#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a6q n ALA 3 N 0.00 0.00 -0.67 4.61 0.00 -1.26 -5.01 120.51 118.18 1a6q n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1a6q n ALA 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1a6q n ALA 3 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1a6q n PHE 4 N 0.00 0.00 -1.94 0.00 3.72 -1.21 -4.88 117.46 113.16 1a6q n PHE 4 Ca 0.00 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.11 1a6q n PHE 4 Cb 0.00 -1.96 0.12 0.00 -0.94 0.00 0.00 39.48 36.69 1a6q n PHE 4 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1a6q s LEU 5 N 0.00 2.60 0.22 4.37 1.02 0.16 -4.79 118.68 122.25 1a6q s LEU 5 Ca 0.00 0.58 0.11 0.00 0.02 0.00 0.00 54.13 54.84 1a6q s LEU 5 Cb 0.00 -2.95 0.08 0.00 0.02 0.00 0.00 46.19 43.35 1a6q s LEU 5 CO 0.00 -2.13 1.44 0.44 0.02 0.00 0.00 176.35 176.12 1a6q h ASP 6 N -1.19 0.00 -4.65 2.29 5.19 -1.97 -3.44 116.42 112.64 1a6q h ASP 6 Ca -0.45 0.00 -0.16 0.00 -0.62 0.00 0.00 57.03 55.80 1a6q h ASP 6 Cb 1.30 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.59 1a6q h ASP 6 CO 0.57 0.74 -0.53 -0.54 -3.12 0.00 0.00 179.24 176.36 1a6q s LYS 7 N -3.08 0.38 0.41 3.56 1.02 -1.26 -5.16 119.74 115.62 1a6q s LYS 7 Ca 0.01 -0.26 -0.23 0.00 0.02 0.00 0.00 55.97 55.51 1a6q s LYS 7 Cb 0.10 0.16 -0.09 0.00 -0.52 0.00 0.00 37.83 37.48 1a6q s LYS 7 CO 0.78 -0.08 1.04 -1.25 -0.92 0.00 0.00 175.35 174.91 1a6q s PRO 8 N -1.00 4.11 -0.86 -1.68 0.04 -1.26 -4.87 135.00 129.48 1a6q s PRO 8 Ca -0.11 1.46 -0.22 0.00 0.04 0.00 0.00 61.00 62.17 1a6q s PRO 8 Cb -0.06 -2.45 0.08 0.00 0.04 0.00 0.00 34.50 32.11 1a6q s PRO 8 CO 0.01 -0.18 1.19 0.15 0.04 0.00 0.00 177.00 178.21 1a6q s LYS 9 N -2.65 3.41 0.00 4.56 1.02 0.31 -4.86 119.74 121.52 1a6q s LYS 9 Ca 0.60 -1.15 0.07 0.00 0.02 0.00 0.00 55.97 55.51 1a6q s LYS 9 Cb -0.20 -4.75 0.40 0.00 -0.52 0.00 0.00 37.83 32.76 1a6q s LYS 9 CO 0.25 -1.95 1.13 -1.33 -0.92 0.00 0.00 175.35 172.54 1a6q n MET 10 N 7.84 0.86 -1.92 1.68 2.81 -1.26 -2.27 117.12 124.86 1a6q n MET 10 Ca 0.16 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.63 1a6q n MET 10 Cb 0.49 -1.12 -0.03 0.00 -0.71 0.00 0.00 33.22 31.85 1a6q n MET 10 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1a6q s GLU 11 N -2.00 4.20 -0.11 0.03 2.12 -1.26 -4.98 118.70 116.71 1a6q s GLU 11 Ca 0.10 2.36 -0.13 0.00 0.36 0.00 0.00 54.97 57.67 1a6q s GLU 11 Cb 0.05 -3.38 -0.05 0.00 0.26 0.00 0.00 34.13 31.00 1a6q s GLU 11 CO 0.08 -0.68 0.29 0.15 -0.54 0.00 0.00 175.26 174.55 1a6q s LYS 12 N 1.93 3.99 -0.27 4.30 -0.14 -1.26 -4.31 119.74 123.98 1a6q s LYS 12 Ca 0.72 0.13 -0.03 0.00 -1.36 0.00 0.00 55.97 55.43 1a6q s LYS 12 Cb -0.42 -3.32 0.02 0.00 -1.68 0.00 0.00 37.83 32.43 1a6q s LYS 12 CO 0.32 0.48 -0.01 -1.01 -0.76 0.00 0.00 175.35 174.37 1a6q s HIS 13 N -0.28 3.12 0.37 3.18 3.76 0.25 -4.93 115.29 120.77 1a6q s HIS 13 Ca 0.18 -1.44 0.08 0.00 -0.15 0.00 0.00 55.06 53.73 1a6q s HIS 13 Cb -0.14 -2.12 -0.05 0.00 1.11 0.00 0.00 32.58 31.38 1a6q s HIS 13 CO 0.06 -0.70 0.14 -0.80 -0.85 0.00 0.00 174.74 172.59 1a6q s ASN 14 N 1.36 4.48 0.03 1.40 0.01 -1.26 -0.87 114.94 120.08 1a6q s ASN 14 Ca 0.00 -0.95 -0.27 0.00 -0.71 0.00 0.00 52.86 50.93 1a6q s ASN 14 Cb -0.17 -0.58 0.09 0.00 0.41 0.00 0.00 41.25 41.00 1a6q s ASN 14 CO -0.02 -0.40 0.77 0.00 -1.51 0.00 0.00 177.10 175.94 1a6q s ALA 15 N -2.52 -1.75 0.19 0.60 0.00 -1.09 -4.96 121.76 112.23 1a6q s ALA 15 Ca 0.39 0.95 -0.22 0.00 0.00 0.00 0.00 51.96 53.08 1a6q s ALA 15 Cb 0.01 0.38 0.05 0.00 0.00 0.00 0.00 23.12 23.56 1a6q s ALA 15 CO 0.22 -0.62 0.62 1.14 0.00 0.00 0.00 175.76 177.12 1a6q s GLN 16 N -2.80 1.42 0.06 0.00 -2.07 -1.26 -0.57 119.66 114.43 1a6q s GLN 16 Ca 0.00 -0.65 -0.27 0.00 -1.82 0.00 0.00 55.36 52.62 1a6q s GLN 16 Cb -0.01 0.58 0.10 0.00 -1.09 0.00 0.00 33.01 32.59 1a6q s GLN 16 CO -0.06 -0.63 1.18 0.20 -1.32 0.00 0.00 175.29 174.66 1a6q s GLY 17 N -2.81 -0.21 -0.03 2.60 0.00 -0.65 -4.97 107.32 101.26 1a6q s GLY 17 Ca 0.04 0.23 -0.15 0.00 0.00 0.00 0.00 44.72 44.84 1a6q s GLY 17 CO -0.07 1.86 0.33 1.20 0.00 0.00 0.00 173.10 176.42 1a6q s GLN 18 N -2.43 0.66 0.00 2.90 1.11 -1.26 -0.56 119.66 120.08 1a6q s GLN 18 Ca 0.19 -0.11 0.00 0.00 0.01 0.00 0.00 55.36 55.45 1a6q s GLN 18 Cb 0.01 0.30 0.00 0.00 -1.01 0.00 0.00 33.01 32.31 1a6q s GLN 18 CO -0.00 -0.18 0.00 0.41 0.01 0.00 0.00 175.29 175.53 1a6q n GLY 19 N 1.40 3.93 2.71 3.09 0.00 0.02 -4.97 105.19 111.37 1a6q n GLY 19 Ca -0.21 -0.76 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 1a6q n GLY 19 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a6q n ASN 20 N 0.00 -5.55 0.00 1.61 3.02 -1.26 -0.86 115.26 112.22 1a6q n ASN 20 Ca 0.00 -0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 1a6q n ASN 20 Cb 0.00 -4.57 0.00 0.00 -0.61 0.00 0.00 39.78 34.60 1a6q n ASN 20 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a6q n GLY 21 N -1.19 1.45 3.92 7.41 0.00 -1.26 -5.01 105.19 110.50 1a6q n GLY 21 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 1a6q n GLY 21 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a6q s LEU 22 N 0.00 4.11 -0.02 0.99 1.43 -0.04 -3.96 118.68 121.19 1a6q s LEU 22 Ca 0.00 -0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 52.99 1a6q s LEU 22 Cb 0.00 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1a6q s LEU 22 CO 0.00 -0.09 0.10 -0.13 0.23 0.00 0.00 176.35 176.46 1a6q s ARG 23 N -3.95 0.26 0.15 1.70 0.52 -1.06 -0.80 118.95 115.77 1a6q s ARG 23 Ca 0.35 -0.10 -0.14 0.00 -0.52 0.00 0.00 55.73 55.31 1a6q s ARG 23 Cb -0.09 0.11 0.02 0.00 0.52 0.00 0.00 34.95 35.51 1a6q s ARG 23 CO 0.28 -0.05 0.39 1.52 0.02 0.00 0.00 175.30 177.46 1a6q s TYR 24 N -0.55 -0.02 0.05 -0.53 -0.85 0.28 -0.65 117.35 115.07 1a6q s TYR 24 Ca -0.06 -0.33 -0.12 0.00 -0.52 0.00 0.00 57.07 56.05 1a6q s TYR 24 Cb -0.04 0.20 0.01 0.00 0.38 0.00 0.00 41.96 42.51 1a6q s TYR 24 CO 0.00 -0.75 0.25 0.20 -1.52 0.00 0.00 175.55 173.73 1a6q s GLY 25 N -2.86 -0.04 0.09 5.49 0.00 -0.87 -1.64 107.32 107.49 1a6q s GLY 25 Ca 0.08 -0.17 -0.13 0.00 0.00 0.00 0.00 44.72 44.49 1a6q s GLY 25 CO -0.07 -0.37 0.31 0.48 0.00 0.00 0.00 173.10 173.46 1a6q s LEU 26 N -2.15 0.83 -0.07 0.66 0.05 0.26 -1.40 118.68 116.86 1a6q s LEU 26 Ca -0.04 -0.36 -0.04 0.00 0.05 0.00 0.00 54.13 53.74 1a6q s LEU 26 Cb -0.00 1.46 0.03 0.00 -2.05 0.00 0.00 46.19 45.63 1a6q s LEU 26 CO -0.04 -0.74 0.16 -0.55 -0.55 0.00 0.00 176.35 174.63 1a6q s SER 27 N -2.57 -0.15 -0.04 1.48 0.15 -0.57 -2.68 113.70 109.33 1a6q s SER 27 Ca 0.01 0.34 0.04 0.00 0.70 0.00 0.00 55.95 57.04 1a6q s SER 27 Cb 0.02 0.26 -0.00 0.00 -1.71 0.00 0.00 66.02 64.58 1a6q s SER 27 CO -0.09 -0.13 -0.16 -0.94 1.20 0.00 0.00 173.24 173.13 1a6q s SER 28 N 0.90 2.02 -0.06 5.45 1.04 -0.05 -1.48 113.70 121.53 1a6q s SER 28 Ca -0.07 -0.33 -0.04 0.00 0.48 0.00 0.00 55.95 56.00 1a6q s SER 28 Cb -0.09 -0.56 0.03 0.00 0.10 0.00 0.00 66.02 65.51 1a6q s SER 28 CO -0.05 0.14 0.15 -0.32 0.98 0.00 0.00 173.24 174.14 1a6q s MET 29 N 0.06 0.12 0.30 4.02 1.75 0.06 -0.58 119.30 125.04 1a6q s MET 29 Ca -0.04 0.33 0.05 0.00 -1.25 0.00 0.00 55.69 54.78 1a6q s MET 29 Cb -0.11 -0.10 0.49 0.00 2.84 0.00 0.00 34.83 37.95 1a6q s MET 29 CO 0.02 -0.12 1.75 0.37 -0.65 0.00 0.00 175.02 176.38 1a6q h GLN 30 N 6.86 0.34 0.00 4.11 4.15 -1.75 -1.29 115.11 127.53 1a6q h GLN 30 Ca -0.38 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 58.91 1a6q h GLN 30 Cb 1.16 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.83 1a6q h GLN 30 CO 0.42 0.61 0.00 0.41 -1.93 0.00 0.00 178.83 178.34 1a6q n GLY 31 N -0.38 1.75 0.16 2.39 0.00 -0.96 -3.39 105.19 104.75 1a6q n GLY 31 Ca -0.01 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.55 1a6q n GLY 31 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1a6q h TRP 32 N 0.00 0.00 -4.00 1.61 4.06 -1.79 0.89 115.95 116.72 1a6q h TRP 32 Ca 0.00 0.00 -0.50 0.00 2.06 0.00 0.00 58.89 60.45 1a6q h TRP 32 Cb 0.00 0.00 0.05 0.00 -1.00 0.00 0.00 29.16 28.21 1a6q h TRP 32 CO 0.00 0.00 0.45 1.03 -3.56 0.00 0.00 178.44 176.36 1a6q s ARG 33 N -3.29 3.84 0.27 0.49 1.81 -1.22 0.37 118.95 121.22 1a6q s ARG 33 Ca 0.06 1.66 0.02 0.00 -1.72 0.00 0.00 55.73 55.76 1a6q s ARG 33 Cb 0.10 -2.39 0.37 0.00 -0.45 0.00 0.00 34.95 32.58 1a6q s ARG 33 CO 0.52 -0.46 1.68 0.28 -0.68 0.00 0.00 175.30 176.64 1a6q h VAL 34 N 1.88 1.28 -2.08 3.52 2.07 -1.89 -3.43 116.25 117.61 1a6q h VAL 34 Ca -0.49 -1.40 -0.60 0.00 0.82 0.00 0.00 66.70 65.02 1a6q h VAL 34 Cb 1.24 1.48 -0.14 0.00 -1.52 0.00 0.00 31.29 32.35 1a6q h VAL 34 CO 0.60 0.44 -0.70 -1.61 0.02 0.00 0.00 177.57 176.32 1a6q s GLU 35 N -4.35 1.75 -0.25 1.57 0.41 -1.26 -5.04 118.70 111.53 1a6q s GLU 35 Ca -0.06 -1.87 -0.04 0.00 -0.41 0.00 0.00 54.97 52.58 1a6q s GLU 35 Cb 0.13 -1.67 0.00 0.00 -1.78 0.00 0.00 34.13 30.81 1a6q s GLU 35 CO 0.80 0.19 -0.00 1.41 -0.49 0.00 0.00 175.26 177.16 1a6q s MET 36 N -3.59 3.19 0.00 1.61 -2.45 -1.26 -4.91 119.30 111.89 1a6q s MET 36 Ca 0.31 -0.76 0.03 0.00 -1.25 0.00 0.00 55.69 54.02 1a6q s MET 36 Cb 0.00 -3.14 0.07 0.00 1.25 0.00 0.00 34.83 33.01 1a6q s MET 36 CO 0.16 -0.32 0.92 0.39 1.05 0.00 0.00 175.02 177.22 1a6q n GLU 37 N 4.80 1.85 -2.84 4.11 1.02 -1.26 -4.82 120.64 123.50 1a6q n GLU 37 Ca -0.17 -1.35 -0.28 0.00 -0.02 0.00 0.00 57.16 55.35 1a6q n GLU 37 Cb 0.49 -1.07 -0.01 0.00 -0.02 0.00 0.00 31.44 30.83 1a6q n GLU 37 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1a6q s ASP 38 N -0.77 6.33 0.31 1.62 1.01 -1.26 -0.42 116.67 123.50 1a6q s ASP 38 Ca 0.06 0.89 -0.09 0.00 0.71 0.00 0.00 52.55 54.11 1a6q s ASP 38 Cb 0.03 -2.23 0.01 0.00 1.01 0.00 0.00 42.92 41.75 1a6q s ASP 38 CO 0.04 -0.47 0.54 0.00 0.21 0.00 0.00 175.17 175.49 1a6q s ALA 39 N -2.56 0.07 0.19 5.23 0.00 0.18 -4.91 121.76 119.97 1a6q s ALA 39 Ca 0.47 -1.11 -0.24 0.00 0.00 0.00 0.00 51.96 51.08 1a6q s ALA 39 Cb -0.10 1.03 0.05 0.00 0.00 0.00 0.00 23.12 24.09 1a6q s ALA 39 CO 0.40 -0.86 0.82 -3.38 0.00 0.00 0.00 175.76 172.74 1a6q s HIS 40 N -3.29 -0.22 -0.01 0.00 -3.43 -1.26 -0.71 115.29 106.38 1a6q s HIS 40 Ca 0.24 -0.13 0.02 0.00 -0.80 0.00 0.00 55.06 54.39 1a6q s HIS 40 Cb -0.01 0.65 -0.00 0.00 -1.43 0.00 0.00 32.58 31.78 1a6q s HIS 40 CO 0.14 -0.97 -0.06 0.99 -2.00 0.00 0.00 174.74 172.85 1a6q s THR 41 N -3.57 0.45 -0.21 -5.38 2.01 -0.46 -4.81 115.64 103.66 1a6q s THR 41 Ca 0.10 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1a6q s THR 41 Cb -0.03 -0.39 0.11 0.00 0.01 0.00 0.00 72.50 72.20 1a6q s THR 41 CO 0.02 0.13 0.27 0.00 -0.69 0.00 0.00 174.62 174.35 1a6q s ALA 42 N -0.11 -0.55 -0.12 7.40 0.00 -1.25 -1.51 121.76 125.61 1a6q s ALA 42 Ca 0.02 0.50 -0.06 0.00 0.00 0.00 0.00 51.96 52.41 1a6q s ALA 42 Cb -0.03 -1.43 0.05 0.00 0.00 0.00 0.00 23.12 21.72 1a6q s ALA 42 CO -0.00 -1.21 0.29 0.54 0.00 0.00 0.00 175.76 175.38 1a6q s VAL 43 N 2.40 -0.05 -0.25 0.00 0.11 0.75 -5.00 120.40 118.36 1a6q s VAL 43 Ca 0.09 0.14 -0.06 0.00 -2.93 0.00 0.00 61.98 59.22 1a6q s VAL 43 Cb -0.15 -0.44 -0.01 0.00 -1.53 0.00 0.00 36.38 34.25 1a6q s VAL 43 CO -0.13 0.06 0.02 -0.63 -3.33 0.00 0.00 175.10 171.09 1a6q s ILE 44 N 1.34 3.78 0.00 7.04 1.01 -1.26 0.51 121.20 133.63 1a6q s ILE 44 Ca -0.09 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1a6q s ILE 44 Cb -0.10 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.57 1a6q s ILE 44 CO -0.10 0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.75 1a6q n GLY 45 N 4.85 -0.30 3.87 6.18 0.00 0.19 -4.97 105.19 115.02 1a6q n GLY 45 Ca -0.17 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 1a6q n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a6q s LEU 46 N 0.00 4.34 1.04 0.99 1.43 0.78 -4.83 118.68 122.43 1a6q s LEU 46 Ca 0.00 0.72 -0.15 0.00 -1.03 0.00 0.00 54.13 53.67 1a6q s LEU 46 Cb 0.00 -2.99 0.21 0.00 0.03 0.00 0.00 46.19 43.44 1a6q s LEU 46 CO 0.00 0.16 1.12 -2.16 0.23 0.00 0.00 176.35 175.70 1a6q s PRO 47 N -2.01 0.05 -1.09 1.29 0.04 -1.26 -1.41 135.00 130.61 1a6q s PRO 47 Ca 0.33 0.25 -0.02 0.00 0.04 0.00 0.00 61.00 61.61 1a6q s PRO 47 Cb -0.13 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1a6q s PRO 47 CO 0.19 -2.93 0.20 0.43 0.04 0.00 0.00 177.00 174.93 1a6q n SER 48 N -4.26 -4.39 0.00 6.66 7.64 -1.26 -3.52 113.62 114.49 1a6q n SER 48 Ca 0.08 -0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1a6q n SER 48 Cb 0.58 -3.41 0.00 0.00 -1.01 0.00 0.00 64.21 60.38 1a6q n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a6q n GLY 49 N -1.14 0.98 1.73 0.23 0.00 -1.26 -4.99 105.19 100.74 1a6q n GLY 49 Ca -0.12 -0.45 -0.06 0.00 0.00 0.00 0.00 46.02 45.40 1a6q n GLY 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1a6q n LEU 50 N 0.00 2.88 0.32 0.99 4.77 -1.02 -4.81 117.00 120.13 1a6q n LEU 50 Ca 0.00 -3.65 0.20 0.00 -0.03 0.00 0.00 56.01 52.53 1a6q n LEU 50 Cb 0.10 -0.15 1.09 0.00 -2.33 0.00 0.00 43.42 42.14 1a6q n LEU 50 CO 0.00 1.39 1.15 -0.08 -1.33 0.00 0.00 177.39 178.53 1a6q h GLU 51 N 1.75 0.00 -0.00 3.23 4.57 -1.53 0.31 114.58 122.91 1a6q h GLU 51 Ca 0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1a6q h GLU 51 Cb 1.40 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.99 1a6q h GLU 51 CO 0.31 0.01 -0.19 0.43 -1.18 0.00 0.00 179.01 178.39 1a6q n SER 52 N -3.34 0.40 -4.93 1.04 7.64 -1.26 -3.81 113.62 109.36 1a6q n SER 52 Ca -0.03 -0.26 -0.26 0.00 1.01 0.00 0.00 58.87 59.33 1a6q n SER 52 Cb 0.09 -0.08 -0.02 0.00 -1.01 0.00 0.00 64.21 63.19 1a6q n SER 52 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1a6q s TRP 53 N -2.73 3.49 0.11 1.43 0.51 0.61 -4.23 118.94 118.13 1a6q s TRP 53 Ca 0.21 0.38 0.01 0.00 -2.12 0.00 0.00 56.10 54.58 1a6q s TRP 53 Cb 0.19 -1.91 -0.04 0.00 -0.81 0.00 0.00 33.47 30.90 1a6q s TRP 53 CO 0.55 0.22 -0.03 -1.12 -0.51 0.00 0.00 176.95 176.06 1a6q s SER 54 N -3.61 0.94 -0.12 2.95 0.01 -0.67 0.56 113.70 113.76 1a6q s SER 54 Ca 0.40 -1.06 -0.07 0.00 1.31 0.00 0.00 55.95 56.53 1a6q s SER 54 Cb -0.10 0.14 0.05 0.00 0.21 0.00 0.00 66.02 66.32 1a6q s SER 54 CO 0.32 -0.54 0.29 0.12 0.41 0.00 0.00 173.24 173.84 1a6q s PHE 55 N -3.74 -0.39 0.00 2.43 5.36 0.18 -1.69 117.98 120.13 1a6q s PHE 55 Ca 0.15 0.91 0.02 0.00 -0.96 0.00 0.00 56.93 57.04 1a6q s PHE 55 Cb 0.06 0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.84 1a6q s PHE 55 CO -0.03 -0.25 -0.05 -0.06 -1.46 0.00 0.00 175.22 173.36 1a6q s PHE 56 N 1.17 0.46 -0.04 10.12 0.40 -0.93 -0.17 117.98 128.98 1a6q s PHE 56 Ca -0.08 -0.12 -0.28 0.00 -0.60 0.00 0.00 56.93 55.84 1a6q s PHE 56 Cb -0.09 -0.29 0.06 0.00 0.51 0.00 0.00 43.02 43.21 1a6q s PHE 56 CO -0.09 -0.02 0.61 0.00 0.70 0.00 0.00 175.22 176.43 1a6q s ALA 57 N -0.24 -1.59 -0.05 5.36 0.00 -0.57 -0.70 121.76 123.97 1a6q s ALA 57 Ca 0.01 1.11 0.06 0.00 0.00 0.00 0.00 51.96 53.14 1a6q s ALA 57 Cb -0.03 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1a6q s ALA 57 CO -0.00 -0.37 -0.22 0.08 0.00 0.00 0.00 175.76 175.25 1a6q s VAL 58 N -1.31 1.84 -0.14 0.00 1.01 0.94 -1.36 120.40 121.39 1a6q s VAL 58 Ca -0.11 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 60.94 1a6q s VAL 58 Cb -0.01 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.83 1a6q s VAL 58 CO 0.08 0.52 -0.21 -0.31 0.00 0.00 0.00 175.10 175.18 1a6q s TYR 59 N -0.17 2.57 -0.54 5.22 2.02 0.11 -1.81 117.35 124.75 1a6q s TYR 59 Ca -0.02 -1.30 -0.08 0.00 -0.37 0.00 0.00 57.07 55.30 1a6q s TYR 59 Cb -0.12 -1.76 0.14 0.00 -0.40 0.00 0.00 41.96 39.82 1a6q s TYR 59 CO 0.03 -0.60 0.41 0.34 -1.57 0.00 0.00 175.55 174.16 1a6q s ASP 60 N 0.86 5.75 0.56 2.29 -1.08 -1.23 -0.64 116.67 123.18 1a6q s ASP 60 Ca -0.06 -2.19 -0.17 0.00 -0.52 0.00 0.00 52.55 49.61 1a6q s ASP 60 Cb -0.15 -2.00 -0.05 0.00 -1.46 0.00 0.00 42.92 39.25 1a6q s ASP 60 CO -0.02 -0.62 1.04 -0.83 0.52 0.00 0.00 175.17 175.26 1a6q s GLY 61 N 2.23 2.17 0.03 2.66 0.00 0.44 -2.30 107.32 112.55 1a6q s GLY 61 Ca 0.09 0.38 -0.00 0.00 0.00 0.00 0.00 44.72 45.19 1a6q s GLY 61 CO -0.02 0.69 -0.03 -2.38 0.00 0.00 0.00 173.10 171.36 1a6q s HIS 62 N -2.42 0.30 -1.39 1.90 -3.43 0.12 -4.72 115.29 105.65 1a6q s HIS 62 Ca 0.63 -0.62 -0.09 0.00 -0.80 0.00 0.00 55.06 54.18 1a6q s HIS 62 Cb -0.15 -0.22 0.06 0.00 -1.43 0.00 0.00 32.58 30.84 1a6q s HIS 62 CO 0.33 -0.23 0.61 0.00 -2.00 0.00 0.00 174.74 173.45 1a6q n ALA 63 N 1.32 -1.08 0.00 -1.38 0.00 -1.26 -1.12 120.51 116.98 1a6q n ALA 63 Ca -0.22 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1a6q n ALA 63 Cb 0.56 -3.33 0.00 0.00 0.00 0.00 0.00 19.45 16.68 1a6q n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a6q n GLY 64 N -1.34 3.06 0.13 0.00 0.00 -1.26 -3.06 105.19 102.71 1a6q n GLY 64 Ca -0.02 -1.91 0.05 0.00 0.00 0.00 0.00 46.02 44.13 1a6q n GLY 64 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a6q n SER 65 N 0.00 0.88 -0.25 1.61 3.41 -1.26 -4.61 113.62 113.40 1a6q n SER 65 Ca 0.00 -0.94 0.03 0.00 -0.26 0.00 0.00 58.87 57.70 1a6q n SER 65 Cb 0.00 0.68 0.16 0.00 -0.26 0.00 0.00 64.21 64.79 1a6q n SER 65 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1a6q h GLN 66 N 0.64 0.53 -0.09 4.33 7.50 -1.94 0.25 115.11 126.33 1a6q h GLN 66 Ca 0.00 -0.03 -0.10 0.00 0.50 0.00 0.00 58.65 59.02 1a6q h GLN 66 Cb 0.28 -0.12 0.00 0.00 0.05 0.00 0.00 27.48 27.70 1a6q h GLN 66 CO 0.00 0.35 -0.33 0.28 -1.50 0.00 0.00 178.83 177.63 1a6q h VAL 67 N 0.54 1.41 0.07 -0.54 2.07 -1.87 -1.45 116.25 116.47 1a6q h VAL 67 Ca 0.37 -1.69 0.02 0.00 0.82 0.00 0.00 66.70 66.22 1a6q h VAL 67 Cb 0.47 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 1a6q h VAL 67 CO -0.32 0.49 -0.20 0.00 0.02 0.00 0.00 177.57 177.57 1a6q h ALA 68 N 0.46 -0.30 -0.85 1.67 0.00 -1.71 -0.12 119.26 118.41 1a6q h ALA 68 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1a6q h ALA 68 Cb 0.96 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 1a6q h ALA 68 CO 0.07 -0.71 0.54 0.87 0.00 0.00 0.00 179.25 180.02 1a6q h LYS 69 N -0.35 1.12 -0.46 0.00 1.57 -0.56 -0.28 116.57 117.61 1a6q h LYS 69 Ca 0.04 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1a6q h LYS 69 Cb 0.39 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1a6q h LYS 69 CO -0.14 0.76 -0.12 -0.92 -0.57 0.00 0.00 179.45 178.46 1a6q h TYR 70 N 1.15 1.02 -0.55 -1.35 3.20 -0.85 -3.06 116.97 116.52 1a6q h TYR 70 Ca 0.31 -0.22 0.03 0.00 3.14 0.00 0.00 58.73 61.99 1a6q h TYR 70 Cb -0.11 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 37.88 1a6q h TYR 70 CO 0.00 1.00 0.32 0.00 -1.64 0.00 0.00 178.16 177.84 1a6q n GLU 73 N -1.89 3.98 0.00 0.00 1.02 -0.86 -4.61 120.64 118.28 1a6q n GLU 73 Ca 0.01 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1a6q n GLU 73 Cb 0.13 -0.91 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1a6q n GLU 73 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1a6q n HIS 74 N -1.24 0.00 -0.24 -0.32 8.25 -0.77 -4.82 115.22 116.08 1a6q n HIS 74 Ca 0.01 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1a6q n HIS 74 Cb 0.13 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.45 1a6q n HIS 74 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1a6q h LEU 75 N 0.00 0.92 -0.01 2.41 5.85 -0.80 -2.28 115.31 121.40 1a6q h LEU 75 Ca 0.00 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1a6q h LEU 75 Cb 0.35 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1a6q h LEU 75 CO 0.00 0.70 0.01 0.25 -0.34 0.00 0.00 178.44 179.06 1a6q h LEU 76 N 1.07 0.02 -1.08 2.25 6.46 -1.88 -1.39 115.31 120.76 1a6q h LEU 76 Ca 0.28 -0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.85 1a6q h LEU 76 Cb -0.06 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 1a6q h LEU 76 CO -0.05 0.13 -0.19 -2.24 -0.62 0.00 0.00 178.44 175.46 1a6q h ASP 77 N -0.09 0.42 0.01 1.25 3.04 -1.86 -0.10 116.42 119.09 1a6q h ASP 77 Ca 0.01 -0.12 -0.05 0.00 -3.24 0.00 0.00 57.03 53.63 1a6q h ASP 77 Cb 0.11 -0.11 -0.01 0.00 -1.04 0.00 0.00 39.33 38.28 1a6q h ASP 77 CO -0.00 0.63 -0.12 0.45 -2.04 0.00 0.00 179.24 178.16 1a6q h HIS 78 N 0.39 0.25 0.20 4.15 3.86 -1.10 0.21 115.15 123.12 1a6q h HIS 78 Ca 0.07 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 1a6q h HIS 78 Cb 0.56 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1a6q h HIS 78 CO 0.02 0.36 -0.10 0.82 0.86 0.00 0.00 177.93 179.89 1a6q h ILE 79 N 0.23 0.69 0.00 2.45 2.04 -0.11 -3.35 117.51 119.46 1a6q h ILE 79 Ca 0.05 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 1a6q h ILE 79 Cb 0.36 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1a6q h ILE 79 CO 0.02 0.18 -0.24 0.71 0.00 0.00 0.00 178.15 178.82 1a6q h THR 80 N -0.91 0.53 -1.28 -0.27 1.35 -0.96 -3.35 112.91 108.03 1a6q h THR 80 Ca -0.03 -1.25 -0.64 0.00 -0.55 0.00 0.00 66.41 63.93 1a6q h THR 80 Cb 0.50 1.88 -0.25 0.00 -1.73 0.00 0.00 68.15 68.54 1a6q h THR 80 CO 0.05 0.23 0.83 0.59 -0.25 0.00 0.00 175.52 176.97 1a6q n ASN 81 N -3.32 7.36 -4.22 5.36 3.02 0.74 -4.47 115.26 119.72 1a6q n ASN 81 Ca 0.01 -3.65 -0.14 0.00 -0.03 0.00 0.00 54.58 50.77 1a6q n ASN 81 Cb 0.48 -1.05 -0.10 0.00 -0.61 0.00 0.00 39.78 38.50 1a6q n ASN 81 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1a6q s ASN 82 N -1.07 1.63 0.58 6.41 2.20 -1.26 -4.92 114.94 118.51 1a6q s ASN 82 Ca 0.56 -0.96 0.29 0.00 -0.94 0.00 0.00 52.86 51.80 1a6q s ASN 82 Cb 0.44 0.01 1.74 0.00 -2.00 0.00 0.00 41.25 41.44 1a6q s ASN 82 CO -0.17 -0.33 2.22 0.06 -2.94 0.00 0.00 177.10 175.93 1a6q h GLN 83 N 2.99 0.00 -0.03 3.55 3.07 -1.94 -1.78 115.11 120.98 1a6q h GLN 83 Ca -0.37 0.00 -0.21 0.00 0.09 0.00 0.00 58.65 58.16 1a6q h GLN 83 Cb 1.19 0.00 0.02 0.00 0.08 0.00 0.00 27.48 28.76 1a6q h GLN 83 CO 0.61 0.02 -0.81 -0.44 0.09 0.00 0.00 178.83 178.31 1a6q h ASP 84 N 0.00 0.76 -0.23 0.06 3.32 -1.91 0.58 116.42 119.00 1a6q h ASP 84 Ca -0.00 -0.72 -0.06 0.00 0.02 0.00 0.00 57.03 56.27 1a6q h ASP 84 Cb 0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1a6q h ASP 84 CO 0.00 1.38 -0.08 0.15 -1.72 0.00 0.00 179.24 178.98 1a6q h PHE 85 N 0.21 0.52 0.69 4.55 3.04 -1.52 -3.29 116.94 121.14 1a6q h PHE 85 Ca -0.09 -0.12 -0.03 0.00 3.98 0.00 0.00 57.97 61.71 1a6q h PHE 85 Cb 1.48 -0.12 0.01 0.00 2.56 0.00 0.00 35.95 39.87 1a6q h PHE 85 CO 0.12 0.71 -0.33 0.87 -2.02 0.00 0.00 178.31 177.65 1a6q h LYS 86 N 0.18 -0.89 -6.83 1.11 1.57 -1.36 -3.42 116.57 106.93 1a6q h LYS 86 Ca 0.06 0.06 -0.56 0.00 -1.87 0.00 0.00 60.65 58.33 1a6q h LYS 86 Cb 0.55 0.20 -0.25 0.00 0.08 0.00 0.00 32.23 32.82 1a6q h LYS 86 CO 0.03 -0.57 -0.84 0.41 -0.57 0.00 0.00 179.45 177.90 1a6q n GLY 87 N -0.71 -0.44 0.00 3.86 0.00 0.20 -4.28 105.19 103.82 1a6q n GLY 87 Ca -0.12 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1a6q n GLY 87 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1a6q n SER 88 N -2.60 0.00 0.00 1.61 7.64 -1.26 -4.84 113.62 114.16 1a6q n SER 88 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1a6q n SER 88 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1a6q n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a6q n ALA 89 N 0.00 0.00 -1.15 -0.43 0.00 -1.26 -5.14 120.51 112.53 1a6q n ALA 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1a6q n ALA 89 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1a6q n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a6q n GLY 90 N 0.00 1.12 3.87 0.00 0.00 -1.26 -4.99 105.19 103.92 1a6q n GLY 90 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1a6q n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6q s ALA 91 N -3.91 3.34 0.22 4.61 0.00 -1.26 -5.01 121.76 119.76 1a6q s ALA 91 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 1a6q s ALA 91 Cb 0.00 -2.73 -0.11 0.00 0.00 0.00 0.00 23.12 20.28 1a6q s ALA 91 CO 0.00 0.11 1.62 -2.14 0.00 0.00 0.00 175.76 175.35 1a6q s PRO 92 N -3.54 4.16 0.84 0.00 0.02 -1.26 -5.00 135.00 130.22 1a6q s PRO 92 Ca 0.52 2.51 -0.12 0.00 0.02 0.00 0.00 61.00 63.93 1a6q s PRO 92 Cb -0.10 -3.08 0.10 0.00 0.02 0.00 0.00 34.50 31.43 1a6q s PRO 92 CO 0.26 -0.65 1.12 -1.54 -0.33 0.00 0.00 177.00 175.86 1a6q s SER 93 N 0.90 4.13 0.23 2.53 1.04 -1.26 -4.79 113.70 116.47 1a6q s SER 93 Ca 0.69 1.12 -0.07 0.00 0.48 0.00 0.00 55.95 58.17 1a6q s SER 93 Cb -0.47 -1.78 0.35 0.00 0.10 0.00 0.00 66.02 64.23 1a6q s SER 93 CO 0.37 -2.18 1.75 0.58 0.98 0.00 0.00 173.24 174.75 1a6q h VAL 94 N -1.24 0.76 -0.72 5.02 2.07 -1.99 -0.04 116.25 120.11 1a6q h VAL 94 Ca -0.48 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 1a6q h VAL 94 Cb 1.30 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1a6q h VAL 94 CO 0.61 0.09 0.28 -0.33 0.02 0.00 0.00 177.57 178.24 1a6q h GLU 95 N 0.49 1.08 -0.53 1.57 3.07 -1.98 0.82 114.58 119.09 1a6q h GLU 95 Ca 0.36 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.36 59.02 1a6q h GLU 95 Cb 0.45 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 28.16 1a6q h GLU 95 CO -0.32 0.88 0.31 -0.91 -1.40 0.00 0.00 179.01 177.57 1a6q h ASN 96 N 1.05 0.65 -0.39 1.42 -0.26 -1.30 0.26 115.58 117.02 1a6q h ASN 96 Ca 0.24 -0.07 -0.05 0.00 -0.56 0.00 0.00 56.30 55.86 1a6q h ASN 96 Cb 0.21 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1a6q h ASN 96 CO -0.02 0.53 0.05 0.58 -1.06 0.00 0.00 177.43 177.51 1a6q h VAL 97 N 0.72 1.25 -0.21 2.81 2.07 -0.63 0.38 116.25 122.63 1a6q h VAL 97 Ca 0.19 -0.