#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gkf s ASN 2 N 0.00 3.31 -0.27 6.43 2.20 -0.45 -3.06 114.94 123.09 1gkf s ASN 2 Ca 0.00 -1.18 -0.25 0.00 -0.94 0.00 0.00 52.86 50.49 1gkf s ASN 2 Cb 0.00 -0.27 0.08 0.00 -2.00 0.00 0.00 41.25 39.06 1gkf s ASN 2 CO 0.00 -0.24 0.78 -0.32 -2.94 0.00 0.00 177.10 174.38 1gkf s MET 3 N -3.65 0.77 -0.05 3.55 1.75 -0.50 -0.48 119.30 120.70 1gkf s MET 3 Ca 0.31 0.93 0.00 0.00 -1.25 0.00 0.00 55.69 55.69 1gkf s MET 3 Cb 0.02 0.37 0.02 0.00 2.84 0.00 0.00 34.83 38.09 1gkf s MET 3 CO 0.14 -0.09 -0.03 1.67 -0.65 0.00 0.00 175.02 176.06 1gkf s TRP 4 N 0.41 0.69 -0.20 4.11 -2.14 -0.17 -1.18 118.94 120.45 1gkf s TRP 4 Ca 0.00 -0.18 -0.01 0.00 2.66 0.00 0.00 56.10 58.57 1gkf s TRP 4 Cb -0.05 -0.67 0.01 0.00 -3.10 0.00 0.00 33.47 29.66 1gkf s TRP 4 CO -0.01 -0.22 -0.12 0.08 -2.66 0.00 0.00 176.95 174.02 1gkf s VAL 5 N 1.15 2.71 -0.26 -0.66 1.01 0.53 -0.94 120.40 123.94 1gkf s VAL 5 Ca -0.07 -0.74 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 1gkf s VAL 5 Cb -0.14 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 1gkf s VAL 5 CO -0.01 0.46 0.05 -0.63 0.00 0.00 0.00 175.10 174.98 1gkf s ILE 6 N 1.38 4.04 0.48 2.22 1.01 0.11 -0.67 121.20 129.77 1gkf s ILE 6 Ca 0.05 -0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 1gkf s ILE 6 Cb -0.14 -2.94 0.10 0.00 0.01 0.00 0.00 42.46 39.49 1gkf s ILE 6 CO -0.08 0.27 0.66 0.61 0.00 0.00 0.00 174.94 176.40 1gkf n GLY 7 N 4.89 0.54 0.36 6.18 0.00 0.23 -0.92 105.19 116.46 1gkf n GLY 7 Ca -0.16 -1.98 0.10 0.00 0.00 0.00 0.00 46.02 43.98 1gkf n GLY 7 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1gkf h LYS 8 N 0.00 0.86 0.00 1.61 3.64 -1.16 0.31 116.57 121.83 1gkf h LYS 8 Ca -0.22 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1gkf h LYS 8 Cb 0.79 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1gkf h LYS 8 CO 0.23 0.57 0.00 -1.13 -2.27 0.00 0.00 179.45 176.84 1gkf n SER 9 N -4.68 0.00 -0.00 4.20 3.41 -1.26 -3.51 113.62 111.78 1gkf n SER 9 Ca 0.21 0.48 0.02 0.00 -0.26 0.00 0.00 58.87 59.32 1gkf n SER 9 Cb 0.46 -0.49 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 1gkf n SER 9 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1gkf n LYS 10 N -1.49 5.79 -3.22 4.33 4.76 -0.04 -4.93 118.16 123.36 1gkf n LYS 10 Ca 0.05 -0.02 -0.37 0.00 -2.87 0.00 0.00 58.31 55.10 1gkf n LYS 10 Cb 0.24 -0.66 -0.06 0.00 -1.84 0.00 0.00 35.03 32.71 1gkf n LYS 10 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gkf s ALA 11 N -1.27 3.53 -0.18 7.82 0.00 -0.37 -1.41 121.76 129.88 1gkf s ALA 11 Ca 0.01 0.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 1gkf s ALA 11 Cb 0.02 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 1gkf s ALA 11 CO 0.13 0.38 -0.02 -1.14 0.00 0.00 0.00 175.76 175.11 1gkf s GLN 12 N -1.52 3.63 -1.55 0.00 2.00 0.32 -4.60 119.66 117.93 1gkf s GLN 12 Ca 0.35 -0.53 0.00 0.00 -2.00 0.00 0.00 55.36 53.18 1gkf s GLN 12 Cb -0.18 -2.98 0.00 0.00 0.80 0.00 0.00 33.01 30.65 1gkf s GLN 12 CO 0.20 0.12 0.00 -0.25 -0.50 0.00 0.00 175.29 174.86 1gkf n ASP 13 N 3.91 -4.87 -3.60 6.67 8.00 -1.26 -4.31 116.55 121.08 1gkf n ASP 13 Ca -0.17 0.20 -0.07 0.00 0.71 0.00 0.00 54.79 55.46 1gkf n ASP 13 Cb 0.52 -3.89 -0.02 0.00 -0.02 0.00 0.00 41.12 37.71 1gkf n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gkf s ALA 14 N -2.70 -1.71 -0.11 2.24 0.00 -1.26 -0.82 121.76 117.40 1gkf s ALA 14 Ca 0.00 0.58 0.16 0.00 0.00 0.00 0.00 51.96 52.70 1gkf s ALA 14 Cb 0.00 0.57 -0.18 0.00 0.00 0.00 0.00 23.12 23.50 1gkf s ALA 14 CO 0.00 -0.84 0.67 1.63 0.00 0.00 0.00 175.76 177.22 1gkf n LYS 15 N -0.35 0.63 -3.52 0.00 5.02 0.27 -4.66 118.16 115.55 1gkf n LYS 15 Ca -0.08 0.19 -0.16 0.00 -2.02 0.00 0.00 58.31 56.23 1gkf n LYS 15 Cb 0.62 -1.75 -0.06 0.00 -0.02 0.00 0.00 35.03 33.82 1gkf n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gkf s ALA 16 N -2.82 -1.78 -0.04 7.82 0.00 -1.10 -1.64 121.76 122.19 1gkf s ALA 16 Ca -0.04 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1gkf s ALA 16 Cb 0.08 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.18 1gkf s ALA 16 CO 0.82 -0.39 -0.00 0.42 0.00 0.00 0.00 175.76 176.61 1gkf s ILE 17 N -1.35 0.23 -0.14 0.00 1.01 -0.10 -0.71 121.20 120.14 1gkf s ILE 17 Ca -0.09 0.09 0.02 0.00 0.00 0.00 0.00 60.65 60.67 1gkf s ILE 17 Cb -0.00 -0.34 0.01 0.00 0.01 0.00 0.00 42.46 42.13 1gkf s ILE 17 CO 0.07 0.17 -0.20 -0.32 0.00 0.00 0.00 174.94 174.67 1gkf s MET 18 N 1.22 3.09 -0.16 2.79 1.75 0.04 0.06 119.30 128.09 1gkf s MET 18 Ca -0.07 -0.82 -0.01 0.00 -1.25 0.00 0.00 55.69 53.55 1gkf s MET 18 Cb -0.13 -2.50 0.04 0.00 2.84 0.00 0.00 34.83 35.08 1gkf s MET 18 CO -0.02 0.01 -0.04 0.08 -0.65 0.00 0.00 175.02 174.39 1gkf s VAL 19 N 0.79 1.00 -0.04 10.11 1.01 -0.11 -0.94 120.40 132.21 1gkf s VAL 19 Ca -0.07 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.43 1gkf s VAL 19 Cb -0.16 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1gkf s VAL 19 CO -0.01 0.12 -0.21 0.21 0.00 0.00 0.00 175.10 175.22 1gkf s ASN 20 N 1.68 3.44 -0.44 3.32 3.04 -0.56 -1.00 114.94 124.42 1gkf s ASN 20 Ca 0.01 -0.37 0.07 0.00 0.04 0.00 0.00 52.86 52.61 1gkf s ASN 20 Cb -0.15 -0.63 0.22 0.00 -1.54 0.00 0.00 41.25 39.16 1gkf s ASN 20 CO -0.08 0.32 0.50 0.61 -3.04 0.00 0.00 177.10 175.41 1gkf n GLY 21 N 2.49 2.95 3.73 1.21 0.00 0.37 -2.23 105.19 113.71 1gkf n GLY 21 Ca -0.17 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 1gkf n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gkf s PRO 22 N -1.02 4.24 -0.33 1.61 0.04 -1.25 -1.35 135.00 136.95 1gkf s PRO 22 Ca 0.35 2.32 -0.02 0.00 0.04 0.00 0.00 61.00 63.68 1gkf s PRO 22 Cb 0.12 -3.15 0.06 0.00 0.04 0.00 0.00 34.50 31.58 1gkf s PRO 22 CO -0.13 -0.53 0.05 -0.65 0.04 0.00 0.00 177.00 175.78 1gkf s GLN 23 N 0.65 2.34 0.00 4.56 -0.21 -1.26 -0.19 119.66 125.55 1gkf s GLN 23 Ca 0.66 -1.38 0.02 0.00 0.02 0.00 0.00 55.36 54.68 1gkf s GLN 23 Cb -0.42 -3.28 0.02 0.00 1.00 0.00 0.00 33.01 30.33 1gkf s GLN 23 CO 0.35 -0.72 0.64 1.19 -2.12 0.00 0.00 175.29 174.63 1gkf n PHE 24 N 4.62 0.01 -0.18 0.91 3.72 -1.26 -4.53 117.46 120.75 1gkf n PHE 24 Ca -0.10 -0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1gkf n PHE 24 Cb 0.43 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 1gkf n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gkf n GLY 25 N 0.05 -3.33 3.09 1.37 0.00 -1.26 -4.93 105.19 100.18 1gkf n GLY 25 Ca 0.01 -1.87 -0.27 0.00 0.00 0.00 0.00 46.02 43.90 