6 s PRO 254 N 4.77 4.40 0.07 -1.71 0.04 -1.25 -4.80 135.00 136.52 3hb6 s PRO 254 Ca 0.74 2.06 0.08 0.00 0.04 0.00 0.00 61.00 63.92 3hb6 s PRO 254 Cb -0.27 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.07 3hb6 s PRO 254 CO 0.30 -0.21 -0.20 0.50 0.04 0.00 0.00 177.00 177.43 3hb6 s ARG 255 N -0.48 1.23 -0.01 4.56 3.52 -1.26 -1.60 118.95 124.91 3hb6 s ARG 255 Ca 0.54 -1.04 0.01 0.00 -0.13 0.00 0.00 55.73 55.12 3hb6 s ARG 255 Cb -0.37 -1.41 0.00 0.00 -1.56 0.00 0.00 34.95 31.61 3hb6 s ARG 255 CO 0.41 0.34 -0.04 -1.58 -0.81 0.00 0.00 175.30 173.63 3hb6 s TRP 256 N -0.98 0.36 -0.24 5.12 0.51 -0.70 -1.85 118.94 121.16 3hb6 s TRP 256 Ca 0.07 -0.06 -0.10 0.00 -2.12 0.00 0.00 56.10 53.88 3hb6 s TRP 256 Cb -0.09 -0.26 -0.05 0.00 -0.81 0.00 0.00 33.47 32.26 3hb6 s TRP 256 CO 0.03 -0.03 0.15 0.15 -0.51 0.00 0.00 176.95 176.74 3hb6 s LYS 257 N 0.06 4.02 -0.20 4.98 1.02 0.17 -1.44 119.74 128.35 3hb6 s LYS 257 Ca -0.00 -0.30 -0.27 0.00 0.02 0.00 0.00 55.97 55.42 3hb6 s LYS 257 Cb -0.03 -3.51 -0.00 0.00 -0.52 0.00 0.00 37.83 33.76 3hb6 s LYS 257 CO -0.00 0.03 0.94 -1.17 -0.92 0.00 0.00 175.35 174.23 3hb6 s LEU 258 N 1.12 4.13 0.06 3.17 2.96 0.12 -0.17 118.68 130.07 3hb6 s LEU 258 Ca 0.07 1.27 0.07 0.00 -0.22 0.00 0.00 54.13 55.32 3hb6 s LEU 258 Cb -0.14 -3.39 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 3hb6 s LEU 258 CO 0.05 -0.54 -0.19 -1.10 -1.32 0.00 0.00 176.35 173.25 3hb6 s GLN 259 N 2.69 1.21 0.13 1.98 -0.21 0.10 -1.49 119.66 124.08 3hb6 s GLN 259 Ca 0.41 -0.98 0.07 0.00 0.02 0.00 0.00 55.36 54.88 3hb6 s GLN 259 Cb -0.16 -1.35 -0.04 0.00 1.00 0.00 0.00 33.01 32.46 3hb6 s GLN 259 CO 0.10 0.33 -0.16 0.96 -2.12 0.00 0.00 175.29 174.40 3hb6 s ILE 260 N -0.94 1.50 -0.11 1.08 -4.36 0.06 -0.75 121.20 117.68 3hb6 s ILE 260 Ca 0.06 -1.78 0.01 0.00 -0.26 0.00 0.00 60.65 58.68 3hb6 s ILE 260 Cb -0.09 -1.63 -0.02 0.00 1.25 0.00 0.00 42.46 41.97 3hb6 s ILE 260 CO 0.02 -0.37 -0.14 -1.10 0.24 0.00 0.00 174.94 173.59 3hb6 s GLN 261 N -2.69 3.20 -0.10 0.37 -0.21 -1.05 -0.56 119.66 118.62 3hb6 s GLN 261 Ca 0.11 -0.70 0.04 0.00 0.02 0.00 0.00 55.36 54.83 3hb6 s GLN 261 Cb -0.05 -2.57 -0.00 0.00 1.00 0.00 0.00 33.01 31.39 3hb6 s GLN 261 CO 0.04 0.29 -0.23 -1.50 -2.12 0.00 0.00 175.29 171.77 3hb6 s ILE 262 N 0.14 2.11 -0.22 1.08 1.10 -1.26 -2.31 121.20 121.84 3hb6 s ILE 262 Ca -0.07 -1.00 -0.00 0.00 -0.51 0.00 0.00 60.65 59.07 3hb6 s ILE 262 Cb -0.15 -1.81 0.06 0.00 0.15 0.00 0.00 42.46 40.71 3hb6 s ILE 262 CO 0.05 0.56 -0.03 -0.32 -2.11 0.00 0.00 174.94 173.08 3hb6 s MET 263 N 0.35 1.40 0.36 3.50 -2.45 0.14 -4.96 119.30 117.64 3hb6 s MET 263 Ca -0.18 -0.86 -0.28 0.00 -1.25 0.00 0.00 55.69 53.12 3hb6 s MET 263 Cb -0.18 -2.48 -0.12 0.00 1.25 0.00 0.00 34.83 33.31 3hb6 s MET 263 CO 0.09 -0.61 1.39 -2.30 1.05 0.00 0.00 175.02 174.64 3hb6 n PRO 264 N 4.76 2.39 -0.30 4.11 -0.02 -1.26 0.40 135.00 145.08 3hb6 n PRO 264 Ca -0.11 0.84 0.05 0.00 -2.02 0.00 0.00 63.50 62.26 3hb6 n PRO 264 Cb 0.45 -2.49 0.12 0.00 -0.02 0.00 0.00 33.50 31.55 3hb6 n PRO 264 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3hb6 n GLU 265 N 0.52 -0.08 0.29 -0.52 2.13 -0.93 -1.17 120.64 120.88 3hb6 n GLU 265 Ca 0.03 1.32 0.17 0.00 0.66 0.00 0.00 57.16 59.33 3hb6 n GLU 265 Cb 0.37 -1.97 0.86 0.00 0.27 0.00 0.00 31.44 30.97 3hb6 n GLU 265 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 3hb6 h LYS 266 N 0.00 0.00 0.00 5.31 2.10 -1.90 -2.73 116.57 119.35 3hb6 h LYS 266 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 3hb6 h LYS 266 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 3hb6 h LYS 266 CO -0.87 0.06 0.00 0.39 -2.00 0.00 0.00 179.45 177.03 3hb6 n GLU 267 N -3.36 0.10 0.19 0.07 1.02 -0.31 -3.54 120.64 114.81 3hb6 n GLU 267 Ca -0.02 0.07 0.06 0.00 -0.02 0.00 0.00 57.16 57.26 3hb6 n GLU 267 Cb 0.21 -1.50 0.37 0.00 -0.02 0.00 0.00 31.44 30.49 3hb6 n GLU 267 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hb6 h ALA 268 N 2.93 1.04 -0.03 0.62 0.00 -1.61 -2.78 119.26 119.45 3hb6 h ALA 268 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3hb6 h ALA 268 Cb 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hb6 h ALA 268 CO 0.00 0.45 0.00 -1.13 0.00 0.00 0.00 179.25 178.57 3hb6 n SER 269 N -3.58 2.45 -0.01 0.00 3.41 -1.23 -4.17 113.62 110.49 3hb6 n SER 269 Ca -0.00 -1.82 0.09 0.00 -0.26 0.00 0.00 58.87 56.88 3hb6 n SER 269 Cb 0.48 -0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.30 3hb6 n SER 269 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hb6 n THR 270 N 0.92 0.00 -2.88 6.66 -2.24 -1.06 -5.00 114.28 110.68 3hb6 n THR 270 Ca 0.16 -0.28 -0.39 0.00 -2.27 0.00 0.00 64.05 61.27 3hb6 n THR 270 Cb 0.51 0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 3hb6 n THR 270 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3hb6 s VAL 271 N -3.07 4.25 -1.51 2.28 -7.23 -1.17 -4.98 120.40 108.96 3hb6 s VAL 271 Ca -0.01 1.85 0.14 0.00 -1.81 0.00 0.00 61.98 62.14 3hb6 s VAL 271 Cb 0.13 -4.20 0.26 0.00 0.56 0.00 0.00 36.38 33.13 3hb6 s VAL 271 CO 0.78 0.48 1.34 -0.81 -0.31 0.00 0.00 175.10 176.58 3hb6 n PRO 272 N 1.46 0.23 -4.45 4.82 -0.04 -1.26 -4.78 135.00 130.98 3hb6 n PRO 272 Ca -0.04 0.14 -0.27 0.00 -0.04 0.00 0.00 63.50 63.29 3hb6 n PRO 272 Cb 0.48 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 3hb6 n PRO 272 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3hb6 s TYR 273 N -2.49 2.55 -0.51 0.54 -0.85 -1.26 -5.09 117.35 110.23 3hb6 s TYR 273 Ca 0.14 -0.63 -0.23 0.00 -0.52 0.00 0.00 57.07 55.83 3hb6 s TYR 273 Cb 0.09 -1.81 0.04 0.00 0.38 0.00 0.00 41.96 40.66 3hb6 s TYR 273 CO 0.20 0.37 0.83 1.21 -1.52 0.00 0.00 175.55 176.64 3hb6 s ASN 274 N -3.77 6.34 0.00 -0.18 3.84 -1.26 -4.92 114.94 115.00 3hb6 s ASN 274 Ca 0.37 -0.38 0.19 0.00 0.21 0.00 0.00 52.86 53.25 3hb6 s ASN 274 Cb 0.07 -2.39 1.10 0.00 -0.55 0.00 0.00 41.25 39.48 3hb6 s ASN 274 CO 0.19 -1.07 1.52 -0.81 -2.79 0.00 0.00 177.10 174.15 3hb6 n PRO 275 N 6.99 0.55 -0.50 0.43 -0.04 -1.26 -2.49 135.00 138.67 3hb6 n PRO 275 Ca 0.00 0.01 0.04 0.00 -0.04 0.00 0.00 63.50 63.52 3hb6 n PRO 275 Cb 0.47 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.64 3hb6 n PRO 275 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hb6 n PHE 276 N -1.04 0.68 -3.33 0.54 3.72 -1.26 -4.70 117.46 112.08 3hb6 n PHE 276 Ca 0.13 -1.22 -0.40 0.00 -0.05 0.00 0.00 57.45 55.92 3hb6 n PHE 276 Cb 0.07 -0.33 -0.09 0.00 -0.94 0.00 0.00 39.48 38.20 3hb6 n PHE 276 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hb6 s ASP 277 N -2.49 6.30 0.49 4.37 -1.08 -1.04 -4.44 116.67 118.79 3hb6 s ASP 277 Ca 0.40 0.28 0.32 0.00 -0.52 0.00 0.00 52.55 53.04 3hb6 s ASP 277 Cb 0.35 -2.23 1.34 0.00 -1.46 0.00 0.00 42.92 40.92 3hb6 s ASP 277 CO 0.03 -0.25 1.95 0.25 0.52 0.00 0.00 175.17 177.66 3hb6 h LEU 278 N 8.72 0.00 -1.58 -1.34 5.85 -1.91 -2.30 115.31 122.74 3hb6 h LEU 278 Ca -0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3hb6 h LEU 278 Cb 1.