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 1a6q h VAL 97 Cb 0.01 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1a6q h VAL 97 CO -0.03 0.31 -0.06 0.11 0.02 0.00 0.00 177.57 177.92 1a6q h LYS 98 N 0.50 0.40 -0.63 1.57 1.57 -0.48 -1.57 116.57 117.93 1a6q h LYS 98 Ca 0.12 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1a6q h LYS 98 Cb 0.40 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1a6q h LYS 98 CO 0.01 0.66 0.08 -0.91 -0.57 0.00 0.00 179.45 178.71 1a6q h ASN 99 N 0.12 1.02 -0.99 0.86 -0.26 -0.50 -1.78 115.58 114.06 1a6q h ASN 99 Ca 0.05 -0.27 0.04 0.00 -0.56 0.00 0.00 56.30 55.56 1a6q h ASN 99 Cb 0.51 -0.27 -0.06 0.00 -1.06 0.00 0.00 38.32 37.44 1a6q h ASN 99 CO 0.02 1.04 0.65 1.23 -1.06 0.00 0.00 177.43 179.31 1a6q h GLY 100 N 0.97 1.46 0.94 2.83 0.00 -0.13 -0.51 103.07 108.64 1a6q h GLY 100 Ca 0.19 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 1a6q h GLY 100 CO 0.02 0.41 -0.41 -2.22 0.00 0.00 0.00 176.54 174.34 1a6q h ILE 101 N 1.24 1.33 -0.04 2.60 2.04 -1.08 -0.43 117.51 123.17 1a6q h ILE 101 Ca 0.40 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.63 1a6q h ILE 101 Cb 0.04 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1a6q h ILE 101 CO -0.13 0.51 0.03 -0.09 0.00 0.00 0.00 178.15 178.46 1a6q h ARG 102 N 0.31 0.06 -0.69 2.37 2.43 -0.98 -1.22 114.38 116.66 1a6q h ARG 102 Ca 0.01 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1a6q h ARG 102 Cb 1.01 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.51 1a6q h ARG 102 CO 0.09 0.04 0.27 1.15 -1.51 0.00 0.00 179.97 180.01 1a6q h THR 103 N 0.05 1.24 -0.70 0.20 2.02 -1.13 -1.49 112.91 113.10 1a6q h THR 103 Ca 0.02 -0.75 0.02 0.00 0.77 0.00 0.00 66.41 66.47 1a6q h THR 103 Cb -0.00 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.79 1a6q h THR 103 CO -0.00 0.30 0.45 1.23 0.37 0.00 0.00 175.52 177.87 1a6q h GLY 104 N 1.07 1.01 0.71 2.16 0.00 -0.69 0.32 103.07 107.65 1a6q h GLY 104 Ca 0.23 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 1a6q h GLY 104 CO -0.02 0.31 -0.01 0.74 0.00 0.00 0.00 176.54 177.56 1a6q h PHE 105 N 0.90 -0.02 -0.82 5.60 -1.00 -0.76 -1.42 116.94 119.41 1a6q h PHE 105 Ca 0.27 -0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.01 1a6q h PHE 105 Cb -0.03 0.01 -0.04 0.00 3.61 0.00 0.00 35.95 39.50 1a6q h PHE 105 CO -0.03 0.27 0.36 -0.07 -1.61 0.00 0.00 178.31 177.22 1a6q h LEU 106 N -0.31 1.11 -0.30 1.54 3.38 -1.08 -1.89 115.31 117.75 1a6q h LEU 106 Ca -0.00 -0.16 -0.19 0.00 0.09 0.00 0.00 57.88 57.62 1a6q h LEU 106 Cb 0.30 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1a6q h LEU 106 CO 0.00 0.96 -0.56 -0.33 0.09 0.00 0.00 178.44 178.60 1a6q h GLU 107 N 1.19 0.85 -0.05 1.13 5.08 -0.32 -2.02 114.58 120.44 1a6q h GLU 107 Ca 0.28 -0.55 -0.11 0.00 -1.00 0.00 0.00 59.36 57.98 1a6q h GLU 107 Cb 0.17 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1a6q h GLU 107 CO -0.03 1.18 -0.47 0.97 -1.00 0.00 0.00 179.01 179.67 1a6q h ILE 108 N 0.65 1.34 0.39 3.13 2.10 -1.20 -0.39 117.51 123.52 1a6q h ILE 108 Ca 0.01 -1.64 -0.02 0.00 1.08 0.00 0.00 64.86 64.29 1a6q h ILE 108 Cb 1.17 1.83 0.00 0.00 -1.09 0.00 0.00 36.82 38.73 1a6q h ILE 108 CO 0.12 0.48 -0.19 -0.78 -1.08 0.00 0.00 178.15 176.71 1a6q h ASP 109 N 0.10 -0.44 -0.89 2.19 3.58 -1.20 0.10 116.42 119.86 1a6q h ASP 109 Ca 0.00 -0.10 0.03 0.00 0.42 0.00 0.00 57.03 57.38 1a6q h ASP 109 Cb 0.87 0.11 -0.05 0.00 1.72 0.00 0.00 39.33 41.98 1a6q h ASP 109 CO 0.07 -0.13 0.58 -0.08 -2.88 0.00 0.00 179.24 176.79 1a6q h GLU 110 N -0.76 1.10 -0.53 0.28 4.57 -1.36 -0.61 114.58 117.27 1a6q h GLU 110 Ca -0.05 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1a6q h GLU 110 Cb 0.52 -0.25 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 1a6q h GLU 110 CO 0.09 0.73 0.30 1.25 -1.18 0.00 0.00 179.01 180.19 1a6q h HIS 111 N 1.13 0.55 -0.38 0.92 2.76 -0.89 0.44 115.15 119.68 1a6q h HIS 111 Ca 0.35 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.44 1a6q h HIS 111 Cb -0.01 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.77 1a6q h HIS 111 CO -0.02 0.30 -0.20 0.52 -1.30 0.00 0.00 177.93 177.23 1a6q h MET 112 N 0.58 0.75 -0.67 5.26 2.86 -0.11 -2.38 114.93 121.23 1a6q h MET 112 Ca 0.22 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1a6q h MET 112 Cb 0.07 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 1a6q h MET 112 CO -0.12 0.89 0.42 -0.09 1.06 0.00 0.00 176.91 179.07 1a6q h ARG 113 N 0.66 0.89 -0.23 1.72 2.43 -0.16 -0.11 114.38 119.58 1a6q h ARG 113 Ca 0.10 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.07 1a6q h ARG 113 Cb 0.70 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1a6q h ARG 113 CO 0.05 0.61 -0.40 -0.39 -1.51 0.00 0.00 179.97 178.34 1a6q h VAL 114 N 0.91 1.30 -0.52 0.20 -1.51 -0.81 -1.22 116.25 114.60 1a6q h VAL 114 Ca 0.24 -1.56 -0.04 0.00 -1.23 0.00 0.00 66.70 64.11 1a6q h VAL 114 Cb -0.07 1.55 -0.02 0.00 -2.13 0.00 0.00 31.29 30.62 1a6q h VAL 114 CO -0.05 0.49 0.17 0.24 -1.23 0.00 0.00 177.57 177.19 1a6q h MET 115 N 0.45 0.80 -0.35 5.19 2.86 -0.98 0.30 114.93 123.20 1a6q h MET 115 Ca 0.04 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 1a6q h MET 115 Cb 0.89 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 1a6q h MET 115 CO 0.08 0.73 0.10 1.03 1.06 0.00 0.00 176.91 179.91 1a6q h SER 116 N 0.71 0.52 -0.47 1.22 0.87 -0.83 -0.05 113.55 115.52 1a6q h SER 116 Ca 0.17 -0.21 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 1a6q h SER 116 Cb 0.26 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 1a6q h SER 116 CO -0.01 0.60 0.22 -0.08 -0.53 0.00 0.00 176.83 177.03 1a6q h GLU 117 N 0.42 0.68 0.29 2.24 4.22 -1.07 0.52 114.58 121.89 1a6q h GLU 117 Ca 0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 59.36 59.44 1a6q h GLU 117 Cb 0.27 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1a6q h GLU 117 CO -0.00 0.58 -0.14 -0.22 -2.18 0.00 0.00 179.01 177.05 1a6q h LYS 118 N 0.62 -0.38 -0.40 1.92 3.64 -0.73 -2.94 116.57 118.30 1a6q h LYS 118 Ca 0.16 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1a6q h LYS 118 Cb 0.13 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1a6q h LYS 118 CO -0.02 -0.25 0.00 1.63 -2.27 0.00 0.00 179.45 178.54 1a6q n LYS 119 N -5.26 1.92 -3.69 1.90 5.02 -0.05 -4.93 118.16 113.07 1a6q n LYS 119 Ca -0.10 -1.41 -0.22 0.00 -2.02 0.00 0.00 58.31 54.56 1a6q n LYS 119 Cb 0.18 -1.31 0.04 0.00 -0.02 0.00 0.00 35.03 33.92 1a6q n LYS 119 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1a6q n HIS 120 N 0.65 -2.09 -1.67 2.13 8.25 -0.10 -4.86 115.22 117.53 1a6q n HIS 120 Ca 0.13 0.88 -0.45 0.00 -0.26 0.00 0.00 57.72 58.02 1a6q n HIS 120 Cb 0.33 -4.49 -0.03 0.00 1.12 0.00 0.00 29.99 26.93 1a6q n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a6q n GLY 121 N -1.55 0.76 0.02 -1.41 0.00 0.16 -4.89 105.19 98.27 1a6q n GLY 121 Ca -0.22 0.49 0.11 0.00 0.00 0.00 0.00 46.02 46.40 1a6q n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6q n ALA 122 N 1.86 3.70 -1.82 4.61 0.00 -1.26 -4.93 120.51 122.66 1a6q n ALA 122 Ca 0.11 -0.48 -0.32 0.00 0.00 0.00 0.00 53.44 52.75 1a6q n ALA 122 Cb 0.31 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 1a6q n ALA 122 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1a6q s ASP 123 N -3.74 6.41 -0.31 0.00 -4.77 -1.26 -4.96 116.67 108.04 1a6q s ASP 123 Ca 0.03 1.56 0.14 0.00 -3.30 0.00 0.00 52.55 50.98 1a6q s ASP 123 Cb 0.15 -2.50 0.47 0.00 -1.09 0.00 0.00 42.92 39.95 1a6q s ASP 123 CO 0.84 -0.74 1.11 0.54 0.70 0.00 0.00 175.17 177.62 1a6q n ARG 124 N -1.97 2.52 -2.03 2.11 3.00 -1.26 -5.06 116.66 113.98 1a6q n ARG 124 Ca 0.07 -3.84 -0.28 0.00 -0.01 0.00 0.00 57.85 53.79 1a6q n ARG 124 Cb 0.54 -1.87 0.12 0.00 0.00 0.00 0.00 32.46 31.25 1a6q n ARG 124 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1a6q s SER 125 N -3.59 4.03 0.27 0.55 1.04 -1.17 -4.66 113.70 110.16 1a6q s SER 125 Ca 0.38 0.43 -0.17 0.00 0.48 0.00 0.00 55.95 57.07 1a6q s SER 125 Cb 0.38 -0.78 0.01 0.00 0.10 0.00 0.00 66.02 65.74 1a6q s SER 125 CO -0.02 -2.15 0.61 -0.83 0.98 0.00 0.00 173.24 171.83 1a6q s GLY 126 N -4.70 0.21 -0.02 7.32 0.00 -0.27 -1.27 107.32 108.59 1a6q s GLY 126 Ca 0.66 -0.58 -0.26 0.00 0.00 0.00 0.00 44.72 44.54 1a6q s GLY 126 CO 0.49 -0.34 0.58 -0.45 0.00 0.00 0.00 173.10 173.38 1a6q s SER 127 N -2.97 -0.53 0.67 1.64 0.15 0.11 0.14 113.70 112.91 1a6q s SER 127 Ca 0.16 0.47 -0.01 0.00 0.70 0.00 0.00 55.95 57.27 1a6q s SER 127 Cb -0.04 0.49 0.09 0.00 -1.71 0.00 0.00 66.02 64.86 1a6q s SER 127 CO 0.08 -0.62 0.94 0.42 1.20 0.00 0.00 173.24 175.26 1a6q s THR 128 N -1.56 2.32 -0.24 6.45 -4.23 -0.97 -0.22 115.64 117.18 1a6q s THR 128 Ca -0.10 -0.56 -0.14 0.00 -1.18 0.00 0.00 61.69 59.71 1a6q s THR 128 Cb -0.01 -2.76 0.07 0.00 1.34 0.00 0.00 72.50 71.14 1a6q s THR 128 CO 0.06 0.00 0.60 0.00 -0.54 0.00 0.00 174.62 174.74 1a6q s ALA 129 N -3.06 -1.60 -0.00 3.99 0.00 -0.65 -3.49 121.76 116.95 1a6q s ALA 129 Ca 0.63 2.11 -0.00 0.00 0.00 0.00 0.00 51.96 54.69 1a6q s ALA 129 Cb -0.08 -1.25 -0.00 0.00 0.00 0.00 0.00 23.12 21.80 1a6q s ALA 129 CO 0.43 -0.34 0.01 0.54 0.00 0.00 0.00 175.76 176.40 1a6q s VAL 130 N 1.48 0.01 0.07 0.00 0.11 -0.75 -1.01 120.40 120.31 1a6q s VAL 130 Ca -0.09 -0.06 -0.12 0.00 -2.93 0.00 0.00 61.98 58.77 1a6q s VAL 130 Cb -0.06 -0.04 0.04 0.00 -1.53 0.00 0.00 36.38 34.79 1a6q s VAL 130 CO -0.16 -0.04 0.57 0.61 -3.33 0.00 0.00 175.10 172.75 1a6q n GLY 131 N 2.97 0.81 2.95 6.54 0.00 -0.03 -0.04 105.19 118.39 1a6q n GLY 131 Ca -0.13 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.70 1a6q n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a6q s VAL 132 N -2.25 0.47 -0.29 1.61 -7.23 0.12 -0.18 120.40 112.65 1a6q s VAL 132 Ca 0.13 -0.22 -0.05 0.00 -1.81 0.00 0.00 61.98 60.02 1a6q s VAL 132 Cb -0.01 -0.42 0.02 0.00 0.56 0.00 0.00 36.38 36.53 1a6q s VAL 132 CO 0.02 0.15 0.05 -0.22 -0.31 0.00 0.00 175.10 174.79 1a6q s LEU 133 N 0.05 3.73 -0.26 1.32 0.20 -0.41 -2.19 118.68 121.12 1a6q s LEU 133 Ca -0.00 -0.79 -0.07 0.00 0.69 0.00 0.00 54.13 53.96 1a6q s LEU 133 Cb -0.05 -1.83 -0.02 0.00 -0.43 0.00 0.00 46.19 43.87 1a6q s LEU 133 CO -0.00 -0.19 0.08 -0.63 -0.29 0.00 0.00 176.35 175.32 1a6q s ILE 134 N 1.45 4.25 0.56 6.68 1.01 -0.68 -0.36 121.20 134.10 1a6q s ILE 134 Ca 0.02 -0.30 0.08 0.00 0.00 0.00 0.00 60.65 60.45 1a6q s ILE 134 Cb -0.17 -3.04 0.07 0.00 0.01 0.00 0.00 42.46 39.32 1a6q s ILE 134 CO 0.01 0.27 0.64 -0.94 0.00 0.00 0.00 174.94 174.92 1a6q s SER 135 N 1.59 4.94 0.44 3.58 1.04 0.86 -1.66 113.70 124.49 1a6q s SER 135 Ca 0.06 -0.98 0.30 0.00 0.48 0.00 0.00 55.95 55.81 1a6q s SER 135 Cb -0.16 0.31 1.48 0.00 0.10 0.00 0.00 66.02 67.75 1a6q s SER 135 CO 0.03 -1.24 1.92 -0.65 0.98 0.00 0.00 173.24 174.29 1a6q h PRO 136 N 0.40 0.00 0.00 4.02 0.11 -2.00 -3.25 132.00 131.29 1a6q h PRO 136 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1a6q h PRO 136 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1a6q h PRO 136 CO 0.47 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.30 1a6q n GLN 137 N -2.62 -0.43 -3.81 1.05 6.02 -1.26 -4.94 117.38 111.39 1a6q n GLN 137 Ca -0.01 -0.31 -0.12 0.00 -0.01 0.00 0.00 57.00 56.55 1a6q n GLN 137 Cb 0.15 -0.77 -0.10 0.00 1.02 0.00 0.00 30.24 30.54 1a6q n GLN 137 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1a6q s HIS 138 N -0.03 -0.13 -0.19 1.08 3.76 -1.23 -1.22 115.29 117.34 1a6q s HIS 138 Ca 0.00 0.22 -0.01 0.00 -0.15 0.00 0.00 55.06 55.12 1a6q s HIS 138 Cb 0.00 0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.74 1a6q s HIS 138 CO 0.00 -0.29 -0.13 0.95 -0.85 0.00 0.00 174.74 174.42 1a6q s THR 139 N -1.00 2.72 -0.39 1.30 -4.23 