1gkf n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gkf s TRP 26 N -0.89 1.85 0.06 1.61 0.51 -1.26 -4.64 118.94 116.18 1gkf s TRP 26 Ca 0.00 -0.73 0.00 0.00 -2.12 0.00 0.00 56.10 53.26 1gkf s TRP 26 Cb 0.00 -1.30 -0.04 0.00 -0.81 0.00 0.00 33.47 31.32 1gkf s TRP 26 CO 0.00 -0.34 -0.05 0.71 -0.51 0.00 0.00 176.95 176.77 1gkf s TYR 27 N 0.58 0.63 -0.10 -1.98 2.02 -1.26 -1.00 117.35 116.23 1gkf s TYR 27 Ca -0.16 -0.88 0.01 0.00 -0.37 0.00 0.00 57.07 55.67 1gkf s TYR 27 Cb -0.16 -0.41 0.02 0.00 -0.40 0.00 0.00 41.96 41.01 1gkf s TYR 27 CO 0.05 -0.24 -0.10 0.00 -1.57 0.00 0.00 175.55 173.68 1gkf s ALA 28 N -3.21 1.39 1.11 3.71 0.00 0.19 -3.57 121.76 121.38 1gkf s ALA 28 Ca 0.04 -0.56 -0.14 0.00 0.00 0.00 0.00 51.96 51.30 1gkf s ALA 28 Cb 0.03 -0.80 0.25 0.00 0.00 0.00 0.00 23.12 22.59 1gkf s ALA 28 CO -0.06 -0.21 1.06 -1.25 0.00 0.00 0.00 175.76 175.31 1gkf s PRO 29 N 1.27 -0.48 0.45 0.00 0.04 -1.26 -4.33 135.00 130.69 1gkf s PRO 29 Ca -0.03 0.53 -0.23 0.00 0.04 0.00 0.00 61.00 61.31 1gkf s PRO 29 Cb -0.14 -1.63 -0.10 0.00 0.04 0.00 0.00 34.50 32.67 1gkf s PRO 29 CO -0.04 -3.35 1.01 0.00 0.04 0.00 0.00 177.00 174.66 1gkf n ALA 30 N -4.61 0.23 -0.36 8.56 0.00 -1.23 -4.91 120.51 118.19 1gkf n ALA 30 Ca 0.05 0.20 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 1gkf n ALA 30 Cb 0.57 -2.09 0.10 0.00 0.00 0.00 0.00 19.45 18.03 1gkf n ALA 30 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1gkf h TYR 31 N 1.41 1.25 -1.89 0.00 3.20 -1.81 -3.44 116.97 115.70 1gkf h TYR 31 Ca -0.45 -0.00 -0.51 0.00 3.14 0.00 0.00 58.73 60.90 1gkf h TYR 31 Cb 1.34 -0.41 -0.05 0.00 1.54 0.00 0.00 36.73 39.14 1gkf h TYR 31 CO 0.43 0.83 -0.49 0.95 -1.64 0.00 0.00 178.16 178.24 1gkf s THR 32 N -5.97 3.40 -0.10 1.81 -4.23 -1.26 -2.30 115.64 106.99 1gkf s THR 32 Ca -0.13 -1.50 0.01 0.00 -1.18 0.00 0.00 61.69 58.89 1gkf s THR 32 Cb 0.17 -3.12 0.02 0.00 1.34 0.00 0.00 72.50 70.92 1gkf s THR 32 CO 0.82 -0.19 -0.10 -0.47 -0.54 0.00 0.00 174.62 174.14 1gkf s TYR 33 N -2.34 1.55 0.21 3.99 5.04 -0.08 -4.87 117.35 120.86 1gkf s TYR 33 Ca 0.39 -0.73 -0.30 0.00 -2.44 0.00 0.00 57.07 53.99 1gkf s TYR 33 Cb -0.05 -1.22 -0.08 0.00 0.35 0.00 0.00 41.96 40.96 1gkf s TYR 33 CO 0.25 -0.45 1.04 0.20 -1.34 0.00 0.00 175.55 175.24 1gkf s GLY 34 N 1.34 3.00 -0.28 8.97 0.00 -1.26 -1.33 107.32 117.76 1gkf s GLY 34 Ca -0.01 0.75 -0.25 0.00 0.00 0.00 0.00 44.72 45.21 1gkf s GLY 34 CO -0.05 1.46 0.85 -1.50 0.00 0.00 0.00 173.10 173.87 1gkf s ILE 35 N -0.71 0.00 -0.03 0.90 1.10 -0.59 -4.98 121.20 116.88 1gkf s ILE 35 Ca 0.45 0.00 0.07 0.00 -0.51 0.00 0.00 60.65 60.66 1gkf s ILE 35 Cb -0.28 -1.00 -0.01 0.00 0.15 0.00 0.00 42.46 41.31 1gkf s ILE 35 CO 0.35 0.00 -0.24 -0.83 -2.11 0.00 0.00 174.94 172.11 1gkf s GLY 36 N 0.33 1.19 -0.08 1.50 0.00 -1.26 -2.15 107.32 106.85 1gkf s GLY 36 Ca 0.01 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.75 1gkf s GLY 36 CO -0.02 -0.73 -0.13 1.08 0.00 0.00 0.00 173.10 173.30 1gkf s LEU 37 N -0.36 1.65 -0.25 0.66 1.43 -0.64 -4.99 118.68 116.19 1gkf s LEU 37 Ca 0.03 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1gkf s LEU 37 Cb -0.11 -0.90 0.09 0.00 0.03 0.00 0.00 46.19 45.30 1gkf s LEU 37 CO 0.01 0.03 0.11 -1.00 0.23 0.00 0.00 176.35 175.73 1gkf s HIS 38 N 0.76 0.29 0.00 0.29 3.76 -1.26 -1.06 115.29 118.07 1gkf s HIS 38 Ca -0.13 -0.68 0.00 0.00 -0.15 0.00 0.00 55.06 54.10 1gkf s HIS 38 Cb -0.16 -0.83 0.00 0.00 1.11 0.00 0.00 32.58 32.70 1gkf s HIS 38 CO 0.03 -0.71 0.00 0.41 -0.85 0.00 0.00 174.74 173.61 1gkf n GLY 39 N 5.26 3.16 2.88 -2.22 0.00 0.33 -4.98 105.19 109.61 1gkf n GLY 39 Ca -0.06 -1.81 -0.21 0.00 0.00 0.00 0.00 46.02 43.94 1gkf n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gkf n ALA 40 N -1.78 -0.89 -0.11 4.61 0.00 -1.26 -1.01 120.51 120.08 1gkf n ALA 40 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1gkf n ALA 40 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 19.45 16.51 1gkf n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gkf n GLY 41 N -1.24 0.89 3.87 0.00 0.00 -1.26 -5.07 105.19 102.38 1gkf n GLY 41 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1gkf n GLY 41 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gkf s TYR 42 N -2.44 3.45 -0.41 1.61 2.02 -0.18 -4.83 117.35 116.57 1gkf s TYR 42 Ca 0.00 0.26 0.06 0.00 -0.37 0.00 0.00 57.07 57.03 1gkf s TYR 42 Cb 0.00 -1.77 0.17 0.00 -0.40 0.00 0.00 41.96 39.97 1gkf s TYR 42 CO 0.00 0.60 0.54 0.34 -1.57 0.00 0.00 175.55 175.46 1gkf s ASP 43 N -2.13 -0.46 0.08 2.29 2.15 -1.22 -0.51 116.67 116.87 1gkf s ASP 43 Ca 0.29 -1.27 0.01 0.00 0.43 0.00 0.00 52.55 52.01 1gkf s ASP 43 Cb -0.13 1.37 -0.04 0.00 -0.30 0.00 0.00 42.92 43.82 1gkf s ASP 43 CO 0.21 -0.19 -0.06 0.68 -0.17 0.00 0.00 175.17 175.65 1gkf s VAL 44 N 1.51 0.58 -0.05 1.11 -7.23 -0.23 -4.26 120.40 111.82 1gkf s VAL 44 Ca 0.19 -1.83 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1gkf s VAL 44 Cb -0.07 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.34 1gkf s VAL 44 CO -0.06 -0.86 0.27 0.28 -0.31 0.00 0.00 175.10 174.43 1gkf s THR 45 N -3.48 0.04 -4.72 5.32 -1.32 -0.76 -1.62 115.64 109.09 1gkf s THR 45 Ca 0.09 -0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.27 1gkf s THR 45 Cb 0.04 -0.49 0.00 0.00 -1.51 0.00 0.00 72.50 70.55 1gkf s THR 45 CO -0.05 -0.16 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 1gkf n GLY 46 N 2.06 -0.50 3.16 6.08 0.00 -0.91 -1.56 105.19 113.50 1gkf n GLY 46 Ca -0.18 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 1gkf n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkf s ASN 47 N -4.00 0.12 -0.15 1.61 2.20 -0.42 -1.55 114.94 112.76 1gkf s ASN 47 Ca 0.00 -0.52 -0.19 0.00 -0.94 0.00 0.00 52.86 51.22 1gkf s ASN 47 Cb 0.00 0.28 0.05 0.00 -2.00 0.00 0.00 41.25 39.57 1gkf s ASN 47 CO 0.00 -0.58 0.50 0.28 -2.94 0.00 0.00 177.10 174.35 1gkf s THR 48 N -2.94 0.01 0.31 0.54 -1.32 -0.44 -2.60 115.64 109.19 1gkf s THR 48 Ca -0.02 -0.07 -0.29 0.00 -1.21 0.00 0.00 61.69 60.10 1gkf s THR 48 Cb 0.01 -0.72 -0.12 0.00 -1.51 0.00 0.00 72.50 70.16 1gkf s THR 48 CO -0.06 -0.04 1.54 -2.65 -2.21 0.00 0.00 174.62 171.20 1gkf n PRO 49 N 2.38 2.63 -2.18 7.08 -0.02 -1.26 -0.90 135.00 142.73 1gkf n PRO 49 Ca -0.15 0.93 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1gkf n PRO 49 Cb 0.56 -2.68 -0.02 0.00 -0.02 0.00 0.00 33.50 31.34 1gkf n PRO 49 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1gkf n PHE 50 N 1.58 -1.12 -3.95 6.00 3.72 -0.97 -1.77 117.46 120.96 1gkf n PHE 50 Ca 0.07 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.16 1gkf n PHE 50 Cb 0.37 -2.81 0.02 0.00 -0.94 0.00 0.00 39.48 36.11 1gkf n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1gkf n ALA 51 N -1.53 -1.38 -1.07 4.37 0.00 -1.10 -4.93 120.51 114.87 1gkf n ALA 51 Ca -0.15 0.11 -0.34 0.00 0.00 0.00 0.00 53.44 53.07 1gkf n ALA 51 Cb 0.57 -3.99 0.13 0.00 0.00 0.00 0.00 19.45 16.16 1gkf n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1gkf n TYR 52 N -4.59 0.94 -0.36 0.00 4.01 -0.73 -4.87 117.16 111.56 1gkf n TYR 52 Ca 0.00 0.39 0.05 0.00 -0.16 0.00 0.00 57.90 58.19 1gkf n TYR 52 Cb 0.54 -2.07 0.22 0.00 -0.31 0.00 0.00 39.34 37.72 1gkf n TYR 52 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1gkf h PRO 53 N -0.96 1.03 -5.70 -0.72 0.11 -1.93 -3.39 132.00 120.43 1gkf h PRO 53 Ca -0.46 -0.06 -0.58 0.00 0.11 0.00 0.00 66.00 65.01 1gkf h PRO 53 Cb 1.30 -0.23 -0.08 0.00 0.11 0.00 0.00 31.00 32.10 1gkf h PRO 53 CO 0.45 0.68 -0.20 0.20 -0.21 0.00 0.00 178.00 178.92 1gkf s GLY 54 N -3.43 2.35 -0.21 -0.55 0.00 -1.26 -4.88 107.32 99.35 1gkf s GLY 54 Ca -0.12 -0.27 -0.29 0.00 0.00 0.00 0.00 44.72 44.04 1gkf s GLY 54 CO 0.81 0.60 1.27 1.08 0.00 0.00 0.00 173.10 176.85 1gkf s LEU 55 N 0.36 4.08 0.27 0.66 1.02 -1.26 -4.89 118.68 118.92 1gkf s LEU 55 Ca 0.23 1.53 0.12 0.00 0.02 0.00 0.00 54.13 56.04 1gkf s LEU 55 Cb -0.15 -3.54 0.28 0.00 0.02 0.00 0.00 46.19 42.81 1gkf s LEU 55 CO 0.09 -0.86 1.55 0.58 0.02 0.00 0.00 176.35 177.73 1gkf h VAL 56 N 5.64 1.28 -3.69 -1.59 2.07 -1.90 -3.42 116.25 114.65 1gkf h VAL 56 Ca -0.26 -2.26 -0.63 0.00 0.82 0.00 0.00 66.70 64.37 1gkf h VAL 56 Cb 1.10 2.28 -0.38 0.00 -1.52 0.00 0.00 31.29 32.77 1gkf h VAL 56 CO 0.99 0.61 -0.79 -0.36 0.02 0.00 0.00 177.57 178.04 1gkf s PHE 57 N -3.33 2.64 -1.58 1.57 0.08 -1.07 -3.92 117.98 112.36 1gkf s PHE 57 Ca 0.00 -1.91 0.00 0.00 0.12 0.00 0.00 56.93 55.15 1gkf s PHE 57 Cb 0.11 -1.68 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 1gkf s PHE 57 CO 0.75 -0.80 0.00 0.41 -0.10 0.00 0.00 175.22 175.48 1gkf n GLY 58 N 4.61 -1.41 3.48 4.36 0.00 -1.15 -1.30 105.19 113.78 1gkf n GLY 58 Ca -0.13 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1gkf n GLY 58 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1gkf s HIS 59 N -2.69 0.15 -0.10 1.61 -3.43 -0.60 -1.57 115.29 108.65 1gkf s HIS 59 Ca 0.00 -0.51 0.15 0.00 -0.80 0.00 0.00 55.06 53.90 1gkf s HIS 59 Cb 0.00 0.21 0.23 0.00 -1.43 0.00 0.00 32.58 31.59 1gkf s HIS 59 CO 0.00 -0.88 1.11 0.27 -2.00 0.00 0.00 174.74 173.25 1gkf n ASN 60 N -0.31 1.91 0.00 7.38 0.23 -0.61 -1.84 115.26 122.02 1gkf n ASN 60 Ca -0.07 -2.85 0.00 0.00 -0.53 0.00 0.00 54.58 51.13 1gkf n ASN 60 Cb 0.62 -0.37 0.00 0.00 -2.08 0.00 0.00 39.78 37.95 1gkf n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gkf n GLY 61 N -1.15 2.21 1.06 4.83 0.00 -1.26 -4.72 105.19 106.16 1gkf n GLY 61 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1gkf n GLY 61 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1gkf n VAL 62 N -2.00 0.16 -4.39 1.61 0.31 -1.26 -4.77 118.33 107.98 1gkf n VAL 62 Ca 0.00 0.05 -0.20 0.00 -0.01 0.00 0.00 64.34 64.18 1gkf n VAL 62 Cb 0.00 -1.46 -0.10 0.00 -0.91 0.00 0.00 33.84 31.37 1gkf n VAL 62 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1gkf s ILE 63 N -2.00 1.93 0.17 2.52 -4.36 -1.26 -1.20 121.20 117.00 1gkf s ILE 63 Ca 0.00 -2.25 0.06 0.00 -0.26 0.00 0.00 60.65 58.19 1gkf s ILE 63 Cb 0.00 -2.18 -0.05 0.00 1.25 0.00 0.00 42.46 41.49 1gkf s ILE 63 CO 0.00 -0.50 -0.12 -0.94 0.24 0.00 0.00 174.94 173.62 1gkf s SER 64 N -3.39 2.11 0.10 4.36 1.04 -0.01 -1.57 113.70 116.34 1gkf s SER 64 Ca 0.26 -1.02 -0.07 0.00 0.48 0.00 0.00 55.95 55.59 1gkf s SER 64 Cb -0.01 -0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.04 1gkf s SER 64 CO 0.10 -0.27 0.17 -1.66 0.98 0.00 0.00 173.24 172.56 1gkf s TRP 65 N -3.19 0.30 0.24 5.02 -2.14 -0.61 -2.12 118.94 116.46 1gkf s TRP 65 Ca 0.19 -0.73 -0.18 0.00 2.66 0.00 0.00 56.10 58.04 1gkf s TRP 65 Cb 0.01 -0.13 0.07 0.00 -3.10 0.00 0.00 33.47 30.32 1gkf s TRP 65 CO 0.03 -0.56 0.88 0.41 -2.66 0.00 0.00 176.95 175.06 1gkf n GLY 66 N -0.07 0.79 3.22 3.67 0.00 -1.00 -2.91 105.19 108.88 1gkf n GLY 66 Ca -0.13 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 1gkf n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gkf s SER 67 N -3.16 -0.05 0.06 1.61 0.01 -1.26 -1.39 113.70 109.52 1gkf s SER 67 Ca 0.19 -0.29 0.03 0.00 1.31 0.00 0.00 55.95 57.18 1gkf s SER 67 Cb -0.03 0.33 -0.03 0.00 0.21 0.00 0.00 66.02 66.50 1gkf s SER 67 CO 0.07 -0.60 -0.09 0.42 0.41 0.00 0.00 173.24 173.45 1gkf s THR 68 N -2.67 0.67 0.40 1.44 -4.23 -0.64 -4.70 115.64 105.90 1gkf s THR 68 Ca -0.04 -1.28 -0.27 0.00 -1.18 0.00 0.00 61.69 58.92 1gkf s THR 68 Cb -0.01 -0.88 -0.10 0.00 1.34 0.00 0.00 72.50 72.85 1gkf s THR 68 CO -0.04 -0.45 1.45 0.00 -0.54 0.00 0.00 174.62 175.04 1gkf s ALA 69 N -1.78 3.46 -0.05 3.99 0.00 -1.26 -0.50 121.76 125.62 1gkf s ALA 69 Ca -0.05 1.52 -0.16 0.00 0.00 0.00 0.00 51.96 53.27 1gkf s ALA 69 Cb -0.07 -3.59 -0.31 0.00 0.00 0.00 0.00 23.12 19.14 1gkf s ALA 69 CO -0.00 -1.07 0.76 0.78 0.00 0.00 0.00 175.76 176.23 1gkf h GLY 70 N 2.81 0.42 -3.25 0.00 0.00 -1.43 -3.41 103.07 98.22 1gkf h GLY 70 Ca -0.51 -1.08 -0.39 0.00 0.00 0.00 0.00 47.33 45.35 1gkf h GLY 70 CO 0.63 0.95 -0.51 0.69 0.00 0.00 0.00 176.54 178.30 1gkf n PHE 71 N -3.82 -1.14 -1.56 5.60 3.72 -1.25 -4.90 117.46 114.10 1gkf n PHE 71 Ca -0.21 0.04 -0.29 0.00 -0.05 0.00 0.00 57.45 56.94 1gkf n PHE 71 Cb 0.98 -3.84 0.13 0.00 -0.94 0.00 0.00 39.48 35.81 1gkf n PHE 71 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1gkf s GLY 72 N -2.10 1.58 -0.81 1.37 0.00 -1.26 -0.11 107.32 105.98 1gkf s GLY 72 Ca 0.03 -0.50 -0.17 0.00 0.00 0.00 0.00 44.72 44.07 1gkf s GLY 72 CO 0.03 0.04 0.90 -0.35 0.00 0.00 0.00 173.10 173.73 1gkf s ASP 73 N -4.05 6.56 -0.05 1.64 -1.08 -1.26 -4.12 116.67 114.32 1gkf s ASP 73 Ca 0.63 -2.10 0.12 0.00 -0.52 0.00 0.00 52.55 50.69 1gkf s ASP 73 Cb -0.14 -2.31 0.37 0.00 -1.46 0.00 0.00 42.92 39.37 1gkf s ASP 73 CO 0.53 -0.92 1.30 -0.90 0.52 0.00 0.00 175.17 175.70 1gkf n ASP 74 N 5.66 3.20 -3.84 -0.34 5.75 -1.26 -4.74 116.55 120.98 1gkf n ASP 74 Ca 0.12 -2.29 -0.22 0.00 -0.01 0.00 0.00 54.79 52.39 1gkf n ASP 74 Cb 0.47 -0.32 -0.17 0.00 -1.03 0.00 0.00 41.12 40.07 1gkf n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1gkf s VAL 