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3hb6 h LEU 278 CO 0.68 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.13 3hb6 n THR 279 N -2.90 0.53 -4.26 1.05 -2.24 -1.26 -2.63 114.28 102.57 3hb6 n THR 279 Ca 0.01 -0.56 -0.14 0.00 -2.27 0.00 0.00 64.05 61.08 3hb6 n THR 279 Cb 0.27 0.33 -0.10 0.00 -2.10 0.00 0.00 70.33 68.74 3hb6 n THR 279 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3hb6 s LYS 280 N -1.47 1.08 0.25 -0.78 1.02 -0.87 -4.83 119.74 114.14 3hb6 s LYS 280 Ca 0.30 -1.46 0.09 0.00 0.02 0.00 0.00 55.97 54.92 3hb6 s LYS 280 Cb 0.16 -0.66 -0.05 0.00 -0.52 0.00 0.00 37.83 36.76 3hb6 s LYS 280 CO 0.21 0.08 -0.14 0.14 -0.92 0.00 0.00 175.35 174.73 3hb6 s VAL 281 N -3.30 1.94 -0.04 3.17 -7.23 -1.26 -4.84 120.40 108.84 3hb6 s VAL 281 Ca 0.17 -2.24 -0.15 0.00 -1.81 0.00 0.00 61.98 57.95 3hb6 s VAL 281 Cb 0.02 -2.24 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 3hb6 s VAL 281 CO 0.01 -0.46 0.40 0.26 -0.31 0.00 0.00 175.10 175.01 3hb6 s TRP 282 N -2.84 3.67 0.39 2.82 0.51 -1.26 -5.06 118.94 117.16 3hb6 s TRP 282 Ca 0.27 0.93 -0.27 0.00 -2.12 0.00 0.00 56.10 54.91 3hb6 s TRP 282 Cb -0.01 -2.33 -0.09 0.00 -0.81 0.00 0.00 33.47 30.24 3hb6 s TRP 282 CO 0.11 0.54 1.33 -2.14 -0.51 0.00 0.00 176.95 176.27 3hb6 s PRO 283 N -0.67 4.06 0.43 4.98 0.02 -1.26 -4.90 135.00 137.65 3hb6 s PRO 283 Ca 0.23 2.22 0.20 0.00 0.02 0.00 0.00 61.00 63.67 3hb6 s PRO 283 Cb -0.16 -2.84 0.96 0.00 0.02 0.00 0.00 34.50 32.48 3hb6 s PRO 283 CO 0.12 -0.44 1.88 0.45 -0.33 0.00 0.00 177.00 178.68 3hb6 h HIS 284 N 2.85 0.00 -0.13 6.54 3.86 -1.98 -0.69 115.15 125.61 3hb6 h HIS 284 Ca -0.50 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 58.62 3hb6 h HIS 284 Cb 1.24 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 3hb6 h HIS 284 CO 0.54 0.28 -0.35 0.00 0.86 0.00 0.00 177.93 179.25 3hb6 h ALA 285 N 1.72 1.18 0.09 2.45 0.00 -2.00 -3.02 119.26 119.68 3hb6 h ALA 285 Ca -0.00 -0.37 -0.37 0.00 0.00 0.00 0.00 54.91 54.17 3hb6 h ALA 285 Cb 0.62 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3hb6 h ALA 285 CO 0.04 0.54 -2.13 -0.25 0.00 0.00 0.00 179.25 177.45 3hb6 n ASP 286 N -4.08 2.03 -3.76 0.00 8.00 -1.12 -4.81 116.55 112.82 3hb6 n ASP 286 Ca -0.01 0.12 -0.30 0.00 0.71 0.00 0.00 54.79 55.31 3hb6 n ASP 286 Cb 0.43 -0.70 -0.14 0.00 -0.02 0.00 0.00 41.12 40.69 3hb6 n ASP 286 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3hb6 s TYR 287 N -2.55 2.08 0.67 1.24 2.02 -0.28 -5.07 117.35 115.46 3hb6 s TYR 287 Ca -0.25 -2.21 -0.15 0.00 -0.37 0.00 0.00 57.07 54.09 3hb6 s TYR 287 Cb 0.07 -1.94 0.01 0.00 -0.40 0.00 0.00 41.96 39.69 3hb6 s TYR 287 CO 0.73 -0.84 1.11 -2.14 -1.57 0.00 0.00 175.55 172.84 3hb6 s PRO 288 N 0.93 2.73 -0.17 -1.71 0.02 -1.14 -4.26 135.00 131.39 3hb6 s PRO 288 Ca 0.14 1.40 -0.23 0.00 0.02 0.00 0.00 61.00 62.32 3hb6 s PRO 288 Cb -0.21 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 3hb6 s PRO 288 CO -0.11 -1.31 0.74 -0.51 -0.33 0.00 0.00 177.00 175.48 3hb6 s LEU 289 N -4.94 4.18 -0.12 -5.54 1.02 -1.26 -4.42 118.68 107.59 3hb6 s LEU 289 Ca 0.67 1.04 -0.03 0.00 0.02 0.00 0.00 54.13 55.83 3hb6 s LEU 289 Cb -0.21 -3.08 -0.03 0.00 0.02 0.00 0.00 46.19 42.89 3hb6 s LEU 289 CO 0.42 -0.32 -0.03 -0.04 0.02 0.00 0.00 176.35 176.41 3hb6 s MET 290 N 1.92 3.35 0.41 1.70 -1.94 0.27 -4.86 119.30 120.16 3hb6 s MET 290 Ca 0.34 -0.49 -0.25 0.00 -1.71 0.00 0.00 55.69 53.58 3hb6 s MET 290 Cb -0.16 -2.84 -0.08 0.00 2.01 0.00 0.00 34.83 33.75 3hb6 s MET 290 CO 0.12 0.43 1.19 -0.51 -0.01 0.00 0.00 175.02 176.24 3hb6 s ASP 291 N -0.16 6.44 0.09 3.03 1.01 -1.26 -0.76 116.67 125.07 3hb6 s ASP 291 Ca 0.03 2.38 0.00 0.00 0.71 0.00 0.00 52.55 55.68 3hb6 s ASP 291 Cb -0.13 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.19 3hb6 s ASP 291 CO 0.02 -0.73 0.00 0.52 0.21 0.00 0.00 175.17 175.19 3hb6 n VAL 292 N 0.01 0.63 -3.05 -1.27 0.31 -0.55 -4.62 118.33 109.78 3hb6 n VAL 292 Ca 0.05 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 3hb6 n VAL 292 Cb 0.46 -1.33 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 3hb6 n VAL 292 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hb6 n GLY 293 N 2.93 0.84 3.21 2.92 0.00 -1.20 -0.80 105.19 113.10 3hb6 n GLY 293 Ca 0.00 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 3hb6 n GLY 293 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hb6 s TYR 294 N -2.14 0.36 0.01 1.61 -0.85 -0.17 0.11 117.35 116.28 3hb6 s TYR 294 Ca 0.00 -0.78 0.03 0.00 -0.52 0.00 0.00 57.07 55.80 3hb6 s TYR 294 Cb 0.00 -0.16 -0.01 0.00 0.38 0.00 0.00 41.96 42.17 3hb6 s TYR 294 CO 0.00 -0.56 -0.10 -0.59 -1.52 0.00 0.00 175.55 172.78 3hb6 s PHE 295 N -3.92 0.87 -0.00 -3.49 -0.12 -0.52 -0.40 117.98 110.40 3hb6 s PHE 295 Ca 0.11 -0.25 0.04 0.00 -0.05 0.00 0.00 56.93 56.78 3hb6 s PHE 295 Cb 0.05 -0.54 -0.01 0.00 -0.63 0.00 0.00 43.02 41.89 3hb6 s PHE 295 CO -0.07 -0.01 -0.13 -1.83 -0.05 0.00 0.00 175.22 173.13 3hb6 s GLU 296 N -0.63 1.06 -0.47 1.99 -1.05 -0.64 -1.72 118.70 117.24 3hb6 s GLU 296 Ca 0.01 -0.52 -0.20 0.00 -0.15 0.00 0.00 54.97 54.11 3hb6 s GLU 296 Cb -0.05 -1.03 0.04 0.00 -0.44 0.00 0.00 34.13 32.64 3hb6 s GLU 296 CO 0.00 0.28 0.65 -0.51 0.95 0.00 0.00 175.26 176.63 3hb6 s LEU 297 N -0.43 4.63 0.00 1.83 1.43 -0.62 -1.56 118.68 123.96 3hb6 s LEU 297 Ca 0.05 -0.54 0.09 0.00 -1.03 0.00 0.00 54.13 52.70 3hb6 s LEU 297 Cb -0.05 -2.63 0.00 0.00 0.03 0.00 0.00 46.19 43.54 3hb6 s LEU 297 CO -0.00 -0.84 0.60 -0.46 0.23 0.00 0.00 176.35 175.88 3hb6 n ASN 298 N 6.29 1.16 -3.73 2.29 0.23 -0.80 -3.90 115.26 116.80 3hb6 n ASN 298 Ca -0.03 -1.08 -0.16 0.00 -0.53 0.00 0.00 54.58 52.78 3hb6 n ASN 298 Cb 0.47 0.45 -0.16 0.00 -2.08 0.00 0.00 39.78 38.46 3hb6 n ASN 298 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 3hb6 s ARG 299 N -1.22 -0.01 0.24 -3.83 3.52 -0.50 -5.01 118.95 112.12 3hb6 s ARG 299 Ca 0.07 0.33 -0.30 0.00 -0.13 0.00 0.00 55.73 55.71 3hb6 s ARG 299 Cb 0.07 -0.30 -0.09 0.00 -1.56 0.00 0.00 34.95 33.07 3hb6 s ARG 299 CO 0.22 -0.23 1.04 -0.80 -0.81 0.00 0.00 175.30 174.71 3hb6 s ASN 300 N 1.55 7.41 0.52 -2.12 0.02 -1.26 -0.18 114.94 120.88 3hb6 s ASN 300 Ca -0.04 2.10 -0.22 0.00 -1.02 0.00 0.00 52.86 53.68 3hb6 s ASN 300 Cb -0.12 -2.61 -0.06 0.00 0.02 0.00 0.00 41.25 38.48 3hb6 s ASN 300 CO -0.04 -0.05 1.33 -2.84 0.02 0.00 0.00 177.10 175.52 3hb6 s PRO 301 N -1.05 3.32 0.14 -0.60 0.02 -1.26 -4.87 135.00 130.69 3hb6 s PRO 301 Ca 0.44 2.17 -0.13 0.00 0.02 0.00 0.00 61.00 63.51 3hb6 s PRO 301 Cb -0.29 -2.33 0.01 0.00 0.02 0.00 0.00 34.50 31.91 3hb6 s PRO 301 CO 0.36 -1.03 1.60 -0.44 -0.33 0.00 0.00 177.00 177.16 3hb6 h ASP 302 N 1.67 0.78 -3.39 2.53 3.32 -2.00 -3.43 116.42 115.91 3hb6 h ASP 302 Ca -0.51 -0.29 -0.42 0.00 0.02 0.00 0.00 57.03 55.83 3hb6 h ASP 302 Cb 1.29 -0.21 -0.35 0.00 0.22 0.00 0.00 39.33 40.27 3hb6 h ASP 302 CO 0.58 0.88 -0.77 0.21 -1.72 0.00 0.00 179.24 178.43 3hb6 s ASN 303 N -6.27 1.17 0.07 6.45 3.84 -1.26 -5.06 114.94 113.88 3hb6 s ASN 303 Ca -0.13 -0.12 -0.22 0.00 0.21 0.00 0.00 52.86 52.61 3hb6 s ASN 303 Cb 0.11 -0.45 -0.13 0.00 -0.55 0.00 0.00 41.25 40.23 3hb6 s ASN 303 CO 0.81 -0.10 1.61 0.22 -2.79 0.00 0.00 177.10 176.84 3hb6 h TYR 304 N 7.59 0.15 0.41 0.43 5.03 -1.98 -1.53 116.97 127.07 3hb6 h TYR 304 Ca -0.32 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 60.96 3hb6 h TYR 304 Cb 1.14 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 39.38 3hb6 h TYR 304 CO 0.49 0.26 -0.20 0.35 -1.32 0.00 0.00 178.16 177.74 3hb6 h PHE 305 N 0.00 -0.51 -0.81 -3.82 3.57 -1.97 0.18 116.94 113.58 3hb6 h PHE 305 Ca 0.03 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3hb6 h PHE 305 Cb 0.17 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 3hb6 h PHE 305 CO -0.02 -0.32 0.44 0.77 -2.23 0.00 0.00 178.31 176.96 3hb6 h SER 306 N -0.55 1.02 0.09 0.41 0.02 -1.97 -0.89 113.55 111.69 3hb6 h SER 306 Ca -0.06 -0.10 -0.37 0.00 -0.84 0.00 0.00 61.79 60.42 3hb6 h SER 306 Cb 0.42 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 3hb6 h SER 306 CO 0.09 0.83 -2.24 0.47 -1.14 0.00 0.00 176.83 174.84 3hb6 n ASP 307 N -4.39 1.57 -0.11 3.07 8.00 -0.58 -4.38 116.55 119.72 3hb6 n ASP 307 Ca 0.08 0.05 -0.21 0.00 0.71 0.00 0.00 54.79 55.41 3hb6 n ASP 307 Cb 0.10 -0.27 -0.07 0.00 -0.02 0.00 0.00 41.12 40.86 3hb6 n ASP 307 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3hb6 n VAL 308 N -3.21 1.46 -0.27 2.53 0.31 0.50 -3.96 118.33 115.68 3hb6 n VAL 308 Ca -0.36 -0.19 -0.04 0.00 -0.01 0.00 0.00 64.34 63.74 3hb6 n VAL 308 Cb 1.04 -2.02 0.10 0.00 -0.91 0.00 0.00 33.84 32.06 3hb6 n VAL 308 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hb6 h GLU 309 N -0.94 1.15 -0.01 5.55 4.57 -1.18 -2.60 114.58 121.12 3hb6 h GLU 309 Ca -0.44 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.56 3hb6 h GLU 309 Cb 1.36 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 3hb6 h GLU 309 CO -0.26 