0.39 -0.10 115.64 114.33 1a6q s THR 139 Ca -0.11 -0.73 -0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1a6q s THR 139 Cb -0.05 -2.18 0.04 0.00 1.34 0.00 0.00 72.50 71.64 1a6q s THR 139 CO 0.02 0.49 0.23 -0.31 -0.54 0.00 0.00 174.62 174.52 1a6q s TYR 140 N 1.19 3.26 0.29 3.99 2.02 0.51 -0.90 117.35 127.72 1a6q s TYR 140 Ca 0.02 -1.03 -0.28 0.00 -0.37 0.00 0.00 57.07 55.40 1a6q s TYR 140 Cb -0.14 -2.56 -0.09 0.00 -0.40 0.00 0.00 41.96 38.76 1a6q s TYR 140 CO -0.05 -0.69 1.04 -0.06 -1.57 0.00 0.00 175.55 174.22 1a6q s PHE 141 N 1.54 3.63 -0.11 2.71 0.40 0.19 -1.28 117.98 125.06 1a6q s PHE 141 Ca 0.02 1.75 0.02 0.00 -0.60 0.00 0.00 56.93 58.12 1a6q s PHE 141 Cb -0.20 -3.16 0.02 0.00 0.51 0.00 0.00 43.02 40.18 1a6q s PHE 141 CO 0.06 -0.28 -0.15 0.42 0.70 0.00 0.00 175.22 175.97 1a6q s ILE 142 N -1.28 1.50 -0.02 0.64 1.01 0.75 -1.81 121.20 121.99 1a6q s ILE 142 Ca 0.46 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.48 1a6q s ILE 142 Cb -0.28 -1.37 0.01 0.00 0.01 0.00 0.00 42.46 40.83 1a6q s ILE 142 CO 0.36 0.44 -0.01 0.21 0.00 0.00 0.00 174.94 175.94 1a6q s ASN 143 N 1.02 0.33 -0.40 3.58 3.84 -0.25 -0.85 114.94 122.20 1a6q s ASN 143 Ca -0.06 -0.03 0.05 0.00 0.21 0.00 0.00 52.86 53.03 1a6q s ASN 143 Cb -0.15 -0.12 0.17 0.00 -0.55 0.00 0.00 41.25 40.60 1a6q s ASN 143 CO -0.02 -0.04 0.46 0.00 -2.79 0.00 0.00 177.10 174.71 1a6q n GLY 145 N 3.88 0.57 0.99 0.00 0.00 -1.24 -1.64 105.19 107.76 1a6q n GLY 145 Ca 0.15 -1.95 0.08 0.00 0.00 0.00 0.00 46.02 44.29 1a6q n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a6q n ASP 146 N 0.00 3.94 -4.82 1.61 5.75 -1.26 -1.35 116.55 120.42 1a6q n ASP 146 Ca 0.00 -2.76 -0.29 0.00 -0.01 0.00 0.00 54.79 51.73 1a6q n ASP 146 Cb 0.00 -0.50 0.11 0.00 -1.03 0.00 0.00 41.12 39.70 1a6q n ASP 146 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1a6q s SER 147 N -1.56 4.12 -0.02 -1.12 0.01 -1.26 -4.07 113.70 109.81 1a6q s SER 147 Ca 0.40 0.80 -0.14 0.00 1.31 0.00 0.00 55.95 58.32 1a6q s SER 147 Cb 0.30 -1.29 0.02 0.00 0.21 0.00 0.00 66.02 65.26 1a6q s SER 147 CO 0.12 -2.15 0.30 -0.60 0.41 0.00 0.00 173.24 171.32 1a6q s ARG 148 N -5.51 0.64 0.05 12.44 3.52 -0.13 -4.75 118.95 125.21 1a6q s ARG 148 Ca 0.63 -0.16 0.04 0.00 -0.13 0.00 0.00 55.73 56.11 1a6q s ARG 148 Cb -0.12 0.28 -0.03 0.00 -1.56 0.00 0.00 34.95 33.53 1a6q s ARG 148 CO 0.50 -0.17 -0.11 0.20 -0.81 0.00 0.00 175.30 174.91 1a6q s GLY 149 N -1.23 0.70 0.03 8.12 0.00 -1.26 -1.56 107.32 112.12 1a6q s GLY 149 Ca -0.13 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.70 1a6q s GLY 149 CO 0.04 -0.89 0.03 0.48 0.00 0.00 0.00 173.10 172.75 1a6q s LEU 150 N -1.55 2.09 -0.19 0.66 0.05 -0.42 -0.97 118.68 118.35 1a6q s LEU 150 Ca -0.04 -0.58 -0.02 0.00 0.05 0.00 0.00 54.13 53.54 1a6q s LEU 150 Cb -0.09 0.33 -0.00 0.00 -2.05 0.00 0.00 46.19 44.37 1a6q s LEU 150 CO 0.01 -0.43 -0.11 -0.22 -0.55 0.00 0.00 176.35 175.06 1a6q s LEU 151 N -1.94 2.65 -0.23 1.48 1.98 -0.08 -1.63 118.68 120.92 1a6q s LEU 151 Ca -0.08 -0.44 -0.14 0.00 -2.89 0.00 0.00 54.13 50.58 1a6q s LEU 151 Cb -0.04 -1.64 -0.04 0.00 0.66 0.00 0.00 46.19 45.13 1a6q s LEU 151 CO -0.04 0.03 0.32 0.00 -1.89 0.00 0.00 176.35 174.77 1a6q s ARG 153 N 1.37 0.90 -1.45 0.00 3.52 0.62 -1.88 118.95 122.02 1a6q s ARG 153 Ca 0.14 -0.16 -0.10 0.00 -0.13 0.00 0.00 55.73 55.48 1a6q s ARG 153 Cb -0.15 -0.86 0.04 0.00 -1.56 0.00 0.00 34.95 32.42 1a6q s ARG 153 CO 0.07 -0.04 0.97 -1.71 -0.81 0.00 0.00 175.30 173.79 1a6q n ASN 154 N 3.87 -5.61 -0.73 -2.12 5.15 -0.78 -1.63 115.26 113.40 1a6q n ASN 154 Ca -0.24 -0.57 -0.10 0.00 -0.60 0.00 0.00 54.58 53.07 1a6q n ASN 154 Cb 0.52 -4.46 -0.04 0.00 -0.53 0.00 0.00 39.78 35.26 1a6q n ASN 154 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1a6q n ARG 155 N -4.65 -0.94 -4.24 1.20 1.74 -1.26 -4.99 116.66 103.52 1a6q n ARG 155 Ca 0.00 0.79 -0.14 0.00 -0.77 0.00 0.00 57.85 57.73 1a6q n ARG 155 Cb 0.56 -4.78 -0.10 0.00 -1.02 0.00 0.00 32.46 27.11 1a6q n ARG 155 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1a6q s LYS 156 N -2.62 1.10 -0.80 5.56 1.02 -0.65 -4.99 119.74 118.37 1a6q s LYS 156 Ca 0.00 -1.52 -0.25 0.00 0.02 0.00 0.00 55.97 54.22 1a6q s LYS 156 Cb 0.00 -0.32 0.05 0.00 -0.52 0.00 0.00 37.83 37.04 1a6q s LYS 156 CO 0.00 -0.10 1.24 0.08 -0.92 0.00 0.00 175.35 175.65 1a6q s VAL 157 N -3.61 3.95 0.22 3.17 1.01 -1.26 -0.28 120.40 123.60 1a6q s VAL 157 Ca 0.23 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.13 1a6q s VAL 157 Cb 0.06 -4.89 -0.07 0.00 0.00 0.00 0.00 36.38 31.48 1a6q s VAL 157 CO 0.03 -1.77 1.52 -0.74 0.00 0.00 0.00 175.10 174.14 1a6q h HIS 158 N 9.81 0.29 -2.34 5.22 2.76 -1.02 -3.47 115.15 126.41 1a6q h HIS 158 Ca -0.15 -0.12 -0.06 0.00 -2.20 0.00 0.00 60.37 57.84 1a6q h HIS 158 Cb 1.04 -0.05 -0.18 0.00 1.55 0.00 0.00 27.41 29.78 1a6q h HIS 158 CO 1.13 0.81 0.14 0.12 -1.30 0.00 0.00 177.93 178.84 1a6q s PHE 159 N -3.63 -0.57 -0.04 5.26 2.19 -1.16 -4.98 117.98 115.05 1a6q s PHE 159 Ca -0.04 0.85 -0.20 0.00 0.33 0.00 0.00 56.93 57.88 1a6q s PHE 159 Cb 0.12 0.40 0.04 0.00 -1.31 0.00 0.00 43.02 42.27 1a6q s PHE 159 CO 0.80 -0.64 0.43 -0.59 1.83 0.00 0.00 175.22 177.05 1a6q s PHE 160 N -1.78 -0.34 0.44 10.12 -0.12 -1.26 -0.90 117.98 124.14 1a6q s PHE 160 Ca -0.08 0.59 -0.22 0.00 -0.05 0.00 0.00 56.93 57.16 1a6q s PHE 160 Cb -0.01 0.19 -0.09 0.00 -0.63 0.00 0.00 43.02 42.49 1a6q s PHE 160 CO 0.04 -0.44 1.04 0.95 -0.05 0.00 0.00 175.22 176.76 1a6q s THR 161 N -1.17 3.80 -0.31 -4.49 -4.23 -0.14 -5.00 115.64 104.10 1a6q s THR 161 Ca -0.12 1.23 -0.15 0.00 -1.18 0.00 0.00 61.69 61.47 1a6q s THR 161 Cb -0.04 -3.56 -0.02 0.00 1.34 0.00 0.00 72.50 70.22 1a6q s THR 161 CO 0.06 -0.14 0.38 -1.10 -0.54 0.00 0.00 174.62 173.28 1a6q s GLN 162 N -2.91 3.80 0.33 3.99 -1.52 -1.26 -4.77 119.66 117.32 1a6q s GLN 162 Ca 0.63 -0.16 -0.29 0.00 -1.95 0.00 0.00 55.36 53.59 1a6q s GLN 162 Cb -0.18 -3.73 -0.11 0.00 -0.22 0.00 0.00 33.01 28.77 1a6q s GLN 162 CO 0.23 -0.41 1.51 -0.51 -0.25 0.00 0.00 175.29 175.85 1a6q s ASP 163 N 1.69 6.43 -0.76 5.90 1.01 -1.26 -4.93 116.67 124.75 1a6q s ASP 163 Ca 0.14 2.94 -0.21 0.00 0.71 0.00 0.00 52.55 56.13 1a6q s ASP 163 Cb -0.16 -2.65 0.09 0.00 1.01 0.00 0.00 42.92 41.21 1a6q s ASP 163 CO 0.11 -0.84 1.02 -1.00 0.21 0.00 0.00 175.17 174.67 1a6q s HIS 164 N -0.56 2.84 -0.04 4.23 3.76 -0.45 -4.97 115.29 120.09 1a6q s HIS 164 Ca 0.57 -0.88 -0.01 0.00 -0.15 0.00 0.00 55.06 54.60 1a6q s HIS 164 Cb -0.46 -4.29 -0.04 0.00 1.11 0.00 0.00 32.58 28.91 1a6q s HIS 164 CO 0.54 -1.58 0.03 0.15 -0.85 0.00 0.00 174.74 173.03 1a6q s LYS 165 N 3.54 2.97 0.29 1.40 -0.14 -1.26 -2.67 119.74 123.86 1a6q s LYS 165 Ca 0.26 -0.47 0.03 0.00 -1.36 0.00 0.00 55.97 54.43 1a6q s LYS 165 Cb -0.13 -2.80 0.64 0.00 -1.68 0.00 0.00 37.83 33.87 1a6q s LYS 165 CO 0.02 0.67 1.80 -1.35 -0.76 0.00 0.00 175.35 175.73 1a6q h PRO 166 N 4.63 0.83 0.00 -1.68 0.11 -1.77 -1.26 132.00 132.85 1a6q h PRO 166 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1a6q h PRO 166 Cb 1.19 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1a6q h PRO 166 CO 0.57 0.55 0.00 -1.13 -0.21 0.00 0.00 178.00 177.78 1a6q n SER 167 N -4.71 0.00 -4.73 -2.05 3.41 -1.26 -2.06 113.62 102.21 1a6q n SER 167 Ca 0.21 -0.34 -0.42 0.00 -0.26 0.00 0.00 58.87 58.06 1a6q n SER 167 Cb 0.47 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.24 1a6q n SER 167 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1a6q s ASN 168 N -2.30 6.63 0.10 4.04 0.01 -0.48 -4.76 114.94 118.18 1a6q s ASN 168 Ca 0.27 2.63 -0.19 0.00 -0.71 0.00 0.00 52.86 54.86 1a6q s ASN 168 Cb 0.15 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 1a6q s ASN 168 CO 0.30 -0.75 0.95 -2.65 -1.51 0.00 0.00 177.10 173.44 1a6q n PRO 169 N 3.06 -0.27 -0.03 -0.60 -0.02 -1.26 -0.62 135.00 135.25 1a6q n PRO 169 Ca 0.10 0.93 -0.06 0.00 -2.02 0.00 0.00 63.50 62.45 1a6q n PRO 169 Cb 0.40 -1.37 0.12 0.00 -0.02 0.00 0.00 33.50 32.63 1a6q n PRO 169 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1a6q h LEU 170 N 0.00 0.64 -0.28 2.45 3.38 -1.93 -0.59 115.31 118.99 1a6q h LEU 170 Ca 0.10 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1a6q h LEU 170 Cb 0.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1a6q h LEU 170 CO -0.58 0.90 -0.04 -0.33 0.09 0.00 0.00 178.44 178.48 1a6q h GLU 171 N 0.54 0.53 -0.51 1.13 4.39 -1.35 -1.08 114.58 118.23 1a6q h GLU 171 Ca 0.07 -0.19 0.01 0.00 0.34 0.00 0.00 59.36 59.59 1a6q h GLU 171 Cb 0.77 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.36 1a6q h GLU 171 CO 0.06 0.71 0.33 -0.22 -1.16 0.00 0.00 179.01 178.74 1a6q h LYS 172 N 0.30 0.66 -0.01 2.33 3.64 -0.27 0.12 116.57 123.32 1a6q h LYS 172 Ca 0.08 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1a6q h LYS 172 Cb 0.50 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1a6q h LYS 172 CO 0.02 0.43 -0.21 1.49 -2.27 0.00 0.00 179.45 178.92 1a6q h GLU 173 N 0.68 -0.31 0.22 1.90 4.81 -0.81 0.77 114.58 121.83 1a6q h GLU 173 Ca 0.19 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1a6q h GLU 173 Cb -0.06 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1a6q h GLU 173 CO -0.05 -0.21 -0.11 -0.09 -0.73 0.00 0.00 179.01 177.82 1a6q h ARG 174 N -0.33 -0.29 -0.55 1.92 2.43 -0.81 -0.59 114.38 116.17 1a6q h ARG 174 Ca 0.06 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.36 1a6q h ARG 174 Cb 0.41 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 29.94 1a6q h ARG 174 CO -0.20 -0.19 0.06 0.82 -1.51 0.00 0.00 179.97 178.95 1a6q h ILE 175 N -0.30 0.62 -0.57 1.20 2.04 -0.41 0.33 117.51 120.41 1a6q h ILE 175 Ca -0.03 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.69 1a6q h ILE 175 Cb 0.24 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1a6q h ILE 175 CO 0.04 0.03 0.06 1.56 0.00 0.00 0.00 178.15 179.84 1a6q h GLN 176 N 0.18 0.97 0.00 2.37 4.20 -0.66 0.20 115.11 122.37 1a6q h GLN 176 Ca 0.28 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1a6q h GLN 176 Cb 0.42 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1a6q h GLN 176 CO -0.41 0.94 0.00 -0.91 -0.67 0.00 0.00 178.83 177.78 1a6q h ASN 177 N 0.86 0.00 -0.40 1.46 -0.26 -0.14 -1.62 115.58 115.48 1a6q h ASN 177 Ca 0.17 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 1a6q h ASN 177 Cb 0.47 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 1a6q h ASN 177 CO 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.39 1a6q n ALA 178 N -1.96 2.52 -0.39 -0.83 0.00 0.11 -4.88 120.51 115.08 1a6q n ALA 178 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.70 1a6q n ALA 178 Cb 0.31 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1a6q n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a6q n GLY 179 N 1.07 0.94 0.00 0.00 0.00 -0.61 -4.77 105.19 101.82 1a6q n GLY 179 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1a6q n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a6q n GLY 180 N -2.00 0.87 3.22 -0.02 0.00 0.64 -4.97 105.19 102.94 1a6q n GLY 180 Ca 0.00 -1.96 -0.11 0.00 0.00 0.00 0.00 46.02 43.95 1a6q n GLY 180 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a6q s SER 181 N -1.00 -0.07 -0.32 1.61 1.04 -1.26 -3.98 113.70 109.72 1a6q s SER 181 Ca 0.00 -0.23 -0.06 0.00 0.48 0.00 0.00 55.95 56.14 1a6q s SER 181 Cb 0.00 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.48 1a6q s SER 181 CO 0.00 -0.57 0.09 -0.69 0.98 0.00 0.00 173.24 173.05 1a6q s VAL 182 N -2.41 3.76 -0.47 5.02 1.01 -1.26 0.53 120.40 126.58 1a6q s VAL 182 Ca -0.06 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 60.75 1a6q s VAL 182 Cb -0.02 -3.08 0.09 0.00 0.00 0.00 0.00 36.38 33.38 1a6q s VAL 182 CO -0.03 -0.10 0.36 -0.04 0.00 0.00 0.00 175.10 175.30 1a6q s MET 183 N 1.42 2.83 3.03 2.72 -1.94 0.21 -4.86 119.30 122.71 1a6q s MET 183 Ca -0.01 -1.46 0.00 0.00 -1.71 0.00 0.00 55.69 52.51 1a6q s MET 183 Cb -0.19 -4.03 0.00 0.00 2.01 0.00 0.00 34.83 32.62 1a6q s MET 183 CO 0.02 -1.06 0.00 -0.89 -0.01 0.00 0.00 175.02 173.08 1a6q n ILE 184 N 5.10 0.00 -0.17 2.53 2.08 -1.26 -1.97 119.36 125.67 1a6q n ILE 184 Ca -0.12 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.19 1a6q n ILE 184 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.32 1a6q n ILE 184 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a6q