75 N -1.51 0.54 0.13 2.12 1.01 -1.26 -1.12 120.40 120.31 1gkf s VAL 75 Ca 0.28 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.30 1gkf s VAL 75 Cb 0.18 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1gkf s VAL 75 CO 0.14 0.27 -0.18 -1.81 0.00 0.00 0.00 175.10 173.52 1gkf s ASP 76 N 1.52 2.40 -0.15 3.32 1.01 -0.55 -4.93 116.67 119.30 1gkf s ASP 76 Ca -0.01 -0.79 -0.04 0.00 0.71 0.00 0.00 52.55 52.42 1gkf s ASP 76 Cb -0.13 -0.12 -0.03 0.00 1.01 0.00 0.00 42.92 43.65 1gkf s ASP 76 CO -0.04 -0.04 -0.01 -0.63 0.21 0.00 0.00 175.17 174.66 1gkf s ILE 77 N -1.79 4.12 -0.19 0.77 -1.09 -1.26 -0.10 121.20 121.66 1gkf s ILE 77 Ca 0.10 -0.28 -0.08 0.00 -2.23 0.00 0.00 60.65 58.17 1gkf s ILE 77 Cb -0.07 -2.81 -0.04 0.00 -1.58 0.00 0.00 42.46 37.96 1gkf s ILE 77 CO 0.05 0.50 0.07 -0.36 -1.23 0.00 0.00 174.94 173.96 1gkf s PHE 78 N 0.25 3.25 -0.64 3.97 0.40 0.23 -0.95 117.98 124.49 1gkf s PHE 78 Ca -0.01 0.06 -0.23 0.00 -0.60 0.00 0.00 56.93 56.15 1gkf s PHE 78 Cb -0.14 -2.09 0.06 0.00 0.51 0.00 0.00 43.02 41.36 1gkf s PHE 78 CO 0.02 0.13 0.97 0.00 0.70 0.00 0.00 175.22 177.04 1gkf s ALA 79 N 0.45 3.11 0.24 5.36 0.00 0.30 -0.77 121.76 130.45 1gkf s ALA 79 Ca 0.03 -1.72 -0.30 0.00 0.00 0.00 0.00 51.96 49.98 1gkf s ALA 79 Cb -0.12 -3.85 -0.09 0.00 0.00 0.00 0.00 23.12 19.06 1gkf s ALA 79 CO 0.00 -2.72 0.95 -1.21 0.00 0.00 0.00 175.76 172.78 1gkf s GLU 80 N 4.10 4.84 -0.29 0.00 0.41 0.16 -0.44 118.70 127.49 1gkf s GLU 80 Ca 0.24 1.50 -0.20 0.00 -0.41 0.00 0.00 54.97 56.10 1gkf s GLU 80 Cb -0.16 -3.27 -0.01 0.00 -1.78 0.00 0.00 34.13 28.91 1gkf s GLU 80 CO 0.12 0.50 0.64 0.50 -0.49 0.00 0.00 175.26 176.53 1gkf s ARG 81 N -1.21 3.98 0.53 1.61 6.06 -1.26 -1.96 118.95 126.70 1gkf s ARG 81 Ca 0.41 0.40 0.08 0.00 -2.50 0.00 0.00 55.73 54.13 1gkf s ARG 81 Cb -0.26 -3.70 0.06 0.00 0.06 0.00 0.00 34.95 31.10 1gkf s ARG 81 CO 0.32 -0.52 0.65 -0.51 -2.50 0.00 0.00 175.30 172.74 1gkf s LEU 82 N 2.59 3.15 -0.11 -0.88 1.43 -0.78 -1.37 118.68 122.71 1gkf s LEU 82 Ca 0.26 -0.84 -0.06 0.00 -1.03 0.00 0.00 54.13 52.46 1gkf s LEU 82 Cb -0.15 -1.76 0.04 0.00 0.03 0.00 0.00 46.19 44.35 1gkf s LEU 82 CO 0.11 -1.14 0.26 -0.55 0.23 0.00 0.00 176.35 175.26 1gkf s SER 83 N -4.49 -0.28 0.57 2.29 0.15 -1.26 -4.89 113.70 105.78 1gkf s SER 83 Ca 0.54 0.55 0.34 0.00 0.70 0.00 0.00 55.95 58.08 1gkf s SER 83 Cb -0.06 0.45 1.68 0.00 -1.71 0.00 0.00 66.02 66.39 1gkf s SER 83 CO 0.34 -0.15 2.13 0.00 1.20 0.00 0.00 173.24 176.75 1gkf h ALA 84 N 6.91 1.14 0.00 5.45 0.00 -1.98 -1.54 119.26 129.23 1gkf h ALA 84 Ca -0.37 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1gkf h ALA 84 Cb 1.17 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1gkf h ALA 84 CO 0.36 0.07 -0.14 0.93 0.00 0.00 0.00 179.25 180.48 1gkf h GLU 85 N 0.00 0.00 -2.31 0.00 5.08 -2.02 -3.37 114.58 111.96 1gkf h GLU 85 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 1gkf h GLU 85 Cb 0.30 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.16 1gkf h GLU 85 CO 0.01 0.14 -0.98 1.63 -1.00 0.00 0.00 179.01 178.81 1gkf n LYS 86 N -3.24 0.51 -1.70 2.33 5.02 -0.58 -5.11 118.16 115.39 1gkf n LYS 86 Ca 0.01 -3.32 -0.43 0.00 -2.02 0.00 0.00 58.31 52.55 1gkf n LYS 86 Cb 0.43 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1gkf n LYS 86 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1gkf n PRO 87 N 2.34 2.21 -0.76 1.97 -0.04 -1.24 -2.43 135.00 137.05 1gkf n PRO 87 Ca 0.27 0.78 0.00 0.00 -0.04 0.00 0.00 63.50 64.51 1gkf n PRO 87 Cb 0.48 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 1gkf n PRO 87 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gkf n GLY 88 N 1.68 0.70 3.45 0.55 0.00 -1.26 -5.04 105.19 105.27 1gkf n GLY 88 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1gkf n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gkf s TYR 89 N -2.46 2.19 0.05 1.61 1.51 -1.02 -1.03 117.35 118.20 1gkf s TYR 89 Ca 0.00 -0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 55.61 1gkf s TYR 89 Cb 0.00 -0.98 -0.01 0.00 -0.11 0.00 0.00 41.96 40.86 1gkf s TYR 89 CO 0.00 0.64 0.11 1.52 -1.11 0.00 0.00 175.55 176.72 1gkf s TYR 90 N -2.60 0.21 -0.24 2.71 1.13 -0.23 -4.38 117.35 113.95 1gkf s TYR 90 Ca 0.29 -0.55 -0.23 0.00 -1.41 0.00 0.00 57.07 55.17 1gkf s TYR 90 Cb -0.04 -0.14 -0.01 0.00 -1.10 0.00 0.00 41.96 40.67 1gkf s TYR 90 CO 0.14 -0.41 0.73 -1.17 -2.51 0.00 0.00 175.55 172.33 1gkf s LEU 91 N -2.35 4.09 -0.13 -3.49 2.96 -0.47 -0.44 118.68 118.86 1gkf s LEU 91 Ca -0.02 0.90 -0.05 0.00 -0.22 0.00 0.00 54.13 54.74 1gkf s LEU 91 Cb 0.01 -3.03 0.06 0.00 0.50 0.00 0.00 46.19 43.73 1gkf s LEU 91 CO -0.06 -0.43 0.26 -2.28 -1.32 0.00 0.00 176.35 172.51 1gkf s HIS 92 N 2.57 -0.40 -1.42 5.38 5.65 -0.25 -4.07 115.29 122.75 1gkf s HIS 92 Ca 0.31 0.94 -0.08 0.00 0.25 0.00 0.00 55.06 56.48 1gkf s HIS 92 Cb -0.15 -0.04 0.04 0.00 -1.18 0.00 0.00 32.58 31.24 1gkf s HIS 92 CO 0.08 -0.34 0.95 0.09 -0.65 0.00 0.00 174.74 174.87 1gkf n ASN 93 N 5.28 -3.92 0.00 9.88 5.03 -0.19 -2.26 115.26 129.08 1gkf n ASN 93 Ca -0.07 -0.74 0.00 0.00 0.87 0.00 0.00 54.58 54.64 1gkf n ASN 93 Cb 0.50 -4.22 0.00 0.00 -1.02 0.00 0.00 39.78 35.04 1gkf n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gkf n GLY 94 N -1.68 0.97 3.30 7.41 0.00 -1.26 -5.02 105.19 108.90 1gkf n GLY 94 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 1gkf n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkf s LYS 95 N -0.06 1.17 -0.37 1.61 1.02 -0.96 -5.11 119.74 117.05 1gkf s LYS 95 Ca 0.00 -1.20 -0.25 0.00 0.02 0.00 0.00 55.97 54.54 1gkf s LYS 95 Cb 0.00 -1.46 0.01 0.00 -0.52 0.00 0.00 37.83 35.86 1gkf s LYS 95 CO 0.00 0.34 0.90 -1.58 -0.92 0.00 0.00 175.35 174.08 1gkf s TRP 96 N -1.19 3.08 -0.10 3.18 0.52 -1.26 -1.08 118.94 122.08 1gkf s TRP 96 Ca 0.08 0.72 -0.02 0.00 0.02 0.00 0.00 56.10 56.89 1gkf s TRP 96 Cb -0.10 -3.60 -0.03 0.00 -1.15 0.00 0.00 33.47 28.59 1gkf s TRP 96 CO 0.05 -0.81 -0.00 0.08 0.02 0.00 0.00 176.95 176.28 1gkf s VAL 97 N 3.40 4.26 0.07 4.03 1.01 0.42 -4.89 120.40 128.69 1gkf s VAL 97 Ca 0.37 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1gkf s VAL 97 Cb -0.12 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 1gkf s VAL 97 CO 0.18 0.58 1.13 -0.75 0.00 0.00 0.00 175.10 176.24 1gkf s LYS 98 N -0.59 4.49 0.58 2.72 2.20 -1.26 -1.06 119.74 126.82 1gkf s LYS 98 Ca 0.10 1.69 -0.19 0.00 -0.36 0.00 0.00 55.97 57.21 1gkf s LYS 98 Cb -0.12 -3.36 -0.04 0.00 -1.51 0.00 0.00 37.83 32.80 1gkf