0.91 0.00 1.04 -1.18 0.00 0.00 179.01 179.51 3hb6 n GLN 310 N -4.29 1.34 -2.10 1.92 6.02 -0.35 -4.90 117.38 115.02 3hb6 n GLN 310 Ca 0.07 -0.50 -0.41 0.00 -0.01 0.00 0.00 57.00 56.15 3hb6 n GLN 310 Cb 0.16 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 3hb6 n GLN 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hb6 s ALA 311 N -2.00 3.59 -0.22 -1.58 0.00 -0.98 -4.90 121.76 115.66 3hb6 s ALA 311 Ca 0.42 1.23 0.02 0.00 0.00 0.00 0.00 51.96 53.63 3hb6 s ALA 311 Cb 0.21 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.85 3hb6 s ALA 311 CO 0.35 -0.65 -0.14 0.00 0.00 0.00 0.00 175.76 175.32 3hb6 s ALA 312 N 0.12 2.41 -0.01 0.00 0.00 -1.26 -5.04 121.76 117.98 3hb6 s ALA 312 Ca 0.59 -1.51 0.03 0.00 0.00 0.00 0.00 51.96 51.07 3hb6 s ALA 312 Cb -0.39 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.28 3hb6 s ALA 312 CO 0.40 -0.86 -0.07 -0.06 0.00 0.00 0.00 175.76 175.18 3hb6 s PHE 313 N 1.20 2.90 -0.19 0.00 0.40 -1.26 -4.95 117.98 116.08 3hb6 s PHE 313 Ca -0.03 -0.03 -0.13 0.00 -0.60 0.00 0.00 56.93 56.14 3hb6 s PHE 313 Cb -0.17 -1.63 0.06 0.00 0.51 0.00 0.00 43.02 41.79 3hb6 s PHE 313 CO -0.08 0.36 0.48 0.45 0.70 0.00 0.00 175.22 177.14 3hb6 s SER 314 N -1.28 -0.59 0.55 1.36 0.15 -1.26 -4.88 113.70 107.75 3hb6 s SER 314 Ca 0.16 1.03 0.36 0.00 0.70 0.00 0.00 55.95 58.20 3hb6 s SER 314 Cb -0.11 0.96 1.77 0.00 -1.71 0.00 0.00 66.02 66.92 3hb6 s SER 314 CO 0.06 -0.19 2.09 -0.65 1.20 0.00 0.00 173.24 175.75 3hb6 h PRO 315 N 6.46 0.00 0.00 5.44 0.11 -1.84 -0.64 132.00 141.53 3hb6 h PRO 315 Ca -0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 3hb6 h PRO 315 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hb6 h PRO 315 CO 0.24 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 177.87 3hb6 h ALA 316 N 2.03 1.05 -1.00 -0.75 0.00 -1.89 -3.37 119.26 115.32 3hb6 h ALA 316 Ca 0.00 -0.14 -0.66 0.00 0.00 0.00 0.00 54.91 54.11 3hb6 h ALA 316 Cb 0.23 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 3hb6 h ALA 316 CO 0.00 0.19 1.91 -0.80 0.00 0.00 0.00 179.25 180.55 3hb6 s ASN 317 N -6.05 6.73 0.37 0.00 0.02 -0.25 -4.94 114.94 110.82 3hb6 s ASN 317 Ca 0.00 -2.12 0.08 0.00 -1.02 0.00 0.00 52.86 49.80 3hb6 s ASN 317 Cb 0.10 -2.57 -0.05 0.00 0.02 0.00 0.00 41.25 38.75 3hb6 s ASN 317 CO 0.60 -1.27 0.10 0.27 0.02 0.00 0.00 177.10 176.83 3hb6 s ILE 318 N 4.36 2.57 0.26 0.60 -4.36 -1.26 -0.83 121.20 122.54 3hb6 s ILE 318 Ca 0.50 -1.82 0.10 0.00 -0.26 0.00 0.00 60.65 59.17 3hb6 s ILE 318 Cb 0.02 -2.92 -0.05 0.00 1.25 0.00 0.00 42.46 40.76 3hb6 s ILE 318 CO 0.01 -0.12 -0.15 0.68 0.24 0.00 0.00 174.94 175.61 3hb6 s VAL 319 N -2.54 2.10 0.26 8.37 -7.23 -1.26 -4.82 120.40 115.28 3hb6 s VAL 319 Ca 0.38 -2.28 -0.31 0.00 -1.81 0.00 0.00 61.98 57.95 3hb6 s VAL 319 Cb 0.01 -2.29 -0.12 0.00 0.56 0.00 0.00 36.38 34.54 3hb6 s VAL 319 CO 0.21 -0.42 1.55 -2.65 -0.31 0.00 0.00 175.10 173.48 3hb6 n PRO 320 N -0.56 2.45 0.00 4.82 -0.02 -1.26 -1.78 135.00 138.65 3hb6 n PRO 320 Ca -0.06 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3hb6 n PRO 320 Cb 0.61 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3hb6 n PRO 320 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hb6 n GLY 321 N 2.48 2.04 3.06 -1.23 0.00 -1.26 -3.25 105.19 107.02 3hb6 n GLY 321 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 3hb6 n GLY 321 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb6 s ILE 322 N -2.44 1.22 0.00 -0.61 1.01 -0.73 -1.02 121.20 118.63 3hb6 s ILE 322 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.10 3hb6 s ILE 322 Cb 0.00 -1.09 0.00 0.00 0.01 0.00 0.00 42.46 41.38 3hb6 s ILE 322 CO 0.00 0.37 0.00 -0.24 0.00 0.00 0.00 174.94 175.07 3hb6 n SER 323 N 3.58 0.00 -1.46 3.58 2.88 -0.06 -4.19 113.62 117.94 3hb6 n SER 323 Ca -0.21 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.49 3hb6 n SER 323 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 3hb6 n SER 323 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3hb6 n PHE 324 N 0.00 -1.63 -3.78 0.66 3.72 -1.26 -1.57 117.46 113.60 3hb6 n PHE 324 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 3hb6 n PHE 324 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 3hb6 n PHE 324 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3hb6 s SER 325 N -1.00 -0.01 0.00 4.37 1.04 -1.26 -3.36 113.70 113.48 3hb6 s SER 325 Ca 0.00 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.89 3hb6 s SER 325 Cb 0.00 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.51 3hb6 s SER 325 CO 0.00 -0.78 0.49 -0.81 0.98 0.00 0.00 173.24 173.12 3hb6 n PRO 326 N -0.13 0.66 -1.64 4.02 -0.04 -1.26 -4.53 135.00 132.07 3hb6 n PRO 326 Ca -0.15 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.88 3hb6 n PRO 326 Cb 0.63 -1.17 -0.03 0.00 -0.04 0.00 0.00 33.50 32.89 3hb6 n PRO 326 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3hb6 s ASP 327 N -0.84 5.88 0.33 3.54 -1.08 -1.26 -4.84 116.67 118.40 3hb6 s ASP 327 Ca 0.00 2.21 0.11 0.00 -0.52 0.00 0.00 52.55 54.35 3hb6 s ASP 327 Cb 0.00 -2.52 0.92 0.00 -1.46 0.00 0.00 42.92 39.86 3hb6 s ASP 327 CO 0.00 -1.58 1.74 0.11 0.52 0.00 0.00 175.17 175.96 3hb6 h LYS 328 N 13.14 0.54 -0.36 4.34 1.57 -1.81 -0.63 116.57 133.36 3hb6 h LYS 328 Ca -0.44 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.15 3hb6 h LYS 328 Cb 1.24 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 3hb6 h LYS 328 CO 0.95 0.36 -0.38 0.52 -0.57 0.00 0.00 179.45 180.33 3hb6 h MET 329 N 0.56 0.89 -0.42 3.15 2.86 -1.89 -2.06 114.93 118.02 3hb6 h MET 329 Ca 0.63 -0.48 -0.08 0.00 -2.06 0.00 0.00 59.70 57.71 3hb6 h MET 329 Cb 1.27 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.93 3hb6 h MET 329 CO -0.44 1.13 -0.07 1.25 1.06 0.00 0.00 176.91 179.84 3hb6 h LEU 330 N 0.70 0.79 -1.32 1.22 5.85 -1.62 -2.76 115.31 118.17 3hb6 h LEU 330 Ca 0.06 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.51 3hb6 h LEU 330 Cb 0.97 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 3hb6 h LEU 330 CO 0.09 0.95 0.52 1.56 -0.34 0.00 0.00 178.44 181.22 3hb6 h GLN 331 N 0.62 0.77 -0.06 1.25 1.08 -1.09 -1.52 115.11 116.16 3hb6 h GLN 331 Ca 0.11 -0.05 -0.12 0.00 -1.45 0.00 0.00 58.65 57.14 3hb6 h GLN 331 Cb 0.58 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 3hb6 h GLN 331 CO 0.03 0.51 -0.51 0.78 -0.95 0.00 0.00 178.83 178.69 3hb6 h GLY 332 N 0.79 0.18 2.00 3.46 0.00 -1.10 -2.88 103.07 105.52 3hb6 h GLY 332 Ca 0.35 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3hb6 h GLY 332 CO -0.13 0.18 0.00 3.21 0.00 0.00 0.00 176.54 179.80 3hb6 h ARG 333 N 0.13 0.00 0.00 4.80 3.08 -1.01 -3.06 114.38 118.33 3hb6 h ARG 333 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hb6 h ARG 333 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 3hb6 h ARG 333 CO 0.08 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.26 3hb6 n LEU 334 N -2.81 0.16 -0.05 3.04 4.77 -1.09 -3.57 117.00 117.44 3hb6 n LEU 334 Ca 0.02 0.53 -0.08 0.00 -0.03 0.00 0.00 56.01 56.45 3hb6 n LEU 334 Cb 0.32 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 3hb6 n LEU 334 CO 0.26 -0.28 -0.57 0.33 -1.33 0.00 0.00 177.39 175.81 3hb6 n PHE 335 N -1.67 0.00 -0.31 -1.77 7.35 -1.16 -4.82 117.46 115.09 3hb6 n PHE 335 Ca 0.04 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.88 3hb6 n PHE 335 Cb 0.21 -0.39 0.32 0.00 0.35 0.00 0.00 39.48 39.97 3hb6 n PHE 335 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 3hb6 h SER 336 N -0.69 -0.04 0.07 -2.13 0.87 -1.63 -2.79 113.55 107.21 3hb6 h SER 336 Ca -0.07 0.22 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 3hb6 h SER 336 Cb 0.79 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 3hb6 h SER 336 CO -0.04 -0.21 -0.03 1.88 -0.53 0.00 0.00 176.83 177.90 3hb6 h TYR 337 N 0.16 -0.09 -0.94 2.24 -1.99 -1.88 0.35 116.97 114.82 3hb6 h TYR 337 Ca 0.59 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 61.33 3hb6 h TYR 337 Cb 1.24 0.03 -0.05 0.00 