n GLN 185 N 0.00 2.03 -4.99 0.38 3.00 -1.26 -4.75 117.38 111.79 1a6q n GLN 185 Ca 0.00 -1.20 -0.27 0.00 -0.01 0.00 0.00 57.00 55.52 1a6q n GLN 185 Cb 0.00 -0.92 -0.16 0.00 0.00 0.00 0.00 30.24 29.17 1a6q n GLN 185 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1a6q s ARG 186 N -0.71 1.73 -0.11 -1.09 0.52 -0.83 -4.40 118.95 114.04 1a6q s ARG 186 Ca 0.00 -0.72 -0.29 0.00 -0.52 0.00 0.00 55.73 54.20 1a6q s ARG 186 Cb 0.00 -1.63 -0.06 0.00 0.52 0.00 0.00 34.95 33.78 1a6q s ARG 186 CO 0.00 0.41 2.09 0.08 0.02 0.00 0.00 175.30 177.90 1a6q s VAL 187 N -0.38 3.04 -1.31 3.52 1.01 0.59 -0.62 120.40 126.25 1a6q s VAL 187 Ca 0.05 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.06 1a6q s VAL 187 Cb -0.09 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.26 1a6q s VAL 187 CO -0.00 -0.02 0.13 0.59 0.00 0.00 0.00 175.10 175.81 1a6q n ASN 188 N 9.88 -4.58 0.00 3.32 3.02 0.19 -0.98 115.26 126.10 1a6q n ASN 188 Ca 0.25 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1a6q n ASN 188 Cb 0.43 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 1a6q n ASN 188 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a6q n GLY 189 N -0.98 0.56 0.96 7.41 0.00 -0.47 -4.87 105.19 107.80 1a6q n GLY 189 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 1a6q n GLY 189 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1a6q n SER 190 N -0.12 0.92 -4.68 1.61 7.64 -0.15 -4.91 113.62 113.92 1a6q n SER 190 Ca 0.00 0.12 -0.40 0.00 1.01 0.00 0.00 58.87 59.60 1a6q n SER 190 Cb 0.06 -0.29 -0.05 0.00 -1.01 0.00 0.00 64.21 62.92 1a6q n SER 190 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1a6q s LEU 191 N -6.82 4.21 0.00 -3.43 2.96 -1.09 -4.83 118.68 109.68 1a6q s LEU 191 Ca -0.02 1.06 0.29 0.00 -0.22 0.00 0.00 54.13 55.23 1a6q s LEU 191 Cb 0.01 -3.07 1.16 0.00 0.50 0.00 0.00 46.19 44.79 1a6q s LEU 191 CO 0.03 -0.26 1.81 0.00 -1.32 0.00 0.00 176.35 176.61 1a6q n ALA 192 N 4.69 2.60 -2.44 5.97 0.00 -1.26 -0.30 120.51 129.76 1a6q n ALA 192 Ca 0.01 -0.41 -0.27 0.00 0.00 0.00 0.00 53.44 52.77 1a6q n ALA 192 Cb 0.50 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.59 1a6q n ALA 192 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1a6q s VAL 193 N -2.01 1.81 -0.67 0.00 -7.23 -1.26 -4.33 120.40 106.72 1a6q s VAL 193 Ca 0.39 -1.26 0.23 0.00 -1.81 0.00 0.00 61.98 59.53 1a6q s VAL 193 Cb 0.21 -1.57 -0.15 0.00 0.56 0.00 0.00 36.38 35.43 1a6q s VAL 193 CO 0.34 0.26 0.97 -1.54 -0.31 0.00 0.00 175.10 174.82 1a6q n SER 194 N 1.83 0.63 -3.99 4.85 3.41 -1.09 -4.76 113.62 114.50 1a6q n SER 194 Ca -0.17 -0.36 -0.17 0.00 -0.26 0.00 0.00 58.87 57.91 1a6q n SER 194 Cb 0.53 0.92 -0.14 0.00 -0.26 0.00 0.00 64.21 65.25 1a6q n SER 194 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1a6q s ARG 195 N -3.17 0.55 0.00 4.33 0.52 -1.26 -1.01 118.95 118.91 1a6q s ARG 195 Ca 0.04 -0.30 0.00 0.00 -0.52 0.00 0.00 55.73 54.95 1a6q s ARG 195 Cb 0.15 -0.51 0.00 0.00 0.52 0.00 0.00 34.95 35.10 1a6q s ARG 195 CO 0.82 0.14 0.00 0.00 0.02 0.00 0.00 175.30 176.28 1a6q n ALA 196 N 2.75 0.00 -2.75 2.13 0.00 -0.37 -3.62 120.51 118.66 1a6q n ALA 196 Ca -0.14 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.02 1a6q n ALA 196 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 1a6q n ALA 196 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1a6q s LEU 197 N 0.00 4.22 0.00 0.00 1.43 0.69 -3.76 118.68 121.26 1a6q s LEU 197 Ca 0.00 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.53 1a6q s LEU 197 Cb 0.00 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 43.02 1a6q s LEU 197 CO 0.00 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.14 1a6q n GLY 198 N -0.67 -0.62 3.85 -3.19 0.00 -1.26 -0.72 105.19 102.58 1a6q n GLY 198 Ca -0.04 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 1a6q n GLY 198 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1a6q n ASP 199 N 0.50 -3.13 0.24 1.61 8.00 -0.40 -4.87 116.55 118.50 1a6q n ASP 199 Ca 0.00 -0.81 0.16 0.00 0.71 0.00 0.00 54.79 54.85 1a6q n ASP 199 Cb 0.00 -3.87 0.85 0.00 -0.02 0.00 0.00 41.12 38.08 1a6q n ASP 199 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1a6q h PHE 200 N -1.98 0.00 0.00 1.24 0.04 -1.91 -0.68 116.94 113.65 1a6q h PHE 200 Ca -0.60 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.17 1a6q h PHE 200 Cb 1.37 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.52 1a6q h PHE 200 CO 0.53 0.00 -0.02 -0.44 -0.60 0.00 0.00 178.31 177.77 1a6q h ASP 201 N 0.00 0.00 -0.27 2.17 3.32 -1.96 -2.35 116.42 117.32 1a6q h ASP 201 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1a6q h ASP 201 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1a6q h ASP 201 CO 0.00 0.02 0.00 -1.22 -1.72 0.00 0.00 179.24 176.32 1a6q n TYR 202 N -3.11 0.35 -2.23 4.55 4.02 -0.26 -4.18 117.16 116.29 1a6q n TYR 202 Ca 0.02 -0.17 -0.21 0.00 -0.01 0.00 0.00 57.90 57.52 1a6q n TYR 202 Cb 0.39 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.73 1a6q n TYR 202 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1a6q n LYS 203 N 0.98 3.26 -0.04 -0.72 5.02 -0.88 -2.07 118.16 123.70 1a6q n LYS 203 Ca 0.18 -4.11 0.05 0.00 -2.02 0.00 0.00 58.31 52.40 1a6q n LYS 203 Cb 0.49 -2.15 0.07 0.00 -0.02 0.00 0.00 35.03 33.41 1a6q n LYS 203 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a6q s VAL 205 N -1.86 3.64 0.22 0.00 1.01 -1.26 -4.96 120.40 117.19 1a6q s VAL 205 Ca 0.15 0.73 -0.30 0.00 0.00 0.00 0.00 61.98 62.56 1a6q s VAL 205 Cb 0.13 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 1a6q s VAL 205 CO 0.02 -0.26 1.07 -1.00 0.00 0.00 0.00 175.10 174.93 1a6q s HIS 206 N 5.22 3.65 0.00 5.22 3.76 -1.26 -3.06 115.29 128.82 1a6q s HIS 206 Ca 0.73 1.69 0.00 0.00 -0.15 0.00 0.00 55.06 57.33 1a6q s HIS 206 Cb -0.26 -3.23 0.00 0.00 1.11 0.00 0.00 32.58 30.20 1a6q s HIS 206 CO 0.30 -0.40 0.00 0.41 -0.85 0.00 0.00 174.74 174.20 1a6q n GLY 207 N 1.70 0.74 3.18 -2.22 0.00 -1.26 -5.06 105.19 102.26 1a6q n GLY 207 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1a6q n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a6q s LYS 208 N -0.69 1.15 1.11 1.61 -0.14 -1.17 -5.15 119.74 116.45 1a6q s LYS 208 Ca 0.00 -0.80 -0.17 0.00 -1.36 0.00 0.00 55.97 53.64 1a6q s LYS 208 Cb 0.00 -1.19 0.25 0.00 -1.68 0.00 0.00 37.83 35.21 1a6q s LYS 208 CO 0.00 0.30 1.15 0.20 -0.76 0.00 0.00 175.35 176.24 1a6q s GLY 209 N -1.05 1.61 0.40 -3.33 0.00 -1.26 -4.86 107.32 98.84 1a6q s GLY 209 Ca 0.04 -0.87 0.07 0.00 0.00 0.00 0.00 44.72 43.96 1a6q s GLY 209 CO 0.01 -0.07 2.03 -2.55 0.00 0.00 0.00 173.10 172.52 1a6q h PRO 210 N -2.24 0.58 -0.64 2.90 0.11 -1.98 -1.39 132.00 129.34 1a6q h PRO 210 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1a6q h PRO 210 Cb 1.29 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1a6q h PRO 210 CO 0.41 0.38 0.00 0.25 -0.21 0.00 0.00 178.00 178.83 1a6q n THR 211 N -4.47 2.16 -1.07 -1.15 -2.24 -1.26 -4.09 114.28 102.16 1a6q n THR 211 Ca 0.05 -1.16 0.04 0.00 -2.27 0.00 0.00 64.05 60.71 1a6q n THR 211 Cb 0.11 -0.18 0.06 0.00 -2.10 0.00 0.00 70.33 68.22 1a6q n THR 211 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1a6q n GLU 212 N 0.70 1.16 -1.99 -0.78 1.02 -0.53 -4.94 120.64 115.28 1a6q n GLU 212 Ca 0.24 -1.69 -0.27 0.00 -0.02 0.00 0.00 57.16 55.41 1a6q n GLU 212 Cb 0.99 -1.02 0.18 0.00 -0.02 0.00 0.00 31.44 31.58 1a6q n GLU 212 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1a6q n GLN 213 N -0.70 -1.03 -0.13 3.49 1.13 -1.21 -4.52 117.38 114.41 1a6q n GLN 213 Ca 0.07 -2.14 -0.08 0.00 -1.94 0.00 0.00 57.00 52.90 1a6q n GLN 213 Cb 0.55 -1.20 -0.00 0.00 0.11 0.00 0.00 30.24 29.71 1a6q n GLN 213 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1a6q h LEU 214 N 0.00 0.48 -8.74 1.08 3.38 -1.72 -3.41 115.31 106.38 1a6q h LEU 214 Ca -0.40 -0.05 -0.67 0.00 0.09 0.00 0.00 57.88 56.85 1a6q h LEU 214 Cb 1.17 -0.12 -0.25 0.00 0.09 0.00 0.00 40.66 41.54 1a6q h LEU 214 CO 0.31 0.40 -0.75 -0.69 0.09 0.00 0.00 178.44 177.79 1a6q s VAL 215 N -6.00 3.16 -0.09 1.22 1.01 -1.19 -4.64 120.40 113.87 1a6q s VAL 215 Ca -0.13 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 1a6q s VAL 215 Cb 0.11 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1a6q s VAL 215 CO 0.73 0.54 -0.04 -0.55 0.00 0.00 0.00 175.10 175.79 1a6q s SER 216 N -0.01 4.89 0.00 3.32 0.15 -0.18 -4.78 113.70 117.10 1a6q s SER 216 Ca -0.03 0.01 0.23 0.00 0.70 0.00 0.00 55.95 56.86 1a6q s SER 216 Cb -0.14 -1.41 0.85 0.00 -1.71 0.00 0.00 66.02 63.61 1a6q s SER 216 CO 0.04 0.33 1.61 -0.81 1.20 0.00 0.00 173.24 175.60 1a6q n PRO 217 N 2.49 1.69 -2.50 5.44 -0.04 -1.25 -1.23 135.00 139.60 1a6q n PRO 217 Ca -0.18 -1.03 -0.42 0.00 -0.04 0.00 0.00 63.50 61.83 1a6q n PRO 217 Cb 0.53 -1.42 -0.03 0.00 -0.04 0.00 0.00 33.50 32.55 1a6q n PRO 217 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1a6q s GLU 218 N -1.85 4.38 0.42 0.54 2.12 -1.26 -4.54 118.70 118.51 1a6q s GLU 218 Ca 0.34 1.64 -0.03 0.00 0.36 0.00 0.00 54.97 57.28 1a6q s GLU 218 Cb 0.18 -3.52 -0.04 0.00 0.26 0.00 0.00 34.13 31.01 1a6q s GLU 218 CO 0.28 -0.38 0.68 -1.25 -0.54 0.00 0.00 175.26 174.05 1a6q s PRO 219 N 1.97 3.52 -0.16 4.30 0.04 -1.26 -4.81 135.00 138.60 1a6q s PRO 219 Ca 0.55 -0.03 -0.03 0.00 0.04 0.00 0.00 61.00 61.53 1a6q s PRO 219 Cb -0.24 -2.50 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 1a6q s PRO 219 CO 0.23 -0.04 -0.06 -2.00 0.04 0.00 0.00 177.00 175.17 1a6q s GLU 220 N -4.53 3.56 -0.05 4.56 2.12 0.80 -4.93 118.70 120.24 1a6q s GLU 220 Ca 0.44 -0.57 0.05 0.00 0.36 0.00 0.00 54.97 55.25 1a6q s GLU 220 Cb -0.10 -2.88 -0.00 0.00 0.26 0.00 0.00 34.13 31.41 1a6q s GLU 220 CO 0.41 0.16 -0.19 0.08 -0.54 0.00 0.00 175.26 175.17 1a6q s VAL 221 N 0.55 1.62 -0.08 3.70 1.01 -1.26 -1.09 120.40 124.85 1a6q s VAL 221 Ca -0.04 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1a6q s VAL 221 Cb -0.15 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.87 1a6q s VAL 221 CO 0.03 0.46 -0.06 -1.00 0.00 0.00 0.00 175.10 174.53 1a6q s HIS 222 N 0.03 1.14 -0.20 5.22 3.76 -0.75 -4.96 115.29 119.53 1a6q s HIS 222 Ca -0.05 -0.46 -0.22 0.00 -0.15 0.00 0.00 55.06 54.18 1a6q s HIS 222 Cb -0.13 -0.98 -0.02 0.00 1.11 0.00 0.00 32.58 32.56 1a6q s HIS 222 CO 0.03 -0.35 0.69 0.34 -0.85 0.00 0.00 174.74 174.60 1a6q s ASP 223 N 1.36 6.75 -0.15 1.40 2.15 -1.26 -0.64 116.67 126.28 1a6q s ASP 223 Ca -0.03 0.92 0.00 0.00 0.43 0.00 0.00 52.55 53.87 1a6q s ASP 223 Cb -0.14 -2.38 0.02 0.00 -0.30 0.00 0.00 42.92 40.13 1a6q s ASP 223 CO -0.03 -0.32 -0.14 -0.63 -0.17 0.00 0.00 175.17 173.87 1a6q s ILE 224 N 2.07 1.61 0.19 4.11 1.01 -0.08 -4.99 121.20 125.11 1a6q s ILE 224 Ca 0.31 -0.67 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 1a6q s ILE 224 Cb -0.16 -1.51 -0.09 0.00 0.01 0.00 0.00 42.46 40.71 1a6q s ILE 224 CO 0.10 0.45 1.34 -1.61 0.00 0.00 0.00 174.94 175.22 1a6q s GLU 225 N 1.47 4.36 0.71 2.79 2.02 -1.26 -0.46 118.70 128.33 1a6q s GLU 225 Ca 0.05 2.08 -0.13 0.00 0.02 0.00 0.00 54.97 56.99 1a6q s GLU 225 Cb -0.13 -3.20 0.03 0.00 0.10 0.00 0.00 34.13 30.93 1a6q s GLU 225 CO -0.11 -0.31 1.11 1.03 0.02 0.00 0.00 175.26 177.01 1a6q s ARG 226 N 0.13 2.50 -0.28 1.61 0.52 -0.36 -4.88 118.95 118.19 1a6q s ARG 226 Ca 0.59 1.36 -0.04 0.00 -0.52 0.00 0.00 55.73 57.12 1a6q s ARG 226 Cb -0.37 -1.91 0.10 0.00 0.52 0.00 0.00 34.95 33.28 1a6q s ARG 226 CO 0.37 -1.48 0.12 0.45 0.02 0.00 0.00 175.30 174.78 1a6q s SER 227 N -2.79 3.53 0.24 0.23 0.15 -1.26 -4.97 113.70 108.83 1a6q s SER 227 Ca 0.66 -1.29 -0.04 0.00 0.70 0.00 0.00 55.95 55.97 1a6q s SER 227 Cb -0.20 -0.42 0.42 0.00 -1.71 0.00 0.00 66.02 64.10 1a6q s SER 227 CO 0.47 -0.43 1.77 -0.08 1.20 0.00 0.00 173.24 176.18 1a6q h GLU 228 N 8.36 0.61 -0.26 5.44 4.57 -1.96 0.25 114.58 131.59 1a6q h GLU 228 Ca -0.19 -0.04 -0.17 0.00 -1.18 0.00 0.00 59.36 57.79 1a6q h GLU 228 Cb 1.02 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.47 1a6q h GLU 228 CO 0.43 0.40 -0.50 0.93 -1.18 0.00 0.00 179.01 179.09 1a6q h GLU 229 N 0.63 0.72 0.00 1.92 4.39 -2.00 -3.38 114.58 116.85 1a6q h GLU 229 Ca 0.40 -0.43 -0.07 0.00 0.34 0.00 0.00 59.36 59.60 1a6q h GLU 229 Cb 0.47 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1a6q h GLU 229 CO -0.31 1.05 -1.88 -0.25 -1.16 0.00 0.00 179.01 