s LYS 98 CO 0.02 -0.15 1.16 -1.64 -0.36 0.00 0.00 175.35 174.39 1gkf s MET 99 N 0.76 3.12 0.37 4.03 -1.94 -0.20 -4.94 119.30 120.51 1gkf s MET 99 Ca 0.55 1.69 -0.21 0.00 -1.71 0.00 0.00 55.69 56.02 1gkf s MET 99 Cb -0.28 -1.96 -0.10 0.00 2.01 0.00 0.00 34.83 34.50 1gkf s MET 99 CO 0.30 -1.05 0.89 -0.51 -0.01 0.00 0.00 175.02 174.64 1gkf s LEU 100 N -4.02 4.06 0.03 -0.03 1.43 -0.14 -4.91 118.68 115.09 1gkf s LEU 100 Ca 0.74 1.61 -0.07 0.00 -1.03 0.00 0.00 54.13 55.38 1gkf s LEU 100 Cb -0.26 -4.29 -0.00 0.00 0.03 0.00 0.00 46.19 41.66 1gkf s LEU 100 CO 0.31 -0.25 0.14 -0.94 0.23 0.00 0.00 176.35 175.84 1gkf s SER 101 N -2.06 0.09 0.00 2.29 1.04 -1.26 -0.80 113.70 113.00 1gkf s SER 101 Ca 0.57 -0.40 -0.07 0.00 0.48 0.00 0.00 55.95 56.53 1gkf s SER 101 Cb -0.11 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1gkf s SER 101 CO 0.16 -0.50 0.13 0.00 0.98 0.00 0.00 173.24 174.01 1gkf s ARG 102 N -2.32 0.45 -0.08 4.02 1.70 -0.46 -4.99 118.95 117.27 1gkf s ARG 102 Ca -0.07 -0.38 -0.10 0.00 -0.47 0.00 0.00 55.73 54.71 1gkf s ARG 102 Cb -0.03 0.19 -0.05 0.00 -0.57 0.00 0.00 34.95 34.50 1gkf s ARG 102 CO -0.03 -0.11 0.23 -1.21 -1.08 0.00 0.00 175.30 173.11 1gkf s GLU 103 N -1.31 3.62 -0.02 3.89 2.02 -1.26 -0.71 118.70 124.93 1gkf s GLU 103 Ca -0.14 0.06 0.04 0.00 0.02 0.00 0.00 54.97 54.95 1gkf s GLU 103 Cb -0.07 -3.20 -0.01 0.00 0.10 0.00 0.00 34.13 30.94 1gkf s GLU 103 CO 0.01 0.74 -0.14 -1.21 0.02 0.00 0.00 175.26 174.68 1gkf s GLU 104 N -1.02 1.23 -0.15 1.61 0.41 -0.22 -4.98 118.70 115.59 1gkf s GLU 104 Ca 0.18 -0.50 0.00 0.00 -0.41 0.00 0.00 54.97 54.25 1gkf s GLU 104 Cb -0.14 -1.16 -0.00 0.00 -1.78 0.00 0.00 34.13 31.05 1gkf s GLU 104 CO 0.07 0.27 -0.16 0.99 -0.49 0.00 0.00 175.26 175.94 1gkf s THR 105 N -0.20 2.62 -0.39 3.63 2.01 -1.26 -1.25 115.64 120.80 1gkf s THR 105 Ca 0.03 -0.79 -0.21 0.00 0.31 0.00 0.00 61.69 61.03 1gkf s THR 105 Cb -0.07 -2.10 0.01 0.00 0.01 0.00 0.00 72.50 70.35 1gkf s THR 105 CO 0.00 0.52 0.67 -0.63 -0.69 0.00 0.00 174.62 174.49 1gkf s ILE 106 N 0.78 4.83 0.33 1.82 -1.09 0.14 -4.94 121.20 123.07 1gkf s ILE 106 Ca -0.06 0.47 -0.24 0.00 -2.23 0.00 0.00 60.65 58.59 1gkf s ILE 106 Cb -0.15 -4.15 -0.10 0.00 -1.58 0.00 0.00 42.46 36.47 1gkf s ILE 106 CO 0.00 -0.45 0.91 -0.89 -1.23 0.00 0.00 174.94 173.28 1gkf s THR 107 N 2.85 4.31 -0.13 2.92 2.01 -1.26 -1.67 115.64 124.66 1gkf s THR 107 Ca 0.25 1.66 -0.01 0.00 0.31 0.00 0.00 61.69 63.90 1gkf s THR 107 Cb -0.14 -3.90 0.03 0.00 0.01 0.00 0.00 72.50 68.51 1gkf s THR 107 CO 0.17 0.05 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.43 1gkf s VAL 108 N -1.72 0.87 0.10 3.82 1.01 -1.26 -4.99 120.40 118.22 1gkf s VAL 108 Ca 0.51 -0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.83 1gkf s VAL 108 Cb -0.16 -1.03 -0.10 0.00 0.00 0.00 0.00 36.38 35.09 1gkf s VAL 108 CO 0.21 0.20 1.88 1.17 0.00 0.00 0.00 175.10 178.56 1gkf n LYS 109 N 4.97 2.82 -2.19 2.72 3.00 -1.26 -1.91 118.16 126.30 1gkf n LYS 109 Ca -0.11 1.03 -0.18 0.00 -0.00 0.00 0.00 58.31 59.05 1gkf n LYS 109 Cb 0.49 -2.94 -0.02 0.00 0.00 0.00 0.00 35.03 32.56 1gkf n LYS 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1gkf n ASN 110 N 6.18 -5.31 -3.40 3.14 5.03 -1.26 -4.96 115.26 114.68 1gkf n ASN 110 Ca 0.19 0.07 -0.12 0.00 0.87 0.00 0.00 54.58 55.59 1gkf n ASN 110 Cb 0.38 -4.39 -0.03 0.00 -1.02 0.00 0.00 39.78 34.72 1gkf n ASN 110 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1gkf s GLY 111 N -2.29 1.00 0.07 7.41 0.00 -0.80 -5.15 107.32 107.55 1gkf s GLY 111 Ca 0.00 -1.19 -0.26 0.00 0.00 0.00 0.00 44.72 43.27 1gkf s GLY 111 CO 0.00 -0.76 0.80 1.62 0.00 0.00 0.00 173.10 174.76 1gkf s GLN 112 N -3.19 4.54 0.68 2.90 0.74 -1.26 -4.50 119.66 119.57 1gkf s GLN 112 Ca 0.25 1.14 -0.15 0.00 0.05 0.00 0.00 55.36 56.66 1gkf s GLN 112 Cb -0.01 -3.36 0.01 0.00 1.10 0.00 0.00 33.01 30.75 1gkf s GLN 112 CO 0.15 0.29 1.13 0.00 -0.55 0.00 0.00 175.29 176.31 1gkf s ALA 113 N -0.13 2.37 -0.04 1.58 0.00 -1.26 -4.66 121.76 119.62 1gkf s ALA 113 Ca 0.40 0.60 0.05 0.00 0.00 0.00 0.00 51.96 53.01 1gkf s ALA 113 Cb -0.21 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 1gkf s ALA 113 CO 0.24 -1.44 -0.19 -1.21 0.00 0.00 0.00 175.76 173.17 1gkf s GLU 114 N -4.09 1.89 -0.02 0.00 2.02 -0.67 -4.95 118.70 112.88 1gkf s GLU 114 Ca 0.68 -0.66 0.05 0.00 0.02 0.00 0.00 54.97 55.05 1gkf s GLU 114 Cb -0.22 -1.65 -0.03 0.00 0.10 0.00 0.00 34.13 32.33 1gkf s GLU 114 CO 0.43 0.28 -0.15 0.99 0.02 0.00 0.00 175.26 176.83 1gkf s THR 115 N -0.04 3.04 0.23 3.63 2.01 -1.26 0.23 115.64 123.49 1gkf s THR 115 Ca -0.03 -0.87 -0.13 0.00 0.31 0.00 0.00 61.69 60.97 1gkf s THR 115 Cb -0.12 -2.23 -0.00 0.00 0.01 0.00 0.00 72.50 70.16 1gkf s THR 115 CO 0.02 0.49 0.46 0.72 -0.69 0.00 0.00 174.62 175.63 1gkf s PHE 116 N -0.82 0.32 -0.05 4.92 -0.71 -0.38 -5.00 117.98 116.26 1gkf s PHE 116 Ca 0.13 -0.68 0.04 0.00 -1.04 0.00 0.00 56.93 55.38 1gkf s PHE 116 Cb -0.11 0.18 -0.02 0.00 -1.21 0.00 0.00 43.02 41.86 1gkf s PHE 116 CO 0.03 -0.96 -0.18 0.99 -1.34 0.00 0.00 175.22 173.77 1gkf s THR 117 N -4.00 2.75 -0.15 -4.49 2.01 -1.26 -1.05 115.64 109.45 1gkf s THR 117 Ca 0.21 -0.83 -0.05 0.00 0.31 0.00 0.00 61.69 61.33 1gkf s THR 117 Cb -0.00 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1gkf s THR 117 CO 0.07 0.58 0.02 -0.69 -0.69 0.00 0.00 174.62 173.91 1gkf s VAL 118 N -0.52 4.46 0.10 3.82 1.01 0.11 -4.97 120.40 124.41 1gkf s VAL 118 Ca 0.07 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 61.96 1gkf s VAL 118 Cb -0.11 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 1gkf s VAL 118 CO 0.01 0.51 -0.09 0.26 0.00 0.00 0.00 175.10 175.79 1gkf s TRP 119 N -0.02 2.76 -0.11 5.22 0.52 -1.26 -1.36 118.94 124.69 1gkf s TRP 119 Ca 0.04 -0.14 -0.12 0.00 0.02 0.00 0.00 56.10 55.90 1gkf s TRP 119 Cb -0.13 -1.44 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1gkf s TRP 119 CO 0.02 0.43 0.33 0.50 0.02 0.00 0.00 176.95 178.24 1gkf s ARG 120 N -2.22 0.41 0.51 4.98 3.52 0.02 -0.64 118.95 125.53 1gkf s ARG 120 Ca 0.22 0.40 0.01 0.00 -0.13 0.00 0.00 55.73 56.23 1gkf s ARG 120 Cb -0.11 0.20 0.01 0.00 -1.56 0.00 0.00 34.95 33.48 1gkf s ARG 120 CO 0.14 -0.06 0.08 0.25 -0.81 0.00 0.00 175.30 174.91 1gkf n THR 121 N 2.77 0.00 0.20 4.11 -2.24 -0.34 -0.97 114.28 117.80 1gkf n THR 121 Ca -0.14 -2.35 0.18 0.00 -2.27 0.00 0.00 64.05 59.47 1gkf n THR 121 Cb 0.58 0.38 0.83 0.00 -2.10 0.00 0.00 70.33 70.02 1gkf n THR 121 