2.00 0.00 0.00 36.73 39.95 3hb6 h TYR 337 CO -0.27 0.32 0.62 0.78 -0.00 0.00 0.00 178.16 179.61 3hb6 h GLY 338 N -0.52 1.34 0.99 3.88 0.00 -1.85 0.90 103.07 107.81 3hb6 h GLY 338 Ca -0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 3hb6 h GLY 338 CO 0.02 0.46 0.28 -1.80 0.00 0.00 0.00 176.54 175.50 3hb6 h ASP 339 N 1.25 0.74 -0.46 0.19 3.58 -1.46 -1.67 116.42 118.59 3hb6 h ASP 339 Ca 0.35 -0.12 -0.11 0.00 0.42 0.00 0.00 57.03 57.57 3hb6 h ASP 339 Cb -0.10 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 40.74 3hb6 h ASP 339 CO -0.09 0.66 -0.14 0.00 -2.88 0.00 0.00 179.24 176.78 3hb6 h ALA 340 N 1.11 0.81 -0.43 -0.78 0.00 -0.14 -3.07 119.26 116.76 3hb6 h ALA 340 Ca 0.20 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3hb6 h ALA 340 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hb6 h ALA 340 CO -0.03 0.66 0.08 0.45 0.00 0.00 0.00 179.25 180.41 3hb6 h HIS 341 N 0.83 0.75 0.00 0.00 3.86 -0.57 -0.69 115.15 119.33 3hb6 h HIS 341 Ca 0.13 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 3hb6 h HIS 341 Cb 0.69 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 3hb6 h HIS 341 CO 0.04 0.71 -0.11 0.00 0.86 0.00 0.00 177.93 179.44 3hb6 h ARG 342 N 0.57 0.00 0.00 2.45 3.08 -1.28 0.18 114.38 119.37 3hb6 h ARG 342 Ca 0.13 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3hb6 h ARG 342 Cb 0.36 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 3hb6 h ARG 342 CO 0.01 0.11 -0.19 -0.92 -1.07 0.00 0.00 179.97 177.90 3hb6 h TYR 343 N 0.00 0.00 -0.85 3.04 3.20 -1.40 -2.72 116.97 118.24 3hb6 h TYR 343 Ca -0.00 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 3hb6 h TYR 343 Cb 0.23 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 3hb6 h TYR 343 CO 0.00 0.39 0.43 -0.09 -1.64 0.00 0.00 178.16 177.25 3hb6 h ARG 344 N -1.00 1.21 0.00 1.82 2.43 -1.03 -3.36 114.38 114.44 3hb6 h ARG 344 Ca -0.03 -0.16 -0.20 0.00 -0.81 0.00 0.00 59.98 58.78 3hb6 h ARG 344 Cb 0.45 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 3hb6 h ARG 344 CO -0.02 0.91 -1.76 1.28 -1.51 0.00 0.00 179.97 178.87 3hb6 n LEU 345 N -4.34 0.90 0.00 3.80 4.77 0.61 -4.40 117.00 118.34 3hb6 n LEU 345 Ca 0.08 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 3hb6 n LEU 345 Cb 0.12 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3hb6 n LEU 345 CO 0.39 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 3hb6 n GLY 346 N 2.48 2.80 0.24 -0.72 0.00 -1.03 -4.84 105.19 104.12 3hb6 n GLY 346 Ca -0.20 -2.03 0.01 0.00 0.00 0.00 0.00 46.02 43.80 3hb6 n GLY 346 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3hb6 h VAL 347 N 0.00 1.20 -0.67 1.61 3.04 -1.87 -3.23 116.25 116.32 3hb6 h VAL 347 Ca 0.00 -0.89 -0.43 0.00 -1.01 0.00 0.00 66.70 64.37 3hb6 h VAL 347 Cb 0.00 1.25 -0.20 0.00 -2.01 0.00 0.00 31.29 30.33 3hb6 h VAL 347 CO 0.00 0.28 0.55 0.59 -1.01 0.00 0.00 177.57 177.98 3hb6 n ASN 348 N -4.24 6.05 0.05 3.17 3.02 -1.26 -4.62 115.26 117.43 3hb6 n ASN 348 Ca -0.01 -3.27 0.06 0.00 -0.03 0.00 0.00 54.58 51.33 3hb6 n ASN 348 Cb 0.30 -0.95 0.30 0.00 -0.61 0.00 0.00 39.78 38.81 3hb6 n ASN 348 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hb6 n HIS 349 N -0.26 0.27 0.30 3.10 1.44 -1.22 -2.40 115.22 116.45 3hb6 n HIS 349 Ca 0.42 0.12 0.18 0.00 -2.01 0.00 0.00 57.72 56.44 3hb6 n HIS 349 Cb 0.79 -0.70 0.87 0.00 0.12 0.00 0.00 29.99 31.07 3hb6 n HIS 349 CO 0.00 0.00 0.00 1.12 -2.81 0.00 0.00 176.34 174.65 3hb6 h HIS 350 N 0.00 0.00 0.00 -1.40 2.07 -1.90 -2.54 115.15 111.38 3hb6 h HIS 350 Ca 0.00 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.49 3hb6 h HIS 350 Cb 0.16 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.13 3hb6 h HIS 350 CO 0.00 0.02 -0.16 1.96 -3.07 0.00 0.00 177.93 176.69 3hb6 h GLN 351 N 0.00 0.00 -6.27 5.12 4.20 -1.84 -3.24 115.11 113.08 3hb6 h GLN 351 Ca -0.00 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.16 3hb6 h GLN 351 Cb 0.32 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 3hb6 h GLN 351 CO 0.00 0.16 1.05 0.42 -0.67 0.00 0.00 178.83 179.79 3hb6 s ILE 352 N -3.49 3.63 0.32 2.54 1.01 -0.96 -4.89 121.20 119.36 3hb6 s ILE 352 Ca 0.02 0.80 0.08 0.00 0.00 0.00 0.00 60.65 61.55 3hb6 s ILE 352 Cb 0.09 -3.52 0.39 0.00 0.01 0.00 0.00 42.46 39.43 3hb6 s ILE 352 CO 0.63 -0.06 1.54 -2.65 0.00 0.00 0.00 174.94 174.40 3hb6 n PRO 353 N 6.88 -0.07 0.18 2.79 -0.02 -1.26 -0.75 135.00 142.75 3hb6 n PRO 353 Ca 0.17 1.43 0.02 0.00 -2.02 0.00 0.00 63.50 63.10 3hb6 n PRO 353 Cb 0.43 -2.37 0.35 0.00 -0.02 0.00 0.00 33.50 31.89 3hb6 n PRO 353 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3hb6 h VAL 354 N 0.00 1.27 0.00 -1.45 3.04 -1.90 -2.96 116.25 114.26 3hb6 h VAL 354 Ca 0.67 -1.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 3hb6 h VAL 354 Cb 1.54 1.70 0.00 0.00 -2.01 0.00 0.00 31.29 32.53 3hb6 h VAL 354 CO -0.87 0.37 -0.79 0.78 -1.01 0.00 0.00 177.57 176.06 3hb6 h ASN 355 N 0.00 0.00 -4.03 3.17 2.35 -1.23 -3.48 115.58 112.36 3hb6 h ASN 355 Ca -0.00 -0.15 -0.50 0.00 -0.55 0.00 0.00 56.30 55.09 3hb6 h ASN 355 Cb 0.67 0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.11 3hb6 h ASN 355 CO 0.05 0.07 0.46 0.00 -1.65 0.00 0.00 177.43 176.37 3hb6 s ALA 356 N -3.24 2.89 0.48 -0.83 0.00 -0.73 -4.87 121.76 115.46 3hb6 s ALA 356 Ca 0.04 0.88 -0.19 0.00 0.00 0.00 0.00 51.96 52.69 3hb6 s ALA 356 Cb 0.12 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.78 3hb6 s ALA 356 CO 0.75 -0.66 0.98 -1.25 0.00 0.00 0.00 175.76 175.58 3hb6 s PRO 357 N -2.88 4.00 -0.56 0.00 0.04 -1.26 -4.98 135.00 129.36 3hb6 s PRO 357 Ca 0.66 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.82 3hb6 s PRO 357 Cb -0.27 -2.14 0.41 0.00 0.04 0.00 0.00 34.50 32.55 3hb6 s PRO 357 CO 0.32 -0.23 1.55 1.63 0.04 0.00 0.00 177.00 180.30 3hb6 n LYS 358 N -1.15 3.15 -3.79 4.56 5.02 -1.26 -4.98 118.16 119.71 3hb6 n LYS 358 Ca 0.07 -3.95 -0.10 0.00 -2.02 0.00 0.00 58.31 52.32 3hb6 n LYS 358 Cb 0.54 -2.27 -0.05 0.00 -0.02 0.00 0.00 35.03 33.23 3hb6 n LYS 358 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hb6 s PRO 360 N -3.88 4.18 0.02 0.00 0.02 -1.26 -5.00 135.00 129.07 3hb6 s PRO 360 Ca 0.10 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.56 3hb6 s PRO 360 Cb 0.02 -3.32 -0.02 0.00 0.02 0.00 0.00 34.50 31.19 3hb6 s PRO 360 CO -0.05 -0.71 -0.03 -0.59 -0.33 0.00 0.00 177.00 175.29 3hb6 s PHE 361 N 1.78 0.26 -0.41 6.54 -0.12 -1.26 -4.96 117.98 119.82 3hb6 s PHE 361 Ca 0.74 -0.53 0.02 0.00 -0.05 0.00 0.00 56.93 57.11 3hb6 s PHE 361 Cb -0.44 -0.19 0.12 0.00 -0.63 0.00 0.00 43.02 41.87 3hb6 s PHE 361 CO 0.32 -0.19 0.17 -1.58 -0.05 0.00 0.00 175.22 173.90 3hb6 s HIS 362 N -1.46 2.48 -0.15 3.49 2.46 -1.26 -5.10 115.29 115.75 3hb6 s HIS 362 Ca -0.16 -2.52 -0.29 0.00 0.47 0.00 0.00 55.06 52.56 3hb6 s HIS 362 Cb -0.10 -2.22 -0.01 0.00 -0.13 0.00 0.00 32.58 30.12 3hb6 s HIS 362 CO -0.01 -0.83 1.16 1.21 -2.47 0.00 0.00 174.74 173.80 3hb6 s ASN 363 N 0.63 7.04 -0.01 9.88 2.47 -1.26 -4.95 114.94 128.74 3hb6 s ASN 363 Ca 0.14 1.62 -0.13 0.00 0.42 0.00 0.00 52.86 54.91 3hb6 s ASN 363 Cb -0.22 -2.54 -0.33 0.00 -1.45 0.00 0.00 41.25 36.70 3hb6 s ASN 363 CO -0.07 -0.66 0.84 0.22 -3.72 0.00 0.00 177.10 173.71 3hb6 h TYR 364 N 7.71 0.83 -0.58 0.43 3.20 -1.98 -3.42 116.97 123.16 3hb6 h TYR 364 Ca -0.27 -0.61 -0.72 0.00 3.14 0.00 0.00 58.73 60.27 3hb6 h TYR 364 Cb 1.11 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.32 3hb6 h TYR 364 CO 0.76 1.61 1.35 0.72 -1.64 0.00 0.00 178.16 180.96 3hb6 n HIS 365 N -3.64 1.40 -3.33 -3.82 8.25 -1.26 -4.79 115.22 108.03 3hb6 n HIS 365 Ca -0.20 0.53 -0.38 0.00 -0.26 0.00 0.00 57.72 57.40 3hb6 n HIS 365 Cb 1.09 -2.41 -0.06 0.00 1.12 0.00 0.00 29.99 29.73 3hb6 n HIS 365 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 3hb6 s ARG 366 N 6.01 4.14 6.28 -0.41 3.52 -1.26 -4.30 118.95 132.93 3hb6 s ARG 366 Ca 1.14 0.64 0.00 0.00 -0.13 0.00 0.00 55.73 57.38 3hb6 s ARG 366 Cb -1.18 