176.46 1a6q n ASP 230 N -4.00 0.94 -4.69 1.42 8.00 -0.98 -4.84 116.55 112.41 1a6q n ASP 230 Ca -0.03 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.05 1a6q n ASP 230 Cb 0.59 1.60 -0.03 0.00 -0.02 0.00 0.00 41.12 43.27 1a6q n ASP 230 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1a6q s ASP 231 N -4.27 6.68 -0.05 -2.24 1.01 0.84 -1.86 116.67 116.77 1a6q s ASP 231 Ca -0.07 2.38 -0.07 0.00 0.71 0.00 0.00 52.55 55.50 1a6q s ASP 231 Cb 0.10 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1a6q s ASP 231 CO 0.72 -0.83 -0.13 0.00 0.21 0.00 0.00 175.17 175.14 1a6q n GLN 232 N 5.46 0.19 -3.60 8.23 6.02 -0.79 -3.87 117.38 129.03 1a6q n GLN 232 Ca 0.15 0.08 -0.11 0.00 -0.01 0.00 0.00 57.00 57.11 1a6q n GLN 232 Cb 0.41 -0.76 -0.03 0.00 1.02 0.00 0.00 30.24 30.88 1a6q n GLN 232 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1a6q s PHE 233 N -1.86 -0.30 0.04 1.08 -0.12 -1.16 -0.16 117.98 115.50 1a6q s PHE 233 Ca -0.11 0.01 0.08 0.00 -0.05 0.00 0.00 56.93 56.86 1a6q s PHE 233 Cb 0.01 0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 42.82 1a6q s PHE 233 CO 0.16 -0.86 -0.24 0.42 -0.05 0.00 0.00 175.22 174.64 1a6q s ILE 234 N -3.81 1.97 -0.10 -4.49 1.01 0.36 -0.44 121.20 115.70 1a6q s ILE 234 Ca 0.05 -1.28 0.01 0.00 0.00 0.00 0.00 60.65 59.42 1a6q s ILE 234 Cb -0.01 -1.68 0.02 0.00 0.01 0.00 0.00 42.46 40.80 1a6q s ILE 234 CO -0.08 0.34 -0.11 -0.63 0.00 0.00 0.00 174.94 174.46 1a6q s ILE 235 N -0.77 1.18 -0.11 2.92 1.01 -0.64 -1.40 121.20 123.38 1a6q s ILE 235 Ca 0.10 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.35 1a6q s ILE 235 Cb -0.10 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.25 1a6q s ILE 235 CO 0.02 0.38 -0.22 -0.76 0.00 0.00 0.00 174.94 174.35 1a6q s LEU 236 N 1.25 2.16 0.05 2.97 1.43 -0.68 -1.30 118.68 124.56 1a6q s LEU 236 Ca -0.03 -0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 52.33 1a6q s LEU 236 Cb -0.14 -1.44 0.04 0.00 0.03 0.00 0.00 46.19 44.68 1a6q s LEU 236 CO -0.04 0.15 0.45 0.00 0.23 0.00 0.00 176.35 177.14 1a6q s ALA 237 N 0.43 -1.12 0.64 4.21 0.00 -0.60 -0.86 121.76 124.46 1a6q s ALA 237 Ca -0.16 0.39 -0.10 0.00 0.00 0.00 0.00 51.96 52.10 1a6q s ALA 237 Cb -0.17 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 1a6q s ALA 237 CO 0.07 -0.48 1.01 0.00 0.00 0.00 0.00 175.76 176.36 1a6q n ASP 239 N -2.79 0.16 0.24 0.00 5.68 -1.26 -0.72 116.55 117.87 1a6q n ASP 239 Ca 0.06 0.47 0.09 0.00 -0.50 0.00 0.00 54.79 54.91 1a6q n ASP 239 Cb 0.56 -0.46 0.61 0.00 -1.14 0.00 0.00 41.12 40.69 1a6q n ASP 239 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1a6q h GLY 240 N 0.00 0.00 0.00 6.12 0.00 -1.92 0.37 103.07 107.64 1a6q h GLY 240 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1a6q h GLY 240 CO 0.00 0.00 -0.43 -2.22 0.00 0.00 0.00 176.54 173.89 1a6q h ILE 241 N 0.00 0.17 -0.16 2.60 1.08 -1.21 -3.39 117.51 116.59 1a6q h ILE 241 Ca -0.00 -1.18 0.05 0.00 -0.39 0.00 0.00 64.86 63.34 1a6q h ILE 241 Cb 0.40 0.37 -0.01 0.00 -3.07 0.00 0.00 36.82 34.51 1a6q h ILE 241 CO 0.02 0.06 0.13 -0.50 -0.69 0.00 0.00 178.15 177.17 1a6q h TRP 242 N -1.00 0.00 -0.06 1.37 -0.00 -1.47 -1.98 115.95 112.80 1a6q h TRP 242 Ca -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 58.89 58.87 1a6q h TRP 242 Cb 0.47 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.63 1a6q h TRP 242 CO -0.11 0.00 0.06 -0.44 -0.00 0.00 0.00 178.44 177.95 1a6q h ASP 243 N 0.00 0.00 -0.00 -3.49 3.32 -0.46 -3.18 116.42 112.62 1a6q h ASP 243 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1a6q h ASP 243 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1a6q h ASP 243 CO -0.00 0.00 -0.01 0.55 -1.72 0.00 0.00 179.24 178.06 1a6q n VAL 244 N -3.99 0.00 -3.84 -1.35 3.14 -0.76 -5.00 118.33 106.52 1a6q n VAL 244 Ca -0.01 -0.49 -0.16 0.00 -2.96 0.00 0.00 64.34 60.71 1a6q n VAL 244 Cb 0.16 1.01 -0.16 0.00 -1.06 0.00 0.00 33.84 33.78 1a6q n VAL 244 CO 0.00 0.00 0.00 -0.04 -6.46 0.00 0.00 176.83 170.33 1a6q s MET 245 N -0.59 0.12 0.95 1.45 -1.94 -1.09 -5.05 119.30 113.15 1a6q s MET 245 Ca 0.00 0.14 -0.14 0.00 -1.71 0.00 0.00 55.69 53.98 1a6q s MET 245 Cb 0.00 -0.36 0.17 0.00 2.01 0.00 0.00 34.83 36.65 1a6q s MET 245 CO 0.01 -0.15 1.20 0.20 -0.01 0.00 0.00 175.02 176.27 1a6q s GLY 246 N 1.06 1.64 0.09 -0.03 0.00 -1.26 -4.41 107.32 104.41 1a6q s GLY 246 Ca -0.09 -0.81 -0.30 0.00 0.00 0.00 0.00 44.72 43.52 1a6q s GLY 246 CO -0.02 -0.15 1.63 3.43 0.00 0.00 0.00 173.10 177.98 1a6q h ASN 247 N -1.61 -0.81 0.46 1.64 2.35 -1.99 -0.59 115.58 115.02 1a6q h ASN 247 Ca -0.47 0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.20 1a6q h ASN 247 Cb 1.30 0.26 -0.01 0.00 0.05 0.00 0.00 38.32 39.92 1a6q h ASN 247 CO 0.52 -0.46 -0.63 -0.08 -1.65 0.00 0.00 177.43 175.13 1a6q h GLU 248 N -0.70 0.16 0.02 0.81 4.57 -1.98 -1.21 114.58 116.25 1a6q h GLU 248 Ca -0.03 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1a6q h GLU 248 Cb 0.61 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1a6q h GLU 248 CO -0.01 0.73 -0.01 0.93 -1.18 0.00 0.00 179.01 179.47 1a6q h GLU 249 N 0.12 -0.03 -0.23 1.92 5.08 -1.92 0.24 114.58 119.77 1a6q h GLU 249 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1a6q h GLU 249 Cb 1.13 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1a6q h GLU 249 CO 0.09 0.12 0.05 1.25 -1.00 0.00 0.00 179.01 179.52 1a6q h LEU 250 N -0.16 0.36 -0.09 1.33 5.85 -1.08 0.19 115.31 121.70 1a6q h LEU 250 Ca -0.00 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.51 1a6q h LEU 250 Cb 0.15 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1a6q h LEU 250 CO 0.00 0.51 -0.17 0.00 -0.34 0.00 0.00 178.44 178.45 1a6q h ASP 252 N -0.23 1.13 0.02 0.00 3.32 -0.34 -1.61 116.42 118.71 1a6q h ASP 252 Ca 0.08 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1a6q h ASP 252 Cb 0.35 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1a6q h ASP 252 CO -0.23 0.80 -0.01 0.15 -1.72 0.00 0.00 179.24 178.23 1a6q h PHE 253 N 1.32 -0.03 -0.99 4.55 3.57 0.29 -2.11 116.94 123.54 1a6q h PHE 253 Ca 0.38 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.89 1a6q h PHE 253 Cb -0.08 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.61 1a6q h PHE 253 CO -0.00 0.18 0.66 0.28 -2.23 0.00 0.00 178.31 177.19 1a6q h VAL 254 N -0.23 1.25 -0.03 1.41 2.07 -0.45 -1.54 116.25 118.73 1a6q h VAL 254 Ca -0.00 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.08 1a6q h VAL 254 Cb 0.22 -0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 1a6q h VAL 254 CO 0.00 0.24 -0.09 -0.09 0.02 0.00 0.00 177.57 177.66 1a6q h ARG 255 N 1.34 -0.13 -0.83 1.57 2.43 -1.20 0.18 114.38 117.74 1a6q h ARG 255 Ca 0.36 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.64 1a6q h ARG 255 Cb -0.15 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.37 1a6q h ARG 255 CO -0.08 -0.09 0.54 0.66 -1.51 0.00 0.00 179.97 179.49 1a6q h SER 256 N -0.14 0.72 0.65 -3.80 4.64 -0.75 -0.16 113.55 114.72 1a6q h SER 256 Ca 0.05 0.02 -0.18 0.00 -0.47 0.00 0.00 61.79 61.21 1a6q h SER 256 Cb 0.20 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1a6q h SER 256 CO -0.12 0.43 -0.81 0.03 -0.87 0.00 0.00 176.83 175.50 1a6q h ARG 257 N 0.80 0.11 -0.09 4.77 2.47 -0.64 -3.03 114.38 118.77 1a6q h ARG 257 Ca 0.38 -0.11 -0.14 0.00 -1.26 0.00 0.00 59.98 58.84 1a6q h ARG 257 Cb 0.41 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.75 1a6q h ARG 257 CO -0.15 0.86 -0.58 -0.07 0.56 0.00 0.00 179.97 180.59 1a6q h LEU 258 N 0.06 0.32 -0.57 3.04 3.38 0.72 0.07 115.31 122.34 1a6q h LEU 258 Ca -0.02 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1a6q h LEU 258 Cb 1.41 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1a6q h LEU 258 CO 0.12 0.83 0.00 -0.62 0.09 0.00 0.00 178.44 178.86 1a6q n GLU 259 N -3.90 0.12 -0.07 1.13 1.02 -0.21 -2.79 120.64 115.94 1a6q n GLU 259 Ca -0.02 0.42 -0.08 0.00 -0.02 0.00 0.00 57.16 57.46 1a6q n GLU 259 Cb 0.60 -1.76 -0.11 0.00 -0.02 0.00 0.00 31.44 30.16 1a6q n GLU 259 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1a6q n VAL 260 N -1.99 0.99 -3.86 2.62 0.31 -0.85 0.26 118.33 115.82 1a6q n VAL 260 Ca 0.02 -0.59 -0.10 0.00 -0.01 0.00 0.00 64.34 63.66 1a6q n VAL 260 Cb 0.16 -0.68 -0.08 0.00 -0.91 0.00 0.00 33.84 32.33 1a6q n VAL 260 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1a6q s THR 261 N -2.35 0.13 -0.90 2.52 2.01 -0.05 -4.87 115.64 112.14 1a6q s THR 261 Ca -0.09 -1.04 0.09 0.00 0.31 0.00 0.00 61.69 60.96 1a6q s THR 261 Cb 0.04 -1.08 0.19 0.00 0.01 0.00 0.00 72.50 71.66 1a6q s THR 261 CO 0.57 -0.57 1.06 -0.90 -0.69 0.00 0.00 174.62 174.09 1a6q n ASP 262 N 0.40 2.42 -4.51 3.53 5.75 -1.26 -4.28 116.55 118.60 1a6q n ASP 262 Ca -0.17 -1.79 -0.42 0.00 -0.01 0.00 0.00 54.79 52.40 1a6q n ASP 262 Cb 0.60 -0.12 -0.03 0.00 -1.03 0.00 0.00 41.12 40.53 1a6q n ASP 262 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1a6q s ASP 263 N -0.92 6.20 0.47 -1.12 -1.08 -1.26 -4.86 116.67 114.10 1a6q s ASP 263 Ca 0.16 -0.75 0.21 0.00 -0.52 0.00 0.00 52.55 51.65 1a6q s ASP 263 Cb 0.09 -2.51 1.16 0.00 -1.46 0.00 0.00 42.92 40.21 1a6q s ASP 263 CO 0.12 -1.66 1.98 -0.07 0.52 0.00 0.00 175.17 176.07 1a6q h LEU 264 N 12.36 0.00 -0.61 -1.34 3.38 -1.89 -2.16 115.31 125.05 1a6q h LEU 264 Ca -0.24 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.59 1a6q h LEU 264 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1a6q h LEU 264 CO 1.25 0.20 -0.42 -0.33 0.09 0.00 0.00 178.44 179.22 1a6q h GLU 265 N 0.00 0.61 -0.43 1.13 5.08 -1.87 -2.18 114.58 116.92 1a6q h GLU 265 Ca -0.00 -0.33 -0.15 0.00 -1.00 0.00 0.00 59.36 57.89 1a6q h GLU 265 Cb 0.44 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1a6q h GLU 265 CO 0.03 0.92 -0.31 -0.22 -1.00 0.00 0.00 179.01 178.43 1a6q h LYS 266 N 0.50 0.97 -0.80 2.33 3.64 -1.84 -1.18 116.57 120.19 1a6q h LYS 266 Ca 0.04 -0.46 -0.03 0.00 -1.27 0.00 0.00 60.65 58.93 1a6q h LYS 266 Cb 0.94 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.72 1a6q h LYS 266 CO 0.08 1.13 0.39 0.28 -2.27 0.00 0.00 179.45 179.06 1a6q h VAL 267 N 0.81 1.25 -0.46 2.00 2.07 -1.28 -0.50 116.25 120.14 1a6q h VAL 267 Ca 0.08 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1a6q h VAL 267 Cb 0.89 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1a6q h VAL 267 CO 0.08 0.30 0.04 0.00 0.02 0.00 0.00 177.57 178.01 1a6q h ASN 269 N 0.64 0.88 -0.27 0.00 2.35 -0.89 -1.16 115.58 117.14 1a6q h ASN 269 Ca 0.14 -0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 1a6q h ASN 269 Cb 0.43 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1a6q h ASN 269 CO 0.01 0.73 -0.12 -0.33 -1.65 0.00 0.00 177.43 176.07 1a6q h GLU 270 N 0.98 0.68 -0.25 0.81 5.08 -0.86 -0.96 114.58 120.04 1a6q h GLU 270 Ca 0.24 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1a6q h GLU 270 Cb 0.07 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1a6q h GLU 270 CO -0.03 0.78 -0.05 0.28 -1.00 0.00 0.00 179.01 178.98 1a6q h VAL 271 N 0.62 1.28 -0.12 3.13 2.07 -0.57 -1.66 116.25 120.99 1a6q h VAL 271 Ca 0.11 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 1a6q h VAL 271 Cb 0.57 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1a6q h VAL 271 CO 0.04 0.33 0.07 0.58 0.02 0.00 0.00 177.57 178.60 1a6q h VAL 272 N 0.23 1.09 -0.34 2.57 2.07 -1.04 -1.03 116.25 119.79 1a6q h VAL 272 Ca 0.07 -0.25 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 1a6q h VAL 272 Cb 0.51 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1a6q h VAL 272 CO 0.02 0.08 -0.17 0.44 0.02 0.00 0.00 177.57 177.97 1a6q h ASP 273 N 0.10 0.62 -0.63 0.57 3.32 -1.22 -0.74 116.42 118.44 1a6q h ASP 273 Ca 0.04 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1a6q h ASP 273 Cb 0.07 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 1a6q h ASP 273 CO -0.01 0.80 0.22 0.74 -1.72 0.00 0.00 179.24 179.27 1a6q h THR 274 N 0.56 1.24 -0.06 0.35 2.02 -1.09 0.71 112.91 116.66 1a6q h THR 274 Ca 0.09 -0.81 -0.11 0.00 0.77 0.00 0.00 66.41 66.35 1a6q h THR 274 Cb 0.60 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1a6q h THR 274 CO 0.04 0.31 -0.48 0.00 0.37 0.00 0.00 175.52 175.76 1a6q h LEU 276 N 0.11 0.51 -1.63 0.00 7.12 -0.87 0.70 115.31 121.26 1a6q h LEU 276 Ca 0.00 -0.46 -0.02 0.00 0.13 0.00 0.00 57.88 57.54 1a6q h LEU 276 Cb 