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1gkf h VAL 122 N 1.14 0.39 -0.02 2.28 3.04 -2.00 -1.69 116.25 119.40 1gkf h VAL 122 Ca -0.41 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1gkf h VAL 122 Cb 1.27 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 31.35 1gkf h VAL 122 CO 0.67 0.00 -0.19 1.41 -1.01 0.00 0.00 177.57 178.45 1gkf n HIS 123 N -3.68 0.00 0.00 3.17 8.25 -1.26 -5.08 115.22 116.62 1gkf n HIS 123 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1gkf n HIS 123 Cb 0.37 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1gkf n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gkf n GLY 124 N 1.32 0.85 3.77 -1.41 0.00 -0.64 -2.65 105.19 106.43 1gkf n GLY 124 Ca 0.14 -2.18 -0.38 0.00 0.00 0.00 0.00 46.02 43.60 1gkf n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gkf s ASN 125 N -0.84 6.15 -0.05 1.61 0.01 -1.25 -1.20 114.94 119.36 1gkf s ASN 125 Ca 0.00 2.38 -0.30 0.00 -0.71 0.00 0.00 52.86 54.24 1gkf s ASN 125 Cb 0.00 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 1gkf s ASN 125 CO 0.00 -0.94 0.98 -0.63 -1.51 0.00 0.00 177.10 175.00 1gkf s ILE 126 N -1.48 4.84 -0.08 0.60 1.01 0.18 -1.41 121.20 124.87 1gkf s ILE 126 Ca 0.63 2.03 -0.15 0.00 0.00 0.00 0.00 60.65 63.16 1gkf s ILE 126 Cb -0.31 -4.31 -0.29 0.00 0.01 0.00 0.00 42.46 37.57 1gkf s ILE 126 CO 0.38 0.10 0.61 -0.07 0.00 0.00 0.00 174.94 175.96 1gkf h LEU 127 N 7.29 0.46 -7.00 2.97 3.38 -1.26 -3.44 115.31 117.71 1gkf h LEU 127 Ca -0.37 -0.89 0.04 0.00 0.09 0.00 0.00 57.88 56.76 1gkf h LEU 127 Cb 1.19 -0.15 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 1gkf h LEU 127 CO 0.79 1.66 0.37 0.00 0.09 0.00 0.00 178.44 181.35 1gkf s GLN 128 N -2.51 0.98 0.02 1.13 -2.07 -1.25 -5.04 119.66 110.92 1gkf s GLN 128 Ca -0.18 -0.24 0.02 0.00 -1.82 0.00 0.00 55.36 53.14 1gkf s GLN 128 Cb 0.04 0.45 -0.01 0.00 -1.09 0.00 0.00 33.01 32.40 1gkf s GLN 128 CO 0.80 -0.40 -0.06 0.99 -1.32 0.00 0.00 175.29 175.30 1gkf s THR 129 N -2.86 0.44 -0.32 3.63 2.01 -1.26 -0.60 115.64 116.67 1gkf s THR 129 Ca 0.01 -0.66 0.00 0.00 0.31 0.00 0.00 61.69 61.35 1gkf s THR 129 Cb -0.01 -0.45 0.07 0.00 0.01 0.00 0.00 72.50 72.12 1gkf s THR 129 CO -0.07 -0.16 0.03 -0.62 -0.69 0.00 0.00 174.62 173.11 1gkf s ASP 130 N -0.88 4.86 0.34 3.53 -1.08 0.03 -4.97 116.67 118.50 1gkf s ASP 130 Ca -0.05 -1.62 0.04 0.00 -0.52 0.00 0.00 52.55 50.40 1gkf s ASP 130 Cb -0.06 -1.69 0.63 0.00 -1.46 0.00 0.00 42.92 40.34 1gkf s ASP 130 CO 0.00 -0.33 1.91 1.56 0.52 0.00 0.00 175.17 178.84 1gkf h GLN 131 N 7.89 0.59 -0.60 4.34 4.20 -1.98 -1.10 115.11 128.45 1gkf h GLN 131 Ca -0.16 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.40 1gkf h GLN 131 Cb 1.05 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.70 1gkf h GLN 131 CO 0.55 0.54 0.17 1.79 -0.67 0.00 0.00 178.83 181.21 1gkf h THR 132 N 0.58 1.25 -0.38 -0.54 1.35 -1.95 -3.22 112.91 109.99 1gkf h THR 132 Ca 0.13 -0.87 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 1gkf h THR 132 Cb 0.22 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 67.31 1gkf h THR 132 CO -0.00 0.33 0.00 0.35 -0.25 0.00 0.00 175.52 175.95 1gkf n THR 133 N -4.37 0.68 -3.82 6.82 -2.24 -1.11 -4.99 114.28 105.25 1gkf n THR 133 Ca 0.03 -0.84 -0.31 0.00 -2.27 0.00 0.00 64.05 60.66 1gkf n THR 133 Cb 0.23 0.78 0.02 0.00 -2.10 0.00 0.00 70.33 69.25 1gkf n THR 133 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gkf n GLN 134 N 1.07 -1.82 -4.30 -0.78 1.13 -0.43 -4.91 117.38 107.33 1gkf n GLN 134 Ca 0.16 0.40 -0.19 0.00 -1.94 0.00 0.00 57.00 55.43 1gkf n GLN 134 Cb 0.50 -4.08 -0.15 0.00 0.11 0.00 0.00 30.24 26.61 1gkf n GLN 134 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1gkf s THR 135 N -3.64 0.64 -0.05 5.09 2.01 -1.09 -1.87 115.64 116.73 1gkf s THR 135 Ca 0.32 -0.29 0.05 0.00 0.31 0.00 0.00 61.69 62.07 1gkf s THR 135 Cb -0.12 -0.57 -0.01 0.00 0.01 0.00 0.00 72.50 71.81 1gkf s THR 135 CO 0.88 0.20 -0.21 0.00 -0.69 0.00 0.00 174.62 174.81 1gkf s ALA 136 N 0.16 1.83 -0.16 7.40 0.00 -0.83 -0.79 121.76 129.38 1gkf s ALA 136 Ca -0.02 -0.86 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 1gkf s ALA 136 Cb -0.07 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.42 1gkf s ALA 136 CO 0.00 0.34 0.26 0.71 0.00 0.00 0.00 175.76 177.07 1gkf s TYR 137 N -0.06 3.47 -0.08 0.00 2.02 0.23 0.41 117.35 123.33 1gkf s TYR 137 Ca -0.04 0.55 0.03 0.00 -0.37 0.00 0.00 57.07 57.24 1gkf s TYR 137 Cb -0.12 -2.28 -0.02 0.00 -0.40 0.00 0.00 41.96 39.14 1gkf s TYR 137 CO 0.03 0.29 -0.16 0.00 -1.57 0.00 0.00 175.55 174.14 1gkf s ALA 138 N 0.31 2.55 -0.37 3.71 0.00 0.05 -0.71 121.76 127.30 1gkf s ALA 138 Ca 0.15 -0.96 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 1gkf s ALA 138 Cb -0.13 -1.00 -0.00 0.00 0.00 0.00 0.00 23.12 21.99 1gkf s ALA 138 CO 0.03 0.41 0.35 0.21 0.00 0.00 0.00 175.76 176.76 1gkf s LYS 139 N -0.20 3.37 -0.11 0.00 2.20 -0.50 -0.60 119.74 123.90 1gkf s LYS 139 Ca -0.00 -0.61 -0.12 0.00 -0.36 0.00 0.00 55.97 54.88 1gkf s LYS 139 Cb -0.13 -3.86 -0.05 0.00 -1.51 0.00 0.00 37.83 32.28 1gkf s LYS 139 CO 0.03 -0.61 0.27 -1.12 -0.36 0.00 0.00 175.35 173.55 1gkf s SER 140 N 1.74 6.51 -0.12 1.43 0.01 0.85 -3.95 113.70 120.17 1gkf s SER 140 Ca 0.10 0.60 0.02 0.00 1.31 0.00 0.00 55.95 57.98 1gkf s SER 140 Cb -0.17 -2.16 -0.00 0.00 0.21 0.00 0.00 66.02 63.89 1gkf s SER 140 CO 0.12 0.26 -0.19 -0.13 0.41 0.00 0.00 173.24 173.71 1gkf s ARG 141 N -0.40 3.19 0.48 12.44 0.52 -1.26 -1.48 118.95 132.44 1gkf s ARG 141 Ca 0.17 -0.79 0.22 0.00 -0.52 0.00 0.00 55.73 54.82 1gkf s ARG 141 Cb -0.14 -2.48 1.24 0.00 0.52 0.00 0.00 34.95 34.09 1gkf s ARG 141 CO 0.06 0.16 2.01 0.00 0.02 0.00 0.00 175.30 177.55 1gkf h ALA 142 N 6.83 1.38 -0.07 2.13 0.00 -1.40 -1.54 119.26 126.59 1gkf h ALA 142 Ca -0.24 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1gkf h ALA 142 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1gkf h ALA 142 CO 0.52 0.21 0.00 -2.67 0.00 0.00 0.00 179.25 177.31 1gkf n TRP 143 N -3.84 0.09 -1.80 0.00 4.27 -1.26 -4.80 117.44 110.10 1gkf n TRP 143 Ca -0.02 -0.05 -0.42 0.00 -3.89 0.00 0.00 57.50 53.13 1gkf n TRP 143 Cb 0.27 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.19 1gkf n TRP 143 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 1gkf s ASP 144 N -1.61 6.47 0.00 -0.67 -1.08 -0.58 -1.20 116.67 117.99 1gkf s ASP 144 Ca 0.31 2.72 0.00 0.00 -0.52 0.00 0.00 52.55 55.06 1gkf s ASP 144 Cb 0.16 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 