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 28.96 3hb6 s ARG 366 CO 0.58 0.61 0.00 -0.25 -0.81 0.00 0.00 175.30 175.43 3hb6 n ASP 367 N 1.91 0.00 0.00 -2.12 8.00 -1.26 -5.04 116.55 118.04 3hb6 n ASP 367 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 3hb6 n ASP 367 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 3hb6 n ASP 367 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hb6 n GLY 368 N 0.00 -0.67 3.77 0.44 0.00 -1.26 -4.75 105.19 102.73 3hb6 n GLY 368 Ca 0.00 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 43.96 3hb6 n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb6 s ALA 369 N -2.69 3.42 -1.28 4.61 0.00 -1.26 -3.62 121.76 120.95 3hb6 s ALA 369 Ca 0.00 1.49 -0.05 0.00 0.00 0.00 0.00 51.96 53.41 3hb6 s ALA 369 Cb 0.00 -3.59 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 3hb6 s ALA 369 CO 0.00 -1.07 0.67 -0.12 0.00 0.00 0.00 175.76 175.24 3hb6 n MET 370 N 0.21 -3.64 -2.79 0.00 0.00 -1.26 -4.39 117.12 105.26 3hb6 n MET 370 Ca 0.03 0.56 -0.43 0.00 -0.00 0.00 0.00 57.70 57.86 3hb6 n MET 370 Cb 0.41 -4.86 -0.04 0.00 0.00 0.00 0.00 33.22 28.73 3hb6 n MET 370 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 3hb6 s ARG 371 N -6.00 3.26 -0.00 2.12 6.06 -1.24 -4.83 118.95 118.31 3hb6 s ARG 371 Ca 0.13 -0.40 0.10 0.00 -2.50 0.00 0.00 55.73 53.06 3hb6 s ARG 371 Cb -0.04 -4.12 -0.11 0.00 0.06 0.00 0.00 34.95 30.74 3hb6 s ARG 371 CO 0.83 -1.69 0.41 1.33 -2.50 0.00 0.00 175.30 173.69 3hb6 n VAL 372 N 6.17 0.00 1.34 7.11 0.24 -1.26 -4.70 118.33 127.23 3hb6 n VAL 372 Ca 0.01 -0.26 0.06 0.00 -2.04 0.00 0.00 64.34 62.10 3hb6 n VAL 372 Cb 0.47 0.93 0.20 0.00 -1.47 0.00 0.00 33.84 33.97 3hb6 n VAL 372 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3hb6 n ASP 373 N -1.30 1.18 0.00 -1.34 5.68 -1.26 -4.89 116.55 114.62 3hb6 n ASP 373 Ca 0.02 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 3hb6 n ASP 373 Cb 0.17 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 3hb6 n ASP 373 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hb6 n GLY 374 N 0.91 0.57 3.81 6.12 0.00 -1.26 -4.99 105.19 110.34 3hb6 n GLY 374 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.15 3hb6 n GLY 374 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hb6 n ASN 375 N 0.00 -2.24 -0.16 1.61 2.85 -1.26 -4.62 115.26 111.44 3hb6 n ASN 375 Ca 0.00 0.24 0.13 0.00 -0.11 0.00 0.00 54.58 54.84 3hb6 n ASN 375 Cb 0.00 -0.66 0.48 0.00 1.24 0.00 0.00 39.78 40.84 3hb6 n ASN 375 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3hb6 n SER 376 N -1.09 0.70 0.00 1.20 3.41 -1.26 -4.98 113.62 111.59 3hb6 n SER 376 Ca 0.00 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 3hb6 n SER 376 Cb 0.10 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 3hb6 n SER 376 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hb6 n GLY 377 N 1.33 4.22 1.06 5.00 0.00 -1.26 -4.83 105.19 110.71 3hb6 n GLY 377 Ca 0.13 -0.53 0.12 0.00 0.00 0.00 0.00 46.02 45.74 3hb6 n GLY 377 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hb6 n ASN 378 N 0.00 3.25 0.00 1.61 3.02 -1.26 -4.86 115.26 117.02 3hb6 n ASN 378 Ca 0.00 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 3hb6 n ASN 378 Cb 0.00 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.03 3hb6 n ASN 378 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hb6 n GLY 379 N 1.42 1.67 3.67 7.41 0.00 -1.26 -5.07 105.19 113.03 3hb6 n GLY 379 Ca 0.17 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 3hb6 n GLY 379 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb6 s ILE 380 N 1.14 4.11 -0.09 -0.61 1.01 -1.26 -4.89 121.20 120.61 3hb6 s ILE 380 Ca 0.00 1.41 0.13 0.00 0.00 0.00 0.00 60.65 62.19 3hb6 s ILE 380 Cb 0.00 -3.91 0.22 0.00 0.01 0.00 0.00 42.46 38.78 3hb6 s ILE 380 CO 0.00 -0.06 1.11 0.35 0.00 0.00 0.00 174.94 176.34 3hb6 n THR 381 N 5.00 1.24 -4.26 2.92 -2.24 -1.26 -4.79 114.28 110.89 3hb6 n THR 381 Ca 0.13 -1.59 -0.14 0.00 -2.27 0.00 0.00 64.05 60.18 3hb6 n THR 381 Cb 0.45 0.05 -0.10 0.00 -2.10 0.00 0.00 70.33 68.62 3hb6 n THR 381 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3hb6 s TYR 382 N -1.88 1.27 -0.14 4.78 1.13 -1.26 -5.05 117.35 116.20 3hb6 s TYR 382 Ca 0.23 -0.96 -0.09 0.00 -1.41 0.00 0.00 57.07 54.83 3hb6 s TYR 382 Cb 0.20 -0.72 0.05 0.00 -1.10 0.00 0.00 41.96 40.40 3hb6 s TYR 382 CO 0.00 -0.14 0.34 -2.00 -2.51 0.00 0.00 175.55 171.24 3hb6 s GLU 383 N -3.88 0.33 0.44 -3.49 -6.30 -1.26 -4.44 118.70 100.10 3hb6 s GLU 383 Ca 0.23 0.61 -0.24 0.00 -2.50 0.00 0.00 54.97 53.07 3hb6 s GLU 383 Cb 0.06 0.01 -0.08 0.00 0.00 0.00 0.00 34.13 34.12 3hb6 s GLU 383 CO 0.04 -0.12 1.17 -2.14 0.02 0.00 0.00 175.26 174.23 3hb6 s PRO 384 N 0.97 3.86 0.25 4.30 0.02 -1.26 -5.21 135.00 137.93 3hb6 s PRO 384 Ca -0.06 1.81 0.02 0.00 0.02 0.00 0.00 61.00 62.79 3hb6 s PRO 384 Cb -0.07 -2.50 -0.04 0.00 0.02 0.00 0.00 34.50 31.91 3hb6 s PRO 384 CO -0.07 -0.48 0.18 0.54 -0.33 0.00 0.00 177.00 176.84 3hb6 s ASN 385 N -1.27 0.76 -0.08 2.53 2.20 -1.26 -5.06 114.94 112.77 3hb6 s ASN 385 Ca 0.61 -1.53 0.15 0.00 -0.94 0.00 0.00 52.86 51.15 3hb6 s ASN 385 Cb -0.30 0.44 0.49 0.00 -2.00 0.00 0.00 41.25 39.88 3hb6 s ASN 385 CO 0.36 -0.92 1.41 -1.20 -2.94 0.00 0.00 177.10 173.81 3hb6 n SER 386 N -0.76 3.70 -0.74 3.54 7.64 -1.26 -4.52 113.62 121.22 3hb6 n SER 386 Ca 0.04 -2.39 0.06 0.00 1.01 0.00 0.00 58.87 57.59 3hb6 n SER 386 Cb 0.65 -0.42 0.18 0.00 -1.01 0.00 0.00 64.21 63.61 3hb6 n SER 386 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hb6 n GLY 387 N 0.43 2.76 2.43 0.23 0.00 -1.26 -4.98 105.19 104.80 3hb6 n GLY 387 Ca 0.18 -0.44 -0.19 0.00 0.00 0.00 0.00 46.02 45.57 3hb6 n GLY 387 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb6 n GLY 388 N 0.64 0.28 3.85 -0.02 0.00 -1.26 -5.00 105.19 103.68 3hb6 n GLY 388 Ca 0.13 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 3hb6 n GLY 388 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hb6 s VAL 389 N -2.89 5.06 -1.46 1.61 1.01 -1.26 -4.60 120.40 117.87 3hb6 s VAL 389 Ca 0.00 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 3hb6 s VAL 389 Cb 0.00 -3.37 0.06 0.00 0.00 0.00 0.00 36.38 33.07 3hb6 s VAL 389 CO 0.00 0.28 0.97 0.49 0.00 0.00 0.00 175.10 176.84 3hb6 n PHE 390 N 0.88 -2.33 -2.56 5.22 3.72 -1.26 -4.78 117.46 116.35 3hb6 n PHE 390 Ca -0.11 0.91 -0.42 0.00 -0.05 0.00 0.00 57.45 57.79 3hb6 n PHE 390 Cb 0.52 -4.26 -0.03 0.00 -0.94 0.00 0.00 39.48 34.77 3hb6 n PHE 390 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3hb6 s GLN 391 N -6.42 4.52 0.86 -1.08 -1.52 -1.26 -4.95 119.66 109.80 3hb6 s GLN 391 Ca 0.51 1.61 -0.11 0.00 -1.95 0.00 0.00 55.36 55.43 3hb6 s GLN 391 Cb -0.25 -3.38 0.11 0.00 -0.22 0.00 0.00 33.01 29.27 3hb6 s GLN 391 CO 0.81 -0.10 1.10 -1.83 -0.25 0.00 0.00 175.29 175.01 3hb6 s GLU 392 N 0.77 1.56 -0.59 2.91 -1.05 -1.26 -5.02 118.70 116.01 3hb6 s GLU 392 Ca 0.54 1.13 0.01 0.00 -0.15 0.00 0.00 54.97 56.50 3hb6 s GLU 392 Cb -0.26 -1.82 0.15 0.00 -0.44 0.00 0.00 34.13 31.76 3hb6 s GLU 392 CO 0.30 -2.12 0.37 -0.65 0.95 0.00 0.00 175.26 174.11 3hb6 s GLN 393 N -4.84 2.32 0.55 -4.83 -0.21 -1.26 -4.96 119.66 106.42 3hb6 s GLN 393 Ca 0.63 -2.66 0.36 0.00 0.02 0.00 0.00 55.36 53.72 3hb6 s GLN 393 Cb -0.19 -3.53 1.82 0.00 1.00 0.00 0.00 33.01 32.11 3hb6 s GLN 393 CO 0.57 -1.15 2.10 -1.35 -2.12 0.00 0.00 175.29 173.34 3hb6 h PRO 394 N 6.64 0.00 0.00 2.91 0.11 -2.02 -2.86 132.00 136.78 3hb6 h PRO 394 Ca -0.03 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 3hb6 h PRO 394 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 3hb6 h PRO 394 CO 0.71 0.00 -0.05 -0.44 -0.21 0.00 0.00 178.00 178.01 3hb6 h ASP 395 N 0.00 0.00 -0.55 -2.05 3.32 -2.04 -2.71 116.42 112.39 3hb6 h ASP 395 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hb6 h ASP 395 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3hb6 h ASP 395 CO 0.00 0.05 0.00 0.49 -1.72 0.00 0.00 179.24 178.06 3hb6 n PHE 396 