0.89 -0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 40.88 1a6q h LEU 276 CO 0.07 0.86 -0.08 1.88 -0.13 0.00 0.00 178.44 181.04 1a6q h TYR 277 N 0.17 0.00 -0.00 1.25 0.05 -0.52 0.12 116.97 118.03 1a6q h TYR 277 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.82 1a6q h TYR 277 Cb 0.71 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.45 1a6q h TYR 277 CO 0.07 0.08 -0.03 1.63 -1.05 0.00 0.00 178.16 178.86 1a6q n LYS 278 N -3.27 1.02 0.00 4.88 5.02 0.40 -4.90 118.16 121.31 1a6q n LYS 278 Ca -0.00 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.01 1a6q n LYS 278 Cb 0.30 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1a6q n LYS 278 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a6q n GLY 279 N 1.14 0.99 3.71 0.72 0.00 0.03 -5.03 105.19 106.75 1a6q n GLY 279 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1a6q n GLY 279 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1a6q s SER 280 N -1.89 6.87 -0.26 1.61 0.15 0.22 -4.88 113.70 115.52 1a6q s SER 280 Ca 0.00 2.24 0.09 0.00 0.70 0.00 0.00 55.95 58.98 1a6q s SER 280 Cb 0.00 -2.58 0.44 0.00 -1.71 0.00 0.00 66.02 62.17 1a6q s SER 280 CO 0.00 -0.63 1.26 0.54 1.20 0.00 0.00 173.24 175.61 1a6q n ARG 281 N 4.15 2.25 -4.59 5.44 1.74 -1.26 -4.54 116.66 119.85 1a6q n ARG 281 Ca 0.11 -3.55 -0.27 0.00 -0.77 0.00 0.00 57.85 53.37 1a6q n ARG 281 Cb 0.43 -1.86 -0.11 0.00 -1.02 0.00 0.00 32.46 29.91 1a6q n ARG 281 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1a6q s ASP 282 N -3.22 3.68 0.49 0.55 2.15 -1.26 -4.13 116.67 114.93 1a6q s ASP 282 Ca 0.43 -1.35 -0.23 0.00 0.43 0.00 0.00 52.55 51.84 1a6q s ASP 282 Cb 0.39 -0.36 -0.06 0.00 -0.30 0.00 0.00 42.92 42.59 1a6q s ASP 282 CO -0.03 -0.44 1.28 0.20 -0.17 0.00 0.00 175.17 176.01 1a6q s ASN 283 N -3.67 5.78 -0.05 -0.34 0.02 -1.25 -4.49 114.94 110.95 1a6q s ASN 283 Ca 0.35 2.58 0.02 0.00 -1.02 0.00 0.00 52.86 54.79 1a6q s ASN 283 Cb 0.09 -2.62 0.01 0.00 0.02 0.00 0.00 41.25 38.75 1a6q s ASN 283 CO 0.17 -1.20 -0.10 -0.04 0.02 0.00 0.00 177.10 175.95 1a6q s MET 284 N -2.72 1.28 -0.02 -0.60 -1.94 -0.49 -4.17 119.30 110.65 1a6q s MET 284 Ca 0.66 -0.32 -0.00 0.00 -1.71 0.00 0.00 55.69 54.32 1a6q s MET 284 Cb -0.36 -1.13 0.02 0.00 2.01 0.00 0.00 34.83 35.37 1a6q s MET 284 CO 0.43 0.04 0.03 -1.12 -0.01 0.00 0.00 175.02 174.39 1a6q s SER 285 N 0.55 0.02 0.01 3.03 0.01 -1.26 -0.76 113.70 115.30 1a6q s SER 285 Ca -0.10 0.05 0.01 0.00 1.31 0.00 0.00 55.95 57.22 1a6q s SER 285 Cb -0.13 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.08 1a6q s SER 285 CO 0.02 -0.08 -0.03 -0.69 0.41 0.00 0.00 173.24 172.87 1a6q s VAL 286 N 0.64 0.23 -0.10 3.43 1.01 -0.55 -2.60 120.40 122.46 1a6q s VAL 286 Ca -0.05 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1a6q s VAL 286 Cb -0.08 -0.24 0.02 0.00 0.00 0.00 0.00 36.38 36.08 1a6q s VAL 286 CO -0.02 -0.08 -0.11 -0.63 0.00 0.00 0.00 175.10 174.25 1a6q s ILE 287 N -0.43 1.21 -0.24 2.22 1.01 -0.04 -1.51 121.20 123.41 1a6q s ILE 287 Ca -0.03 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1a6q s ILE 287 Cb -0.03 -1.15 0.02 0.00 0.01 0.00 0.00 42.46 41.31 1a6q s ILE 287 CO -0.00 0.39 -0.05 -0.22 0.00 0.00 0.00 174.94 175.05 1a6q s LEU 288 N 1.17 3.14 -0.24 2.97 0.20 -0.50 -1.69 118.68 123.74 1a6q s LEU 288 Ca -0.04 -0.77 -0.02 0.00 0.69 0.00 0.00 54.13 53.99 1a6q s LEU 288 Cb -0.14 -1.68 0.02 0.00 -0.43 0.00 0.00 46.19 43.96 1a6q s LEU 288 CO -0.03 -0.11 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.23 1a6q s ILE 289 N 1.36 2.85 -0.07 6.68 1.09 -0.50 -2.05 121.20 130.57 1a6q s ILE 289 Ca 0.02 -1.01 -0.06 0.00 -1.10 0.00 0.00 60.65 58.50 1a6q s ILE 289 Cb -0.16 -2.44 -0.04 0.00 -1.06 0.00 0.00 42.46 38.76 1a6q s ILE 289 CO -0.04 0.22 0.17 0.00 -0.10 0.00 0.00 174.94 175.19 1a6q s PHE 291 N -1.15 2.91 0.35 0.00 0.08 0.78 -2.56 117.98 118.38 1a6q s PHE 291 Ca 0.20 -0.34 0.17 0.00 0.12 0.00 0.00 56.93 57.08 1a6q s PHE 291 Cb -0.12 -2.16 1.19 0.00 -0.57 0.00 0.00 43.02 41.35 1a6q s PHE 291 CO 0.10 -0.18 1.61 -1.35 -0.10 0.00 0.00 175.22 175.31 1a6q h PRO 292 N 0.84 0.13 -1.00 0.24 0.11 -1.81 0.11 132.00 130.63 1a6q h PRO 292 Ca -0.43 -0.01 -0.52 0.00 0.11 0.00 0.00 66.00 65.15 1a6q h PRO 292 Cb 1.27 -0.03 -0.31 0.00 0.11 0.00 0.00 31.00 32.04 1a6q h PRO 292 CO 0.51 0.09 0.66 0.09 -0.21 0.00 0.00 178.00 179.14 1a6q n ASN 293 N -5.19 3.88 -4.75 -2.05 4.13 -1.25 -4.96 115.26 105.07 1a6q n ASN 293 Ca 0.34 -3.61 -0.34 0.00 1.68 0.00 0.00 54.58 52.65 1a6q n ASN 293 Cb 1.11 -0.84 0.06 0.00 -1.54 0.00 0.00 39.78 38.57 1a6q n ASN 293 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1a6q s ALA 294 N -3.30 2.36 0.61 5.41 0.00 0.02 -4.58 121.76 122.29 1a6q s ALA 294 Ca 0.57 0.73 -0.19 0.00 0.00 0.00 0.00 51.96 53.07 1a6q s ALA 294 Cb 0.48 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 1a6q s ALA 294 CO 0.11 -1.45 1.23 -0.35 0.00 0.00 0.00 175.76 175.30 1a6q n PRO 295 N -2.37 1.22 -3.98 0.00 -0.04 -1.26 -5.00 135.00 123.57 1a6q n PRO 295 Ca 0.12 0.47 -0.21 0.00 -0.04 0.00 0.00 63.50 63.83 1a6q n PRO 295 Cb 0.51 -2.46 -0.03 0.00 -0.04 0.00 0.00 33.50 31.48 1a6q n PRO 295 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1a6q s LYS 296 N -3.09 3.06 0.21 0.54 -0.14 -1.26 -4.73 119.74 114.33 1a6q s LYS 296 Ca 0.78 -1.00 -0.31 0.00 -1.36 0.00 0.00 55.97 54.08 1a6q s LYS 296 Cb -0.40 -2.66 -0.10 0.00 -1.68 0.00 0.00 37.83 32.98 1a6q s LYS 296 CO 0.44 0.34 1.50 0.08 -0.76 0.00 0.00 175.35 176.95 1a6q s VAL 297 N -2.12 2.62 -0.17 3.17 1.01 -1.24 -4.20 120.40 119.47 1a6q s VAL 297 Ca 0.35 0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 1a6q s VAL 297 Cb -0.08 -3.31 -0.00 0.00 0.00 0.00 0.00 36.38 32.98 1a6q s VAL 297 CO 0.27 0.06 -0.12 -0.55 0.00 0.00 0.00 175.10 174.76 1a6q s SER 298 N 0.70 3.89 0.27 3.32 0.15 0.14 -4.98 113.70 117.18 1a6q s SER 298 Ca 0.64 -0.43 -0.01 0.00 0.70 0.00 0.00 55.95 56.86 1a6q s SER 298 Cb -0.43 -1.62 0.52 0.00 -1.71 0.00 0.00 66.02 62.78 1a6q s SER 298 CO 0.38 0.07 1.80 1.55 1.20 0.00 0.00 173.24 178.24 1a6q h PRO 299 N 7.44 0.76 -0.25 5.44 0.13 -1.94 0.12 132.00 143.70 1a6q h PRO 299 Ca -0.35 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 64.61 1a6q h PRO 299 Cb 1.18 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 1a6q h PRO 299 CO 0.58 0.50 -0.39 1.49 -0.23 0.00 0.00 178.00 179.96 1a6q h GLU 300 N 0.78 0.57 -0.46 0.86 4.81 -1.94 -1.47 114.58 117.73 1a6q h GLU 300 Ca 0.46 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1a6q h GLU 300 Cb 0.55 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 1a6q h GLU 300 CO -0.30 0.86 0.01 0.00 -0.73 0.00 0.00 179.01 178.85 1a6q h ALA 301 N 1.10 0.62 -0.82 2.92 0.00 -1.49 0.11 119.26 121.71 1a6q h ALA 301 Ca 0.04 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1a6q h ALA 301 Cb 0.89 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1a6q h ALA 301 CO 0.08 0.41 0.36 0.28 0.00 0.00 0.00 179.25 180.38 1a6q h VAL 302 N 0.66 1.26 0.27 0.00 2.07 -0.90 -1.55 116.25 118.06 1a6q h VAL 302 Ca 0.13 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1a6q h VAL 302 Cb 0.49 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1a6q h VAL 302 CO 0.02 0.32 -0.13 0.11 0.02 0.00 0.00 177.57 177.91 1a6q h LYS 303 N 1.17 -0.36 -0.60 1.57 1.57 -0.79 -1.20 116.57 117.94 1a6q h LYS 303 Ca 0.28 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 1a6q h LYS 303 Cb 0.16 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1a6q h LYS 303 CO -0.03 -0.17 0.40 0.87 -0.57 0.00 0.00 179.45 179.95 1a6q h LYS 304 N -0.46 0.40 -0.26 3.15 1.57 -0.88 0.49 116.57 120.58 1a6q h LYS 304 Ca -0.04 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1a6q h LYS 304 Cb 0.35 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1a6q h LYS 304 CO 0.06 0.26 -0.14 1.49 -0.57 0.00 0.00 179.45 180.56 1a6q h GLU 305 N 0.41 0.55 -0.73 3.15 4.57 -0.79 -0.67 114.58 121.07 1a6q h GLU 305 Ca 0.28 -0.24 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1a6q h GLU 305 Cb 0.54 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.08 1a6q h GLU 305 CO -0.08 0.81 0.29 0.00 -1.18 0.00 0.00 179.01 178.85 1a6q h ALA 306 N 0.73 0.95 -0.49 2.92 0.00 -0.25 -0.13 119.26 122.99 1a6q h ALA 306 Ca 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1a6q h ALA 306 Cb 0.65 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1a6q h ALA 306 CO 0.04 0.58 0.21 0.93 0.00 0.00 0.00 179.25 181.01 1a6q h GLU 307 N 1.06 0.73 -0.54 0.00 5.08 -0.83 -1.35 114.58 118.72 1a6q h GLU 307 Ca 0.24 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1a6q h GLU 307 Cb 0.22 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1a6q h GLU 307 CO -0.02 0.64 0.02 1.25 -1.00 0.00 0.00 179.01 179.91 1a6q h LEU 308 N 0.65 0.92 -0.69 1.33 5.85 -0.76 -0.24 115.31 122.37 1a6q h LEU 308 Ca 0.17 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 1a6q h LEU 308 Cb 0.18 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1a6q h LEU 308 CO -0.02 0.99 0.22 0.44 -0.34 0.00 0.00 178.44 179.73 1a6q h ASP 309 N 0.82 1.00 -0.46 1.25 3.32 -0.87 0.65 116.42 122.11 1a6q h ASP 309 Ca 0.16 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 1a6q h ASP 309 Cb 0.50 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1a6q h ASP 309 CO 0.02 0.94 -0.03 0.50 -1.72 0.00 0.00 179.24 178.95 1a6q h LYS 310 N 1.00 0.84 -0.59 3.56 1.63 -1.05 -1.01 116.57 120.96 1a6q h LYS 310 Ca 0.22 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1a6q h LYS 310 Cb 0.29 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.82 1a6q h LYS 310 CO -0.01 0.91 0.32 -0.92 -3.45 0.00 0.00 179.45 176.30 1a6q h TYR 311 N 0.69 0.81 -0.46 1.91 5.03 -0.80 -1.99 116.97 122.16 1a6q h TYR 311 Ca 0.13 -0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.34 1a6q h TYR 311 Cb 0.55 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 38.55 1a6q h TYR 311 CO 0.04 0.59 -0.02 -0.07 -1.32 0.00 0.00 178.16 177.38 1a6q h LEU 312 N 0.80 0.74 -0.97 2.82 3.38 -0.64 -1.90 115.31 119.55 1a6q h LEU 312 Ca 0.21 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1a6q h LEU 312 Cb 0.05 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1a6q h LEU 312 CO -0.03 0.83 -0.06 -0.33 0.09 0.00 0.00 178.44 178.93 1a6q h GLU 313 N 0.72 0.68 -0.30 1.13 5.08 -0.71 -2.15 114.58 119.04 1a6q h GLU 313 Ca 0.14 -0.19 -0.16 0.00 -1.00 0.00 0.00 59.36 58.14 1a6q h GLU 313 Cb 0.47 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1a6q h GLU 313 CO 0.02 0.74 -0.44 0.00 -1.00 0.00 0.00 179.01 178.34 1a6q h ARG 315 N 0.59 0.29 -0.50 0.00 2.47 -1.15 -1.07 114.38 115.01 1a6q h ARG 315 Ca 0.03 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.76 1a6q h ARG 315 Cb 1.04 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.26 1a6q h ARG 315 CO 0.10 0.19 0.30 0.28 0.56 0.00 0.00 179.97 181.40 1a6q h VAL 316 N 0.30 1.04 -0.44 2.04 2.07 -1.27 0.16 116.25 120.16 1a6q h VAL 316 Ca 0.15 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1a6q h VAL 316 Cb 0.10 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 1a6q h VAL 316 CO -0.13 0.11 0.13 -0.33 0.02 0.00 0.00 177.57 177.36 1a6q h GLU 317 N 0.59 0.27 -0.31 1.57 5.08 -0.63 0.15 114.58 121.30 1a6q h GLU 317 Ca 0.20 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 1a6q h GLU 317 Cb 0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1a6q h GLU 317 CO -0.10 0.18 -0.14 0.93 -1.00 0.00 0.00 179.01 178.88 1a6q h GLU 318 N 0.28 0.65 -0.15 2.33 4.39 -0.66 -3.16 114.58 118.26 1a6q h GLU 318 Ca 0.21 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 1a6q h GLU 318 Cb 0.23 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1a6q h GLU 318 CO -0.24 0.86 -0.01 0.82 -1.16 0.00 0.00 179.01 179.28 1a6q h ILE 319 N 0.41 1.27 0.00 3.13 2.04 -0.35 -2.27 117.51 121.74 1a6q h ILE 319 Ca 0.07 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1a6q h ILE 319 Cb 0.66 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 1a6q h ILE 319 CO 0.04 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.46 1a6q n ILE 320 N -4.73 1.77 0.00 -0.67 3.06 0.50 -4.85 119.36 114.44 1a6q n ILE 320 Ca -0.05 0.56 0.00 0.00 -2.50 0.00 0.00 62.75 60.75 1a6q n ILE 320 Cb 0.23 -1.56 0.00 0.00 0.54 0.00 0.00 39.64 38.85 1a6q n ILE 320 