39.04 1gkf s ASP 144 CO 0.25 -0.94 0.00 0.61 0.52 0.00 0.00 175.17 175.61 1gkf n GLY 145 N 4.03 1.13 0.16 2.66 0.00 -1.26 -4.88 105.19 107.02 1gkf n GLY 145 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 1gkf n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gkf n LYS 146 N -2.00 2.26 -0.05 1.61 5.02 -0.34 -4.77 118.16 119.88 1gkf n LYS 146 Ca 0.00 -2.12 -0.11 0.00 -2.02 0.00 0.00 58.31 54.06 1gkf n LYS 146 Cb 0.00 -1.31 -0.05 0.00 -0.02 0.00 0.00 35.03 33.66 1gkf n LYS 146 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1gkf h GLU 147 N 0.32 0.28 -0.20 1.97 3.07 -1.90 -1.30 114.58 116.81 1gkf h GLU 147 Ca 0.00 -0.05 -0.16 0.00 -0.50 0.00 0.00 59.36 58.64 1gkf h GLU 147 Cb 0.81 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 1gkf h GLU 147 CO 0.02 0.36 -0.54 0.28 -1.40 0.00 0.00 179.01 177.74 1gkf h VAL 148 N 0.14 1.31 -0.70 3.13 2.07 -1.95 -2.46 116.25 117.79 1gkf h VAL 148 Ca 0.06 -1.77 0.01 0.00 0.82 0.00 0.00 66.70 65.82 1gkf h VAL 148 Cb 0.19 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 1gkf h VAL 148 CO -0.00 0.55 0.47 0.00 0.02 0.00 0.00 177.57 178.61 1gkf h ALA 149 N 0.94 1.52 -0.44 1.67 0.00 -1.84 -1.03 119.26 120.09 1gkf h ALA 149 Ca 0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1gkf h ALA 149 Cb 1.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1gkf h ALA 149 CO 0.10 0.44 -0.17 0.77 0.00 0.00 0.00 179.25 180.39 1gkf h SER 150 N 0.93 0.90 -0.38 0.00 0.02 -0.86 0.27 113.55 114.43 1gkf h SER 150 Ca 0.26 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1gkf h SER 150 Cb -0.07 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 1gkf h SER 150 CO -0.06 1.09 0.25 0.25 -1.14 0.00 0.00 176.83 177.21 1gkf h LEU 151 N 0.71 0.44 -0.75 5.07 6.46 -0.96 -2.32 115.31 123.97 1gkf h LEU 151 Ca 0.10 -0.02 -0.13 0.00 -0.12 0.00 0.00 57.88 57.71 1gkf h LEU 151 Cb 0.73 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.53 1gkf h LEU 151 CO 0.06 0.33 -0.59 -0.07 -0.62 0.00 0.00 178.44 177.55 1gkf h LEU 152 N 0.51 0.13 -1.08 2.25 3.38 -0.98 -2.62 115.31 116.90 1gkf h LEU 152 Ca 0.14 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1gkf h LEU 152 Cb -0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1gkf h LEU 152 CO -0.03 0.69 0.39 0.00 0.09 0.00 0.00 178.44 179.58 1gkf h ALA 153 N 1.31 1.29 0.00 1.53 0.00 -0.78 0.10 119.26 122.72 1gkf h ALA 153 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1gkf h ALA 153 Cb 1.06 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1gkf h ALA 153 CO 0.08 0.57 -0.11 2.35 0.00 0.00 0.00 179.25 182.15 1gkf h TRP 154 N 1.04 0.00 0.00 0.00 2.91 -1.15 -1.24 115.95 117.51 1gkf h TRP 154 Ca 0.26 0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.17 1gkf h TRP 154 Cb 0.05 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.69 1gkf h TRP 154 CO 0.01 0.11 -0.63 1.15 -1.03 0.00 0.00 178.44 178.05 1gkf h THR 155 N 0.00 1.06 0.00 2.65 2.02 -0.90 -3.37 112.91 114.36 1gkf h THR 155 Ca -0.00 -2.02 -0.06 0.00 0.77 0.00 0.00 66.41 65.10 1gkf h THR 155 Cb 0.58 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 1gkf h THR 155 CO 0.01 0.36 -0.30 0.45 0.37 0.00 0.00 175.52 176.41 1gkf h HIS 156 N -1.00 0.00 -0.01 3.16 3.86 -0.81 -2.13 115.15 118.23 1gkf h HIS 156 Ca -0.16 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1gkf h HIS 156 Cb 1.00 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.47 1gkf h HIS 156 CO 0.12 0.30 0.01 -0.56 0.86 0.00 0.00 177.93 178.66 1gkf h GLN 157 N 0.00 0.00 0.00 2.45 -0.00 -1.42 -1.52 115.11 114.62 1gkf h GLN 157 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1gkf h GLN 157 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.03 1gkf h GLN 157 CO 0.04 0.00 0.00 0.52 -0.00 0.00 0.00 178.83 179.39 1gkf h MET 158 N 0.00 0.00 -0.01 0.06 2.86 -1.59 -2.33 114.93 113.92 1gkf h MET 158 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1gkf h MET 158 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1gkf h MET 158 CO -0.00 0.00 -0.50 1.63 1.06 0.00 0.00 176.91 179.10 1gkf n LYS 159 N -2.39 0.92 -2.07 1.72 5.02 -0.57 -4.76 118.16 116.03 1gkf n LYS 159 Ca 0.01 -0.72 -0.38 0.00 -2.02 0.00 0.00 58.31 55.20 1gkf n LYS 159 Cb 0.18 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.71 1gkf n LYS 159 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gkf s ALA 160 N -2.57 2.98 -0.17 7.82 0.00 -0.88 -4.94 121.76 123.99 1gkf s ALA 160 Ca 0.18 1.12 0.02 0.00 0.00 0.00 0.00 51.96 53.27 1gkf s ALA 160 Cb 0.18 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.86 1gkf s ALA 160 CO 0.61 -0.91 0.73 1.63 0.00 0.00 0.00 175.76 177.81 1gkf n LYS 161 N -0.54 0.60 -3.88 0.00 5.02 -1.26 -4.64 118.16 113.47 1gkf n LYS 161 Ca 0.08 -0.96 -0.08 0.00 -2.02 0.00 0.00 58.31 55.33 1gkf n LYS 161 Cb 0.46 -1.03 -0.01 0.00 -0.02 0.00 0.00 35.03 34.43 1gkf n LYS 161 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1gkf s ASN 162 N -0.45 -0.11 0.16 4.39 2.20 -1.26 -4.82 114.94 115.04 1gkf s ASN 162 Ca 0.02 -0.84 -0.16 0.00 -0.94 0.00 0.00 52.86 50.94 1gkf s ASN 162 Cb 0.01 0.74 0.02 0.00 -2.00 0.00 0.00 41.25 40.03 1gkf s ASN 162 CO 0.02 -1.41 1.82 -0.25 -2.94 0.00 0.00 177.10 174.33 1gkf h TRP 163 N 2.04 0.55 -0.60 1.54 2.91 -1.98 -1.09 115.95 119.32 1gkf h TRP 163 Ca -0.24 0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.74 1gkf h TRP 163 Cb 1.25 -0.18 -0.02 0.00 -0.51 0.00 0.00 29.16 29.69 1gkf h TRP 163 CO 0.74 0.35 0.17 1.96 -1.03 0.00 0.00 178.44 180.62 1gkf h GLN 164 N 0.58 0.94 -0.64 2.65 1.08 -1.98 0.69 115.11 118.43 1gkf h GLN 164 Ca 0.16 -0.21 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 1gkf h GLN 164 Cb -0.06 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.21 1gkf h GLN 164 CO -0.03 0.85 0.36 0.93 -0.95 0.00 0.00 178.83 179.99 1gkf h GLU 165 N 0.86 0.89 -0.23 1.46 5.08 -1.94 -1.88 114.58 118.82 1gkf h GLU 165 Ca 0.19 -0.10 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 1gkf h GLU 165 Cb 0.32 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1gkf h GLU 165 CO -0.00 0.66 -0.41 2.35 -1.00 0.00 0.00 179.01 180.61 1gkf h TRP 166 N 0.87 0.85 0.00 4.33 7.01 -0.94 -2.99 115.95 125.08 1gkf h TRP 166 Ca 0.23 -0.30 -0.05 0.00 2.11 0.00 0.00 58.89 60.88 1gkf h TRP 166 Cb 0.02 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 1gkf h TRP 166 CO -0.01 1.07 -0.25 1.79 -2.79 0.00 0.00 178.44 178.25 1gkf h THR 167 N 0.39 0.83 -0.94 2.65 1.35 -0.81 -0.50 112.91 