N -3.23 1.88 -1.71 4.55 3.72 -1.08 -4.99 117.46 116.60 3hb6 n PHE 396 Ca -0.01 -0.66 -0.43 0.00 -0.05 0.00 0.00 57.45 56.31 3hb6 n PHE 396 Cb 0.26 -0.46 -0.01 0.00 -0.94 0.00 0.00 39.48 38.33 3hb6 n PHE 396 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3hb6 n LYS 397 N 0.64 2.30 -4.20 -1.08 5.02 -1.03 -4.99 118.16 114.83 3hb6 n LYS 397 Ca 0.26 0.81 -0.32 0.00 -2.02 0.00 0.00 58.31 57.04 3hb6 n LYS 397 Cb 1.10 -2.48 -0.08 0.00 -0.02 0.00 0.00 35.03 33.55 3hb6 n LYS 397 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3hb6 s GLU 398 N -1.14 2.85 0.75 1.97 2.02 -1.26 -4.99 118.70 118.91 3hb6 s GLU 398 Ca 0.61 -0.60 -0.13 0.00 0.02 0.00 0.00 54.97 54.87 3hb6 s GLU 398 Cb -0.57 -2.72 0.05 0.00 0.10 0.00 0.00 34.13 31.00 3hb6 s GLU 398 CO 0.55 0.62 1.16 -1.25 0.02 0.00 0.00 175.26 176.36 3hb6 s PRO 399 N -1.74 2.10 0.81 0.39 0.04 -1.26 -5.01 135.00 130.33 3hb6 s PRO 399 Ca 0.22 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.70 3hb6 s PRO 399 Cb -0.12 -1.85 0.08 0.00 0.04 0.00 0.00 34.50 32.65 3hb6 s PRO 399 CO 0.13 -1.82 1.09 -2.14 0.04 0.00 0.00 177.00 174.30 3hb6 s PRO 400 N -4.23 1.91 -0.18 0.56 0.02 -1.26 -5.05 135.00 126.78 3hb6 s PRO 400 Ca 0.69 1.10 0.01 0.00 0.02 0.00 0.00 61.00 62.82 3hb6 s PRO 400 Cb -0.24 -1.86 0.03 0.00 0.02 0.00 0.00 34.50 32.44 3hb6 s PRO 400 CO 0.48 -1.86 -0.15 -1.17 -0.33 0.00 0.00 177.00 173.97 3hb6 s LEU 401 N -6.05 2.08 0.46 -5.54 2.96 -1.26 -5.11 118.68 106.22 3hb6 s LEU 401 Ca 0.62 -0.68 -0.24 0.00 -0.22 0.00 0.00 54.13 53.60 3hb6 s LEU 401 Cb -0.18 -1.32 -0.08 0.00 0.50 0.00 0.00 46.19 45.12 3hb6 s LEU 401 CO 0.56 -0.06 1.33 -0.94 -1.32 0.00 0.00 176.35 175.92 3hb6 s SER 402 N 1.37 5.95 -0.16 3.68 1.04 -1.26 -5.03 113.70 119.29 3hb6 s SER 402 Ca 0.03 2.70 -0.02 0.00 0.48 0.00 0.00 55.95 59.14 3hb6 s SER 402 Cb -0.14 -2.64 -0.01 0.00 0.10 0.00 0.00 66.02 63.33 3hb6 s SER 402 CO -0.11 -1.10 -0.10 -0.63 0.98 0.00 0.00 173.24 172.29 3hb6 s ILE 403 N -1.29 3.19 -0.25 -1.02 1.01 -1.26 -5.10 121.20 116.49 3hb6 s ILE 403 Ca 0.62 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.66 3hb6 s ILE 403 Cb -0.39 -2.38 0.02 0.00 0.01 0.00 0.00 42.46 39.72 3hb6 s ILE 403 CO 0.49 0.49 -0.05 -1.61 0.00 0.00 0.00 174.94 174.25 3hb6 s GLU 404 N 0.76 2.94 0.00 2.79 8.01 -1.26 -5.04 118.70 126.90 3hb6 s GLU 404 Ca -0.04 -0.91 0.00 0.00 0.01 0.00 0.00 54.97 54.03 3hb6 s GLU 404 Cb -0.15 -3.00 0.00 0.00 -4.31 0.00 0.00 34.13 26.67 3hb6 s GLU 404 CO 0.02 -0.37 0.00 0.41 0.01 0.00 0.00 175.26 175.33 3hb6 n GLY 405 N 4.70 2.11 3.94 -1.39 0.00 -1.26 -5.08 105.19 108.21 3hb6 n GLY 405 Ca -0.17 -1.97 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 3hb6 n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb6 s ALA 406 N -2.55 3.26 -0.21 4.61 0.00 -1.26 -5.05 121.76 120.57 3hb6 s ALA 406 Ca 0.00 -1.04 -0.27 0.00 0.00 0.00 0.00 51.96 50.65 3hb6 s ALA 406 Cb 0.00 -2.50 -0.00 0.00 0.00 0.00 0.00 23.12 20.62 3hb6 s ALA 406 CO 0.00 -1.27 0.94 0.00 0.00 0.00 0.00 175.76 175.43 3hb6 s ALA 407 N -3.19 3.61 0.09 0.00 0.00 -1.26 -4.99 121.76 116.02 3hb6 s ALA 407 Ca 0.61 0.09 -0.26 0.00 0.00 0.00 0.00 51.96 52.40 3hb6 s ALA 407 Cb -0.10 -3.40 0.09 0.00 0.00 0.00 0.00 23.12 19.70 3hb6 s ALA 407 CO 0.44 -0.88 1.12 0.34 0.00 0.00 0.00 175.76 176.78 3hb6 s ASP 408 N 1.22 -0.06 -0.62 0.00 -1.08 -1.26 -5.09 116.67 109.78 3hb6 s ASP 408 Ca 0.41 -0.39 -0.23 0.00 -0.52 0.00 0.00 52.55 51.83 3hb6 s ASP 408 Cb -0.16 0.35 0.06 0.00 -1.46 0.00 0.00 42.92 41.72 3hb6 s ASP 408 CO 0.09 -0.68 0.93 -1.00 0.52 0.00 0.00 175.17 175.03 3hb6 s HIS 409 N -2.51 2.74 -0.23 -5.34 3.76 -1.26 -5.02 115.29 107.44 3hb6 s HIS 409 Ca 0.18 -0.40 -0.18 0.00 -0.15 0.00 0.00 55.06 54.51 3hb6 s HIS 409 Cb 0.00 -4.17 -0.03 0.00 1.11 0.00 0.00 32.58 29.49 3hb6 s HIS 409 CO 0.01 -1.51 0.52 -1.58 -0.85 0.00 0.00 174.74 171.33 3hb6 s TRP 410 N 3.90 3.32 -0.29 1.40 0.52 -1.26 -5.03 118.94 121.50 3hb6 s TRP 410 Ca 0.24 0.71 -0.29 0.00 0.02 0.00 0.00 56.10 56.78 3hb6 s TRP 410 Cb -0.16 -2.70 -0.02 0.00 -1.15 0.00 0.00 33.47 29.44 3hb6 s TRP 410 CO 0.13 -0.19 1.79 1.21 0.02 0.00 0.00 176.95 179.90 3hb6 s ASN 411 N 1.34 5.97 0.15 2.95 3.84 -1.26 -4.87 114.94 123.06 3hb6 s ASN 411 Ca 0.23 1.42 0.21 0.00 0.21 0.00 0.00 52.86 54.93 3hb6 s ASN 411 Cb -0.15 -2.53 0.86 0.00 -0.55 0.00 0.00 41.25 38.88 3hb6 s ASN 411 CO 0.09 -1.62 1.65 0.00 -2.79 0.00 0.00 177.10 174.43 3hb6 n HIS 412 N 9.95 0.50 1.38 0.43 1.44 -1.26 -3.14 115.22 124.52 3hb6 n HIS 412 Ca 0.22 0.19 0.00 0.00 -2.01 0.00 0.00 57.72 56.12 3hb6 n HIS 412 Cb 0.46 -0.80 0.00 0.00 0.12 0.00 0.00 29.99 29.77 3hb6 n HIS 412 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3hb6 n ARG 413 N -1.95 0.79 0.16 -1.40 1.74 -1.26 -2.01 116.66 112.73 3hb6 n ARG 413 Ca 0.03 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.16 3hb6 n ARG 413 Cb 0.24 -1.10 0.11 0.00 -1.02 0.00 0.00 32.46 30.68 3hb6 n ARG 413 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3hb6 h GLU 414 N 0.05 0.00 -4.26 5.56 4.39 -1.97 -3.37 114.58 114.99 3hb6 h GLU 414 Ca 0.00 0.00 -0.74 0.00 0.34 0.00 0.00 59.36 58.96 3hb6 h GLU 414 Cb 0.10 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 28.52 3hb6 h GLU 414 CO 0.00 0.41 -0.15 0.34 -1.16 0.00 0.00 179.01 178.46 3hb6 s ASP 415 N -6.40 6.19 -0.17 1.42 2.15 -0.85 -4.91 116.67 114.08 3hb6 s ASP 415 Ca 0.04 -1.65 0.13 0.00 0.43 0.00 0.00 52.55 51.50 3hb6 s ASP 415 Cb 0.08 -2.23 0.70 0.00 -0.30 0.00 0.00 42.92 41.17 3hb6 s ASP 415 CO 0.72 -0.90 1.58 -0.62 -0.17 0.00 0.00 175.17 175.78 3hb6 n GLU 416 N 5.50 4.11 -2.78 4.34 1.02 -1.26 -4.78 120.64 126.81 3hb6 n GLU 416 Ca -0.13 -2.70 -0.43 0.00 -0.02 0.00 0.00 57.16 53.89 3hb6 n GLU 416 Cb 0.41 -2.07 -0.01 0.00 -0.02 0.00 0.00 31.44 29.75 3hb6 n GLU 416 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hb6 s ASP 417 N -0.73 6.85 -0.01 1.62 3.68 -1.26 -4.58 116.67 122.23 3hb6 s ASP 417 Ca 0.47 -2.47 0.13 0.00 2.13 0.00 0.00 52.55 52.81 3hb6 s ASP 417 Cb 0.34 -2.48 -0.19 0.00 -1.45 0.00 0.00 42.92 39.14 3hb6 s ASP 417 CO 0.17 -1.03 0.34 -1.22 0.13 0.00 0.00 175.17 173.56 3hb6 n TYR 418 N 7.09 0.00 -0.09 -5.34 4.01 -1.26 -4.79 117.16 116.77 3hb6 n TYR 418 Ca 0.38 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 58.02 3hb6 n TYR 418 Cb 0.46 -0.24 -0.13 0.00 -0.31 0.00 0.00 39.34 39.12 3hb6 n TYR 418 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3hb6 n PHE 419 N -1.82 0.00 -0.35 -0.72 3.72 -1.26 -4.60 117.46 112.44 3hb6 n PHE 419 Ca -0.01 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.42 3hb6 n PHE 419 Cb 0.31 -0.85 0.20 0.00 -0.94 0.00 0.00 39.48 38.21 3hb6 n PHE 419 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3hb6 h SER 420 N 0.00 0.98 -0.01 4.37 4.64 -1.91 -2.62 113.55 119.01 3hb6 h SER 420 Ca -0.47 0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 60.64 3hb6 h SER 420 Cb 1.98 -0.20 0.02 0.00 -0.31 0.00 0.00 62.40 63.89 3hb6 h SER 420 CO -0.00 0.62 -0.84 1.56 -0.87 0.00 0.00 176.83 177.30 3hb6 h GLN 421 N 1.11 0.58 0.00 4.77 4.20 -1.91 -2.61 115.11 121.25 3hb6 h GLN 421 Ca 0.42 -0.62 0.00 0.00 0.06 0.00 0.00 58.65 58.51 3hb6 h GLN 421 Cb 0.21 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.16 3hb6 h GLN 421 CO -0.17 1.23 0.00 -1.00 -0.67 0.00 0.00 178.83 178.22 3hb6 h PRO 422 N 0.19 0.00 -0.15 1.46 0.13 -1.79 -2.80 132.00 129.04 3hb6 h PRO 422 Ca -0.10 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.93 3hb6 h PRO 422 Cb 1.52 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.65 3hb6 h PRO 422 CO 0.17 0.00 -0.30 -0.09 -0.23 0.00 0.00 178.00 177.55 3hb6 h ARG 423 N 0.00 0.47 -0.86 0.86 2.43 -1.44 -0.29 114.38 115.55 3hb6 h ARG 423 Ca 0.00 -0.30 0.01 0.00 -0.81 0.00 0.00 59.98 58.88 3hb6 h ARG 423 Cb 0.48 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.03 3hb6 h ARG 423 CO 0.00 0.91 0.57 0.00 -1.51 0.00 0.00 179.97 179.94 3hb6 h ALA 424 N 0.56 1.10 -0.16 