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1a6q n LYS 321 N -1.67 0.00 0.00 9.51 4.76 -0.86 -4.35 118.16 125.55 1a6q n LYS 321 Ca -0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1a6q n LYS 321 Cb 0.01 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.20 1a6q n LYS 321 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1a6q n GLY 326 N 0.00 0.00 2.38 0.72 0.00 -1.26 -4.60 105.19 102.43 1a6q n GLY 326 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1a6q n GLY 326 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1a6q n VAL 327 N -0.15-10.21 -2.27 1.61 0.31 -1.26 -4.99 118.33 101.36 1a6q n VAL 327 Ca 0.00 1.80 -0.38 0.00 -0.01 0.00 0.00 64.34 65.76 1a6q n VAL 327 Cb 0.00 -6.06 -0.01 0.00 -0.91 0.00 0.00 33.84 26.86 1a6q n VAL 327 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1a6q s PRO 328 N -0.99 3.88 0.85 5.55 0.04 -1.26 -5.03 135.00 138.04 1a6q s PRO 328 Ca -0.12 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 62.62 1a6q s PRO 328 Cb 0.01 -2.52 0.10 0.00 0.04 0.00 0.00 34.50 32.13 1a6q s PRO 328 CO 0.61 -0.46 1.10 0.16 0.04 0.00 0.00 177.00 178.46 1a6q s ASP 329 N -1.26 3.76 0.32 6.66 -4.77 -1.26 -4.74 116.67 115.38 1a6q s ASP 329 Ca 0.61 1.85 0.06 0.00 -3.30 0.00 0.00 52.55 51.76 1a6q s ASP 329 Cb -0.29 -2.46 0.71 0.00 -1.09 0.00 0.00 42.92 39.78 1a6q s ASP 329 CO 0.36 -2.51 1.84 0.25 0.70 0.00 0.00 175.17 175.81 1a6q h LEU 330 N -1.46 0.78 -1.06 2.11 5.85 -1.99 0.55 115.31 120.10 1a6q h LEU 330 Ca -0.45 0.06 0.13 0.00 0.84 0.00 0.00 57.88 58.45 1a6q h LEU 330 Cb 1.25 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 42.10 1a6q h LEU 330 CO 0.49 0.38 0.62 0.58 -0.34 0.00 0.00 178.44 180.17 1a6q h VAL 331 N 0.82 0.90 0.00 1.05 2.07 -1.99 0.82 116.25 119.91 1a6q h VAL 331 Ca 0.50 -0.32 -0.20 0.00 0.82 0.00 0.00 66.70 67.50 1a6q h VAL 331 Cb 0.68 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1a6q h VAL 331 CO -0.26 0.17 -0.97 0.45 0.02 0.00 0.00 177.57 176.98 1a6q h HIS 332 N 0.94 0.00 -0.34 1.57 3.86 -1.25 -2.59 115.15 117.33 1a6q h HIS 332 Ca 0.49 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.55 1a6q h HIS 332 Cb 0.54 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 1a6q h HIS 332 CO -0.00 0.92 -0.41 0.28 0.86 0.00 0.00 177.93 179.58 1a6q h VAL 333 N 0.00 1.28 -0.70 2.45 2.07 -0.55 -1.04 116.25 119.76 1a6q h VAL 333 Ca -0.03 -1.58 -0.06 0.00 0.82 0.00 0.00 66.70 65.85 1a6q h VAL 333 Cb 1.73 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 32.91 1a6q h VAL 333 CO 0.12 0.52 0.20 0.24 0.02 0.00 0.00 177.57 178.67 1a6q h MET 334 N 0.69 1.09 -0.24 1.57 2.86 -0.91 -0.45 114.93 119.54 1a6q h MET 334 Ca 0.05 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1a6q h MET 334 Cb 0.98 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 1a6q h MET 334 CO 0.09 0.94 0.15 -0.09 1.06 0.00 0.00 176.91 179.07 1a6q h ARG 335 N 1.05 0.32 0.90 1.72 2.43 -1.12 -0.34 114.38 119.34 1a6q h ARG 335 Ca 0.23 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1a6q h ARG 335 Cb 0.32 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1a6q h ARG 335 CO -0.00 0.23 -0.43 1.15 -1.51 0.00 0.00 179.97 179.40 1a6q h THR 336 N 0.31 0.03 -0.96 0.20 2.02 -0.91 -2.47 112.91 111.13 1a6q h THR 336 Ca 0.09 -0.09 0.30 0.00 0.77 0.00 0.00 66.41 67.48 1a6q h THR 336 Cb -0.02 0.04 -0.15 0.00 -1.74 0.00 0.00 68.15 66.28 1a6q h THR 336 CO -0.02 0.00 0.41 -0.07 0.37 0.00 0.00 175.52 176.21 1a6q h LEU 337 N -1.30 0.24 -0.81 2.58 3.38 -0.93 0.27 115.31 118.73 1a6q h LEU 337 Ca -0.12 0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1a6q h LEU 337 Cb 0.93 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1a6q h LEU 337 CO 0.20 -0.19 -0.25 0.00 0.09 0.00 0.00 178.44 178.29 1a6q h ALA 338 N 1.85 0.98 0.00 1.53 0.00 -0.85 -2.52 119.26 120.26 1a6q h ALA 338 Ca 0.67 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1a6q h ALA 338 Cb 1.50 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1a6q h ALA 338 CO -0.67 0.60 0.00 -1.13 0.00 0.00 0.00 179.25 178.05 1a6q n SER 339 N -4.11 0.74 0.08 0.00 3.41 0.91 -2.15 113.62 112.49 1a6q n SER 339 Ca -0.00 0.64 0.13 0.00 -0.26 0.00 0.00 58.87 59.38 1a6q n SER 339 Cb 0.42 -0.82 0.47 0.00 -0.26 0.00 0.00 64.21 64.03 1a6q n SER 339 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a6q n GLU 340 N -2.28 0.18 -3.84 4.33 1.02 -0.94 -4.94 120.64 114.17 1a6q n GLU 340 Ca 0.03 0.17 -0.38 0.00 -0.02 0.00 0.00 57.16 56.96 1a6q n GLU 340 Cb 0.30 -1.72 0.04 0.00 -0.02 0.00 0.00 31.44 30.03 1a6q n GLU 340 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1a6q n ASN 341 N -2.03 -4.87 -4.73 1.62 3.02 -0.91 -4.86 115.26 102.49 1a6q n ASN 341 Ca 0.06 -1.13 -0.42 0.00 -0.03 0.00 0.00 54.58 53.06 1a6q n ASN 341 Cb 0.39 -2.71 -0.03 0.00 -0.61 0.00 0.00 39.78 36.82 1a6q n ASN 341 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1a6q s ILE 342 N -3.49 2.52 0.59 2.41 1.01 -1.26 -5.01 121.20 117.97 1a6q s ILE 342 Ca 0.49 0.39 -0.11 0.00 0.00 0.00 0.00 60.65 61.42 1a6q s ILE 342 Cb -0.21 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 1a6q s ILE 342 CO 0.91 0.04 1.00 -2.16 0.00 0.00 0.00 174.94 174.72 1a6q s PRO 343 N 0.56 3.64 -1.10 2.79 0.04 -1.26 -4.34 135.00 135.32 1a6q s PRO 343 Ca 0.67 0.72 -0.01 0.00 0.04 0.00 0.00 61.00 62.42 1a6q s PRO 343 Cb -0.44 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1a6q s PRO 343 CO 0.36 -0.49 0.14 0.43 0.04 0.00 0.00 177.00 177.49 1a6q n SER 344 N -2.53 -4.30 -4.85 6.66 7.64 -1.26 -5.02 113.62 109.96 1a6q n SER 344 Ca 0.05 -0.08 -0.32 0.00 1.01 0.00 0.00 58.87 59.54 1a6q n SER 344 Cb 0.54 -3.37 -0.05 0.00 -1.01 0.00 0.00 64.21 60.32 1a6q n SER 344 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1a6q s LEU 345 N -4.10 3.89 0.06 -3.43 1.43 -1.26 -4.95 118.68 110.32 1a6q s LEU 345 Ca 0.07 1.41 -0.37 0.00 -1.03 0.00 0.00 54.13 54.22 1a6q s LEU 345 Cb -0.03 -4.27 -0.16 0.00 0.03 0.00 0.00 46.19 41.75 1a6q s LEU 345 CO 0.09 -0.36 1.41 -2.65 0.23 0.00 0.00 176.35 175.07 1a6q n PRO 346 N -0.87 1.27 -1.80 1.29 -0.02 -1.26 -4.75 135.00 128.86 1a6q n PRO 346 Ca 0.05 0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 1a6q n PRO 346 Cb 0.54 -2.12 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 1a6q n PRO 346 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1a6q s PRO 347 N 0.86 4.12 0.00 0.52 0.04 -1.26 0.14 135.00 139.42 1a6q s PRO 347 Ca 0.85 2.57 0.00 0.00 0.04 0.00 0.00 61.00 64.46 1a6q s PRO 347 Cb -0.93 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1a6q s PRO 347 CO 0.48 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.34 1a6q n GLY 348 N 1.42 1.51 0.20 0.56 0.00 -1.26 -3.35 105.19 104.26 1a6q n GLY 348 Ca 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1a6q n GLY 348 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1a6q h GLY 349 N 0.00 0.39 0.00 -0.02 0.00 -1.78 -3.48 103.07 98.17 1a6q h GLY 349 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1a6q h GLY 349 CO 0.00 0.37 0.00 1.18 0.00 0.00 0.00 176.54 178.09 1a6q n GLU 350 N -3.98 0.00 0.02 4.80 -0.58 0.12 -1.96 120.64 119.06 1a6q n GLU 350 Ca -0.02 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.74 1a6q n GLU 350 Cb 0.53 0.00 0.36 0.00 -0.57 0.00 0.00 31.44 31.77 1a6q n GLU 350 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1a6q h LEU 351 N 0.00 0.43 -1.43 -4.62 3.38 -1.93 -2.51 115.31 108.62 1a6q h LEU 351 Ca 0.00 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 57.97 1a6q h LEU 351 Cb 0.00 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1a6q h LEU 351 CO 0.00 0.44 0.43 0.00 0.09 0.00 0.00 178.44 179.41 1a6q h ALA 352 N 1.62 1.72 0.00 1.53 0.00 -1.90 0.94 119.26 123.17 1a6q h ALA 352 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1a6q h ALA 352 Cb 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1a6q h ALA 352 CO -0.00 0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1a6q n SER 353 N -4.47 0.00 -0.39 0.00 3.41 -0.83 -2.60 113.62 108.74 1a6q n SER 353 Ca 0.09 0.11 0.04 0.00 -0.26 0.00 0.00 58.87 58.85 1a6q n SER 353 Cb 0.19 -0.34 0.07 0.00 -0.26 0.00 0.00 64.21 63.88 1a6q n SER 353 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1a6q n LYS 354 N -1.34 1.51 -0.15 4.33 4.76 0.27 -4.72 118.16 122.83 1a6q n LYS 354 Ca 0.09 -1.44 0.00 0.00 -2.87 0.00 0.00 58.31 54.09 1a6q n LYS 354 Cb 0.18 -1.18 0.27 0.00 -1.84 0.00 0.00 35.03 32.46 1a6q n LYS 354 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1a6q h ARG 355 N 1.53 0.85 -0.02 1.97 2.43 -1.16 -2.35 114.38 117.63 1a6q h ARG 355 Ca 0.00 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.00 1a6q h ARG 355 Cb 0.50 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1a6q h ARG 355 CO 0.00 0.62 -0.41 -0.91 -1.51 0.00 0.00 179.97 177.76 1a6q h ASN 356 N 0.86 0.04 -0.07 -3.80 2.35 -1.84 0.23 115.58 113.36 1a6q h ASN 356 Ca 0.22 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1a6q h ASN 356 Cb 0.01 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.36 1a6q h ASN 356 CO -0.04 0.44 -0.07 0.58 -1.65 0.00 0.00 177.43 176.69 1a6q h VAL 357 N 0.03 1.37 0.01 2.81 2.07 -1.82 -1.51 116.25 119.21 1a6q h VAL 357 Ca 0.00 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 1a6q h VAL 357 Cb 0.73 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1a6q h VAL 357 CO 0.05 0.34 -0.00 0.40 0.02 0.00 0.00 177.57 178.38 1a6q h ILE 358 N -0.27 1.02 -0.37 4.57 2.04 -1.23 -2.50 117.51 120.77 1a6q h ILE 358 Ca 0.01 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 1a6q h ILE 358 Cb 0.58 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1a6q h ILE 358 CO 0.02 0.02 0.05 -0.08 0.00 0.00 0.00 178.15 178.16 1a6q h GLU 359 N -0.04 0.56 -0.60 2.37 4.81 -0.59 -0.98 114.58 120.11 1a6q h GLU 359 Ca -0.00 -0.11 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 1a6q h GLU 359 Cb 0.04 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1a6q h GLU 359 CO 0.00 0.54 -0.01 0.00 -0.73 0.00 0.00 179.01 178.82 1a6q h ALA 360 N 1.52 0.80 -0.08 2.92 0.00 -0.99 -0.25 119.26 123.18 1a6q h ALA 360 Ca 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1a6q h ALA 360 Cb 0.27 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1a6q h ALA 360 CO 0.00 0.65 -0.02 0.28 0.00 0.00 0.00 179.25 180.16 1a6q h VAL 361 N 0.95 1.29 -0.68 0.00 2.07 -1.19 -2.55 116.25 116.16 1a6q h VAL 361 Ca 0.17 -0.93 0.11 0.00 0.82 0.00 0.00 66.70 66.86 1a6q h VAL 361 Cb 0.57 1.75 -0.08 0.00 -1.52 0.00 0.00 31.29 32.01 1a6q h VAL 361 CO 0.03 0.26 0.28 0.22 0.02 0.00 0.00 177.57 178.39 1a6q h TYR 362 N -0.17 0.49 -0.84 1.57 5.03 -1.07 -1.60 116.97 120.38 1a6q h TYR 362 Ca 0.02 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.35 1a6q h TYR 362 Cb 0.42 -0.12 -0.04 0.00 1.55 0.00 0.00 36.73 38.54 1a6q h TYR 362 CO 0.05 0.13 0.48 -0.91 -1.32 0.00 0.00 178.16 176.60 1a6q h ASN 363 N 0.47 1.02 -0.49 -2.11 2.35 -0.94 0.19 115.58 116.08 1a6q h ASN 363 Ca 0.35 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.95 1a6q h ASN 363 Cb 0.44 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1a6q h ASN 363 CO -0.32 0.80 0.01 0.03 -1.65 0.00 0.00 177.43 176.30 1a6q h ARG 364 N 1.16 0.86 -0.00 0.81 3.08 -0.89 -2.16 114.38 117.24 1a6q h ARG 364 Ca 0.30 -0.27 -0.17 0.00 0.07 0.00 0.00 59.98 59.91 1a6q h ARG 364 Cb -0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1a6q h ARG 364 CO -0.05 0.89 -0.80 -0.07 -1.07 0.00 0.00 179.97 178.87 1a6q h LEU 365 N 0.72 0.09 -5.90 3.04 3.38 -0.99 -3.37 115.31 112.28 1a6q h LEU 365 Ca 0.14 -0.07 -0.53 0.00 0.09 0.00 0.00 57.88 57.51 1a6q h LEU 365 Cb 0.50 -0.03 -0.40 0.00 0.09 0.00 0.00 40.66 40.82 1a6q h LEU 365 CO 0.02 0.85 -1.03 -3.20 0.09 0.00 0.00 178.44 175.18 1a6q n ASN 366 N -3.64 1.54 0.24 -0.43 5.15 0.65 -4.97 115.26 113.80 1a6q n ASN 366 Ca -0.02 -3.08 0.16 0.00 -0.60 0.00 0.00 54.58 51.04 1a6q n ASN 366 Cb 0.76 -0.62 0.86 0.00 -0.53 0.00 0.00 39.78 40.26 1a6q n ASN 366 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1a6q h PRO 367 N 3.35 0.00 -0.03 1.20 0.13 -1.56 -3.43 132.00 131.66 1a6q h PRO 367 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1a6q h PRO 367 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1a6q h PRO 367 CO 0.57 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.00