2.80 0.00 -1.26 -0.18 119.26 122.12 3hb6 h ALA 424 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3hb6 h ALA 424 Cb 0.89 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3hb6 h ALA 424 CO 0.07 0.49 -0.13 1.25 0.00 0.00 0.00 179.25 180.93 3hb6 h LEU 425 N 1.16 0.38 -0.50 0.00 5.85 -1.46 -3.05 115.31 117.70 3hb6 h LEU 425 Ca 0.32 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.64 3hb6 h LEU 425 Cb -0.12 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 3hb6 h LEU 425 CO -0.07 0.76 0.21 0.22 -0.34 0.00 0.00 178.44 179.22 3hb6 h TYR 426 N 0.01 0.37 0.00 1.25 3.20 -0.64 -2.38 116.97 118.78 3hb6 h TYR 426 Ca 0.03 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 3hb6 h TYR 426 Cb 0.64 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.82 3hb6 h TYR 426 CO 0.08 0.15 -0.01 0.93 -1.64 0.00 0.00 178.16 177.67 3hb6 h GLU 427 N 0.41 0.00 0.00 1.82 5.08 -1.04 -2.57 114.58 118.28 3hb6 h GLU 427 Ca 0.23 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.53 3hb6 h GLU 427 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3hb6 h GLU 427 CO -0.21 0.01 -0.43 -0.07 -1.00 0.00 0.00 179.01 177.31 3hb6 h LEU 428 N 0.00 0.00 -9.95 1.33 3.38 -1.31 -3.46 115.31 105.30 3hb6 h LEU 428 Ca -0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 3hb6 h LEU 428 Cb 0.34 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3hb6 h LEU 428 CO 0.00 0.26 0.19 -0.76 0.09 0.00 0.00 178.44 178.22 3hb6 s LEU 429 N -6.19 4.17 0.91 1.67 1.43 -0.97 -5.07 118.68 114.63 3hb6 s LEU 429 Ca 0.04 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.52 3hb6 s LEU 429 Cb 0.07 -4.01 0.14 0.00 0.03 0.00 0.00 46.19 42.41 3hb6 s LEU 429 CO 0.73 -0.14 1.10 -0.94 0.23 0.00 0.00 176.35 177.32 3hb6 s SER 430 N -1.95 3.39 0.38 2.29 1.04 -1.26 -4.85 113.70 112.73 3hb6 s SER 430 Ca 0.52 1.35 0.08 0.00 0.48 0.00 0.00 55.95 58.38 3hb6 s SER 430 Cb -0.13 -2.02 0.75 0.00 0.10 0.00 0.00 66.02 64.71 3hb6 s SER 430 CO 0.19 -2.67 1.91 0.44 0.98 0.00 0.00 173.24 174.08 3hb6 h ASP 431 N -1.58 0.28 -0.02 7.02 3.32 -1.97 -1.33 116.42 122.14 3hb6 h ASP 431 Ca -0.51 -0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.32 3hb6 h ASP 431 Cb 1.30 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 3hb6 h ASP 431 CO 0.56 0.41 -0.60 0.44 -1.72 0.00 0.00 179.24 178.34 3hb6 h ASP 432 N 0.29 0.70 -0.51 6.45 3.32 -2.00 -2.27 116.42 122.40 3hb6 h ASP 432 Ca 0.06 -0.39 -0.10 0.00 0.02 0.00 0.00 57.03 56.61 3hb6 h ASP 432 Cb 0.35 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3hb6 h ASP 432 CO 0.02 1.14 -0.09 -0.33 -1.72 0.00 0.00 179.24 178.26 3hb6 h GLU 433 N 0.47 0.96 -0.87 3.56 5.08 -1.81 -2.59 114.58 119.39 3hb6 h GLU 433 Ca -0.00 -0.35 0.03 0.00 -1.00 0.00 0.00 59.36 58.03 3hb6 h GLU 433 Cb 1.16 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.30 3hb6 h GLU 433 CO 0.12 1.02 0.57 0.45 -1.00 0.00 0.00 179.01 180.16 3hb6 h HIS 434 N 0.83 1.06 -0.60 4.33 3.86 -1.16 -0.45 115.15 123.02 3hb6 h HIS 434 Ca 0.13 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.31 3hb6 h HIS 434 Cb 0.64 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.73 3hb6 h HIS 434 CO 0.05 0.63 0.12 1.96 0.86 0.00 0.00 177.93 181.55 3hb6 h GLN 435 N 1.12 0.96 -0.34 2.45 1.08 -1.18 -1.16 115.11 118.03 3hb6 h GLN 435 Ca 0.34 -0.23 -0.15 0.00 -1.45 0.00 0.00 58.65 57.16 3hb6 h GLN 435 Cb -0.04 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 3hb6 h GLN 435 CO -0.10 0.87 -0.38 0.00 -0.95 0.00 0.00 178.83 178.27 3hb6 h ARG 436 N 0.91 0.82 -0.45 1.46 3.08 -1.01 -2.62 114.38 116.57 3hb6 h ARG 436 Ca 0.19 -0.42 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 3hb6 h ARG 436 Cb 0.37 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 3hb6 h ARG 436 CO 0.01 1.06 0.21 0.52 -1.07 0.00 0.00 179.97 180.69 3hb6 h MET 437 N 0.67 0.66 -0.63 0.04 2.86 -0.69 -1.36 114.93 116.48 3hb6 h MET 437 Ca 0.06 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 3hb6 h MET 437 Cb 0.95 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.46 3hb6 h MET 437 CO 0.09 0.58 0.29 0.74 1.06 0.00 0.00 176.91 179.67 3hb6 h PHE 438 N 0.59 0.92 -0.33 -0.22 0.04 -1.17 -1.10 116.94 115.66 3hb6 h PHE 438 Ca 0.15 -0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.79 3hb6 h PHE 438 Cb 0.14 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 3hb6 h PHE 438 CO -0.01 0.70 -0.16 0.00 -0.60 0.00 0.00 178.31 178.24 3hb6 h ALA 439 N 1.13 1.10 -0.24 2.45 0.00 -1.20 -0.34 119.26 122.15 3hb6 h ALA 439 Ca 0.22 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 3hb6 h ALA 439 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3hb6 h ALA 439 CO -0.03 0.56 -0.52 0.00 0.00 0.00 0.00 179.25 179.26 3hb6 h ARG 440 N 0.54 0.78 -0.35 0.00 3.08 -0.84 -2.60 114.38 114.99 3hb6 h ARG 440 Ca 0.09 -0.51 -0.09 0.00 0.07 0.00 0.00 59.98 59.54 3hb6 h ARG 440 Cb 0.59 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3hb6 h ARG 440 CO 0.04 1.14 -0.12 0.82 -1.07 0.00 0.00 179.97 180.78 3hb6 h ILE 441 N 0.53 1.28 -0.94 2.04 2.04 -1.07 -3.18 117.51 118.20 3hb6 h ILE 441 Ca 0.00 -1.21 0.03 0.00 1.00 0.00 0.00 64.86 64.68 3hb6 h ILE 441 Cb 1.13 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 3hb6 h ILE 441 CO 0.11 0.40 0.62 0.00 0.00 0.00 0.00 178.15 179.28 3hb6 h ALA 442 N 0.80 1.24 0.00 1.87 0.00 -1.05 0.33 119.26 122.45 3hb6 h ALA 442 Ca 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hb6 h ALA 442 Cb 0.64 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3hb6 h ALA 442 CO 0.04 0.51 -0.01 0.78 0.00 0.00 0.00 179.25 180.58 3hb6 h GLY 443 N 1.21 0.00 0.00 0.00 0.00 -1.44 -1.23 103.07 101.61 3hb6 h GLY 443 Ca 0.37 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.34 3hb6 h GLY 443 CO -0.11 0.00 -2.03 1.18 0.00 0.00 0.00 176.54 175.58 3hb6 n GLU 444 N -4.31 0.58 0.25 4.80 1.02 -0.89 -4.55 120.64 117.55 3hb6 n GLU 444 Ca -0.03 0.37 0.11 0.00 -0.02 0.00 0.00 57.16 57.59 3hb6 n GLU 444 Cb 0.10 -1.58 0.68 0.00 -0.02 0.00 0.00 31.44 30.62 3hb6 n GLU 444 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3hb6 h LEU 445 N -1.00 0.00 -1.15 -4.62 5.85 -0.32 -2.53 115.31 111.54 3hb6 h LEU 445 Ca -0.55 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.17 3hb6 h LEU 445 Cb 1.47 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.50 3hb6 h LEU 445 CO -0.33 0.13 0.00 0.77 -0.34 0.00 0.00 178.44 178.67 3hb6 h SER 446 N 0.00 0.00 0.56 1.25 4.64 -1.44 -2.12 113.55 116.44 3hb6 h SER 446 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hb6 h SER 446 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3hb6 h SER 446 CO 0.02 0.00 -0.14 0.00 -0.87 0.00 0.00 176.83 175.84 3hb6 n GLN 447 N -2.78 0.38 -2.40 4.77 6.02 -0.95 -4.87 117.38 117.55 3hb6 n GLN 447 Ca 0.01 -0.12 -0.25 0.00 -0.01 0.00 0.00 57.00 56.63 3hb6 n GLN 447 Cb 0.29 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.09 3hb6 n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hb6 s ALA 448 N -2.70 3.36 0.87 -1.58 0.00 -0.80 -4.26 121.76 116.65 3hb6 s ALA 448 Ca 0.22 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.19 3hb6 s ALA 448 Cb 0.19 -2.50 0.11 0.00 0.00 0.00 0.00 23.12 20.93 3hb6 s ALA 448 CO 0.52 -0.95 1.09 -1.54 0.00 0.00 0.00 175.76 174.89 3hb6 s SER 449 N -4.39 3.63 0.32 0.00 1.04 -1.26 -4.79 113.70 108.25 3hb6 s SER 449 Ca 0.56 1.70 0.00 0.00 0.48 0.00 0.00 55.95 58.69 3hb6 s SER 449 Cb -0.11 -2.35 0.52 0.00 0.10 0.00 0.00 66.02 64.19 3hb6 s SER 449 CO 0.44 -2.57 1.96 0.11 0.98 0.00 0.00 173.24 174.15 3hb6 h LYS 450 N -1.50 0.91 -0.19 4.02 1.79 -1.96 -0.55 116.57 119.08 3hb6 h LYS 450 Ca -0.47 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 57.92 3hb6 h LYS 450 Cb 1.27 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.72 3hb6 h LYS 450 CO 0.52 0.65 0.12 1.49 -1.08 0.00 0.00 179.45 181.14 3hb6 h GLU 451 N 0.92 0.26 -0.36 3.15 4.81 -2.00 -1.20 114.58 120.17 3hb6 h GLU 451 Ca 0.24 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.30 3hb6 h GLU 451 Cb -0.02 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3hb6 h GLU 451 CO -0.04 0.21 -0.35 1.15 -0.73 0.00 0.00 179.01 179.25 3hb6 h THR 452 N 0.23 1.28 -0.44 0.32 2.02 -1.85 -1.99 112.91 112.48 3hb6 h THR 452 Ca 0.07 -1.52 0.02 0.00 0.77 0.00 0.00 66.41 65.75 3hb6 h THR 452 Cb 0.02 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 3hb6 h THR 452 CO -0.01 0.50 0.25 1.56 0.37 0.00 0.00 175.52 178.19 3hb6 h GLN 453 N 0.66 0.49 -0.26 6.66 4.20 -0.88 -1.03 115.11 124.96 3hb6 h GLN 453 Ca 0.06 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 3hb6 h GLN 453 Cb 0.93 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.60 3hb6 h GLN 453 CO 0.09 0.33 -0.13 0.37 -0.67 0.00 0.00 178.83 178.82 3hb6 h GLN 454 N 0.51 0.54 -0.79 1.46 5.75 -1.20 -1.38 115.11 120.01 3hb6 h GLN 454 Ca 0.17 -0.24 -0.00 0.00 -0.15 0.00 0.00 58.65 58.43 3hb6 h GLN 454 Cb 0.02 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 3hb6 h GLN 454 CO -0.09 0.80 0.48 -0.09 -2.65 0.00 0.00 178.83 177.29 3hb6 h ARG 455 N 0.27 1.07 -0.18 1.69 2.43 -1.20 -1.29 114.38 117.16 3hb6 h ARG 455 Ca 0.06 -0.09 -0.20 0.00 -0.81 0.00 0.00 59.98 58.94 3hb6 h ARG 455 Cb 0.64 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3hb6 h ARG 455 CO 0.04 0.75 -0.67 0.37 -1.51 0.00 0.00 179.97 178.95 3hb6 h GLN 456 N 1.08 0.71 -0.69 0.20 5.75 -1.14 -2.69 115.11 118.33 3hb6 h GLN 456 Ca 0.28 -0.52 -0.04 0.00 -0.15 0.00 0.00 58.65 58.22 3hb6 h GLN 456 Cb -0.05 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 3hb6 h GLN 456 CO -0.05 1.14 0.27 0.82 -2.65 0.00 0.00 178.83 178.35 3hb6 h ILE 457 N 0.52 1.24 -0.08 2.39 2.04 -0.96 -1.25 117.51 121.40 3hb6 h ILE 457 Ca -0.02 -0.76 -0.07 0.00 1.00 0.00 0.00 64.86 65.01 3hb6 h ILE 457 Cb 1.27 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3hb6 h ILE 457 CO 0.13 0.30 -0.27 0.44 0.00 0.00 0.00 178.15 178.76 3hb6 h ASP 458 N 1.00 0.14 -0.02 1.72 3.32 -1.13 -0.33 116.42 121.12 3hb6 h ASP 458 Ca 0.23 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 57.00 3hb6 h ASP 458 Cb 0.20 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.73 3hb6 h ASP 458 CO -0.02 0.41 -0.89 -0.07 -1.72 0.00 0.00 179.24 176.96 3hb6 h LEU 459 N 0.13 0.86 -1.21 1.55 3.38 -1.05 -2.36 115.31 116.62 3hb6 h LEU 459 Ca 0.02 -0.62 -0.08 0.00 0.09 0.00 0.00 57.88 57.29 3hb6 h LEU 459 Cb 0.55 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3hb6 h LEU 459 CO 0.04 1.42 -0.38 -0.26 0.09 0.00 0.00 178.44 179.35 3hb6 h PHE 460 N 0.44 0.00 -0.23 1.13 0.04 -0.86 -2.65 116.94 114.81 3hb6 h PHE 460 Ca -0.08 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.52 3hb6 h PHE 460 Cb 1.52 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.67 3hb6 h PHE 460 CO 0.09 0.38 -0.54 1.15 -0.60 0.00 0.00 178.31 178.79 3hb6 h THR 461 N 0.00 1.30 0.00 -1.55 2.02 -0.96 -2.22 112.91 111.50 3hb6 h THR 461 Ca -0.00 -1.76 -0.00 0.00 0.77 0.00 0.00 66.41 65.42 3hb6 h THR 461 Cb 0.72 1.69 -0.00 0.00 -1.74 0.00 0.00 68.15 68.82 3hb6 h THR 461 CO 0.05 0.56 -0.02 0.11 0.37 0.00 0.00 175.52 176.59 3hb6 h LYS 462 N 0.53 0.00 0.06 6.66 1.57 -1.07 -2.15 116.57 122.17 3hb6 h LYS 462 Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3hb6 h LYS 462 Cb 1.11 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.42 3hb6 h LYS 462 CO 0.11 0.02 -0.37 0.28 -0.57 0.00 0.00 179.45 178.91 3hb6 h VAL 463 N 0.00 1.65 -1.47 0.50 2.07 -1.34 -3.47 116.25 114.19 3hb6 h VAL 463 Ca -0.00 -2.42 0.12 0.00 0.82 0.00 0.00 66.70 65.23 3hb6 h VAL 463 Cb 0.40 3.28 -0.28 0.00 -1.52 0.00 0.00 31.29 33.17 3hb6 h VAL 463 CO 0.00 0.64 0.44 -2.28 0.02 0.00 0.00 177.57 176.40 3hb6 s HIS 464 N -2.31 -0.50 0.46 1.57 2.46 -0.83 -4.65 115.29 111.50 3hb6 s HIS 464 Ca -0.17 1.00 0.17 0.00 0.47 0.00 0.00 55.06 56.52 3hb6 s HIS 464 Cb -0.01 0.30 1.12 0.00 -0.13 0.00 0.00 32.58 33.86 3hb6 s HIS 464 CO 0.74 -0.25 1.98 -1.35 -2.47 0.00 0.00 174.74 173.40 3hb6 h PRO 465 N 5.85 0.30 0.00 2.88 0.11 -1.74 -1.15 132.00 138.25 3hb6 h PRO 465 Ca -0.28 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 3hb6 h PRO 465 Cb 1.19 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3hb6 h PRO 465 CO 0.20 0.20 -0.16 0.93 -0.21 0.00 0.00 178.00 178.95 3hb6 h GLU 466 N 0.30 0.00 -0.01 1.05 5.08 -1.90 -0.20 114.58 118.91 3hb6 h GLU 466 Ca 0.27 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 3hb6 h GLU 466 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3hb6 h GLU 466 CO -0.06 0.16 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.07 3hb6 h TYR 467 N 0.00 0.14 -0.31 4.33 5.03 -1.45 -1.15 116.97 123.56 3hb6 h TYR 467 Ca -0.00 -0.07 -0.05 0.00 2.58 0.00 0.00 58.73 61.19 3hb6 h TYR 467 Cb 0.77 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 39.02 3hb6 h TYR 467 CO 0.00 0.80 -0.01 0.78 -1.32 0.00 0.00 178.16 178.41 3hb6 h GLY 468 N -0.55 0.60 1.28 1.82 0.00 -1.33 -2.06 103.07 102.83 3hb6 h GLY 468 Ca -0.01 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.78 3hb6 h GLY 468 CO 0.02 0.41 -0.07 0.00 0.00 0.00 0.00 176.54 176.91 3hb6 h ALA 469 N 0.84 0.96 -0.34 3.60 0.00 -1.13 -1.53 119.26 121.66 3hb6 h ALA 469 Ca 0.09 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 3hb6 h ALA 469 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3hb6 h ALA 469 CO 0.02 0.62 -0.21 0.78 0.00 0.00 0.00 179.25 180.45 3hb6 h GLY 470 N 0.98 0.70 1.18 0.00 0.00 -1.11 -0.30 103.07 104.51 3hb6 h GLY 470 Ca 0.14 -0.57 -0.21 0.00 0.00 0.00 0.00 47.33 46.68 3hb6 h GLY 470 CO 0.03 0.52 -0.72 -2.08 0.00 0.00 0.00 176.54 174.30 3hb6 h VAL 471 N 0.57 1.28 -0.61 4.60 2.07 -1.17 -2.28 116.25 120.71 3hb6 h VAL 471 Ca 0.08 -1.91 -0.06 0.00 0.82 0.00 0.00 66.70 65.63 3hb6 h VAL 471 Cb 0.68 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 3hb6 h VAL 471 CO 0.05 0.61 0.13 -0.08 0.02 0.00 0.00 177.57 178.30 3hb6 h GLU 472 N 0.58 0.99 -0.36 1.57 4.81 -1.08 -2.49 114.58 118.60 3hb6 h GLU 472 Ca -0.03 -0.25 -0.06 0.00 -0.13 0.00 0.00 59.36 58.89 3hb6 h GLU 472 Cb 1.34 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3hb6 h GLU 472 CO 0.15 0.92 -0.01 -0.22 -0.73 0.00 0.00 179.01 179.12 3hb6 h LYS 473 N 0.91 0.64 0.00 1.92 3.64 -1.06 -2.80 116.57 119.81 3hb6 h LYS 473 Ca 0.19 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3hb6 h LYS 473 Cb 0.38 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3hb6 h LYS 473 CO 0.01 0.75 -0.12 0.00 -2.27 0.00 0.00 179.45 177.82 3hb6 h ALA 474 N 0.86 1.46 -0.05 5.00 0.00 -1.27 -1.49 119.26 123.77 3hb6 h ALA 474 Ca 0.10 -0.11 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 3hb6 h ALA 474 Cb 0.47 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hb6 h ALA 474 CO 0.02 0.15 -0.93 0.82 0.00 0.00 0.00 179.25 179.31 3hb6 h ILE 475 N 0.00 1.31 -0.54 0.00 2.04 -1.23 -2.83 117.51 116.27 3hb6 h ILE 475 Ca -0.00 -2.21 -0.12 0.00 1.00 0.00 0.00 64.86 63.53 3hb6 h ILE 475 Cb 0.27 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 3hb6 h ILE 475 CO 0.02 0.68 -0.12 0.11 0.00 0.00 0.00 178.15 178.83 3hb6 h LYS 476 N 0.38 1.03 -0.32 2.37 1.57 -1.08 -2.22 116.57 118.31 3hb6 h LYS 476 Ca -0.09 -0.39 -0.10 0.00 -1.87 0.00 0.00 60.65 58.19 3hb6 h LYS 476 Cb 1.56 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.80 3hb6 h LYS 476 CO 0.18 1.08 -0.23 0.28 -0.57 0.00 0.00 179.45 180.19 3hb6 h VAL 477 N 0.91 1.27 -0.15 0.50 2.07 -1.37 -3.11 116.25 116.37 3hb6 h VAL 477 Ca 0.14 -1.29 -0.21 0.00 0.82 0.00 0.00 66.70 66.16 3hb6 h VAL 477 Cb 0.70 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3hb6 h VAL 477 CO 0.05 0.42 -0.73 0.25 0.02 0.00 0.00 177.57 177.58 3hb6 h LEU 478 N 0.54 0.82 0.00 2.57 5.85 -1.40 -3.51 115.31 120.18 3hb6 h LEU 478 Ca 0.08 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3hb6 h LEU 478 Cb 0.69 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.48 3hb6 h LEU 478 CO 0.05 1.30 0.00 -0.62 -0.34 0.00 0.00 178.44 178.83