115.88 1gkf h THR 167 Ca 0.01 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 1gkf h THR 167 Cb 1.00 1.60 -0.05 0.00 -1.73 0.00 0.00 68.15 68.97 1gkf h THR 167 CO 0.09 0.25 0.60 1.56 -0.25 0.00 0.00 175.52 177.77 1gkf h GLN 168 N 0.00 1.25 0.10 4.72 4.20 -1.19 -0.92 115.11 123.26 1gkf h GLN 168 Ca -0.00 -0.09 -0.27 0.00 0.06 0.00 0.00 58.65 58.35 1gkf h GLN 168 Cb 0.58 -0.27 0.01 0.00 0.30 0.00 0.00 27.48 28.09 1gkf h GLN 168 CO 0.03 0.84 -1.17 1.96 -0.67 0.00 0.00 178.83 179.82 1gkf h GLN 169 N 1.28 0.42 -0.90 1.46 1.08 -1.34 -3.29 115.11 113.82 1gkf h GLN 169 Ca 0.34 -0.58 0.12 0.00 -1.45 0.00 0.00 58.65 57.07 1gkf h GLN 169 Cb -0.12 0.20 -0.07 0.00 -0.05 0.00 0.00 27.48 27.44 1gkf h GLN 169 CO -0.07 1.24 0.58 0.00 -0.95 0.00 0.00 178.83 179.63 1gkf h ALA 170 N 0.53 1.69 0.00 3.87 0.00 -0.73 -0.23 119.26 124.38 1gkf h ALA 170 Ca -0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1gkf h ALA 170 Cb 1.86 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1gkf h ALA 170 CO 0.21 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1gkf h ALA 171 N 1.57 1.00 -0.01 0.00 0.00 -1.24 -2.09 119.26 118.49 1gkf h ALA 171 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1gkf h ALA 171 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1gkf h ALA 171 CO -0.20 0.00 -0.42 1.63 0.00 0.00 0.00 179.25 180.26 1gkf n LYS 172 N -2.39 1.15 -3.08 0.00 5.02 -0.11 -4.88 118.16 113.88 1gkf n LYS 172 Ca 0.01 -0.91 -0.42 0.00 -2.02 0.00 0.00 58.31 54.97 1gkf n LYS 172 Cb 0.17 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.64 1gkf n LYS 172 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1gkf s GLN 173 N -2.47 3.70 0.02 1.97 -0.44 -0.79 -3.97 119.66 117.68 1gkf s GLN 173 Ca 0.20 0.11 0.23 0.00 -2.50 0.00 0.00 55.36 53.40 1gkf s GLN 173 Cb 0.18 -3.81 -0.00 0.00 -1.64 0.00 0.00 33.01 27.75 1gkf s GLN 173 CO 0.56 -0.75 1.01 0.00 0.50 0.00 0.00 175.29 176.61 1gkf n ALA 174 N 6.11 3.88 -1.74 1.58 0.00 -1.26 -2.62 120.51 126.45 1gkf n ALA 174 Ca -0.00 -0.47 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 1gkf n ALA 174 Cb 0.48 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.05 1gkf n ALA 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gkf s LEU 175 N -3.47 3.21 -0.84 0.00 1.43 -1.26 -0.83 118.68 116.92 1gkf s LEU 175 Ca 0.06 1.52 -0.24 0.00 -1.03 0.00 0.00 54.13 54.44 1gkf s LEU 175 Cb 0.15 -4.48 0.06 0.00 0.03 0.00 0.00 46.19 41.95 1gkf s LEU 175 CO 0.82 -1.11 1.26 0.28 0.23 0.00 0.00 176.35 177.83 1gkf s THR 176 N -3.08 4.01 -0.05 5.49 -1.32 -1.26 -3.52 115.64 115.91 1gkf s THR 176 Ca 0.57 -0.35 -0.03 0.00 -1.21 0.00 0.00 61.69 60.67 1gkf s THR 176 Cb -0.12 -4.91 0.03 0.00 -1.51 0.00 0.00 72.50 65.99 1gkf s THR 176 CO 0.53 -1.77 0.12 -0.63 -2.21 0.00 0.00 174.62 170.65 1gkf s ILE 177 N 4.83 -0.03 -0.09 5.08 -1.09 -1.13 -1.14 121.20 127.62 1gkf s ILE 177 Ca 0.36 0.12 -0.29 0.00 -2.23 0.00 0.00 60.65 58.62 1gkf s ILE 177 Cb -0.07 -0.19 -0.02 0.00 -1.58 0.00 0.00 42.46 40.61 1gkf s ILE 177 CO 0.03 0.05 0.98 0.20 -1.23 0.00 0.00 174.94 174.97 1gkf s ASN 178 N 0.79 7.23 0.01 3.58 0.01 0.34 -1.08 114.94 125.82 1gkf s ASN 178 Ca -0.06 1.51 0.03 0.00 -0.71 0.00 0.00 52.86 53.63 1gkf s ASN 178 Cb -0.08 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 39.00 1gkf s ASN 178 CO -0.04 -0.40 -0.06 0.26 -1.51 0.00 0.00 177.10 175.35 1gkf s TRP 179 N 1.83 2.90 0.02 2.20 0.52 0.24 -1.62 118.94 125.03 1gkf s TRP 179 Ca 0.48 -0.03 0.04 0.00 0.02 0.00 0.00 56.10 56.61 1gkf s TRP 179 Cb -0.18 -1.61 -0.02 0.00 -1.15 0.00 0.00 33.47 30.51 1gkf s TRP 179 CO 0.19 0.38 -0.14 0.71 0.02 0.00 0.00 176.95 178.12 1gkf s TYR 180 N -1.01 1.20 0.04 -1.98 1.51 -0.49 -1.27 117.35 115.35 1gkf s TYR 180 Ca 0.17 -0.30 0.06 0.00 -1.01 0.00 0.00 57.07 56.00 1gkf s TYR 180 Cb -0.11 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 40.98 1gkf s TYR 180 CO 0.08 0.01 -0.18 -0.47 -1.11 0.00 0.00 175.55 173.88 1gkf s TYR 181 N -0.62 1.54 0.06 2.71 6.14 0.11 -2.38 117.35 124.92 1gkf s TYR 181 Ca 0.03 -0.37 -0.11 0.00 0.64 0.00 0.00 57.07 57.26 1gkf s TYR 181 Cb -0.07 -0.92 0.01 0.00 0.42 0.00 0.00 41.96 41.41 1gkf s TYR 181 CO 0.00 0.07 0.25 0.00 0.64 0.00 0.00 175.55 176.51 1gkf s ALA 182 N -0.84 -0.47 0.23 3.97 0.00 -0.90 -1.15 121.76 122.60 1gkf s ALA 182 Ca 0.05 -0.27 -0.08 0.00 0.00 0.00 0.00 51.96 51.66 1gkf s ALA 182 Cb -0.08 0.39 -0.02 0.00 0.00 0.00 0.00 23.12 23.40 1gkf s ALA 182 CO 0.02 -0.45 0.33 0.16 0.00 0.00 0.00 175.76 175.82 1gkf s ASP 183 N -2.37 0.01 0.64 0.00 1.47 -0.54 -0.83 116.67 115.06 1gkf s ASP 183 Ca -0.01 -1.13 0.36 0.00 1.18 0.00 0.00 52.55 52.95 1gkf s ASP 183 Cb 0.01 0.50 2.02 0.00 -0.34 0.00 0.00 42.92 45.11 1gkf s ASP 183 CO -0.06 -1.01 2.21 1.62 0.68 0.00 0.00 175.17 178.60 1gkf h VAL 184 N 2.41 0.18 -0.00 2.11 3.04 -1.49 -0.72 116.25 121.78 1gkf h VAL 184 Ca -0.30 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1gkf h VAL 184 Cb 1.25 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 1gkf h VAL 184 CO 0.43 0.00 -0.13 0.59 -1.01 0.00 0.00 177.57 177.45 1gkf n ASN 185 N -3.31 0.63 0.00 3.17 3.02 -1.26 -4.29 115.26 113.22 1gkf n ASN 185 Ca -0.02 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1gkf n ASN 185 Cb 0.19 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 1gkf n ASN 185 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gkf n GLY 186 N 1.28 0.77 3.79 7.41 0.00 -0.28 -4.94 105.19 113.22 1gkf n GLY 186 Ca 0.14 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1gkf n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gkf s ASN 187 N -2.04 6.53 0.06 1.61 0.02 -1.26 -2.85 114.94 117.00 1gkf s ASN 187 Ca 0.00 1.97 0.01 0.00 -1.02 0.00 0.00 52.86 53.82 1gkf s ASN 187 Cb 0.00 -2.57 -0.03 0.00 0.02 0.00 0.00 41.25 38.67 1gkf s ASN 187 CO 0.00 -0.65 -0.06 0.27 0.02 0.00 0.00 177.10 176.68 1gkf s ILE 188 N -1.85 0.47 0.22 0.60 -4.36 -1.26 -1.46 121.20 113.56 1gkf s ILE 188 Ca 0.63 -1.40 -0.22 0.00 -0.26 0.00 0.00 60.65 59.40 1gkf s ILE 188 Cb -0.19 -0.99 0.04 0.00 1.25 0.00 0.00 42.46 42.58 1gkf s ILE 188 CO 0.23 -0.63 0.67 -0.83 0.24 0.00 0.00 174.94 174.62 1gkf s GLY 189 N -2.17 -0.32 -0.12 6.27 0.00 -0.30 -0.44 107.32 110.24 1gkf s GLY 189 Ca -0.02 0.05 -0.10 0.00 0.00 0.00 0.00 44.72 44.65 1gkf s GLY 189 CO -0.03 0.02 0.31 -0.47 0.00 0.00 0.00 173.10 172.93 1gkf s TYR 190 N -3.83 -0.35 -0.04 1.90 5.04 -0.09 -0.72 117.35 119.26 1gkf s TYR 190 Ca 0.07 0.85 -0.00 0.00 -2.44 0.00 0.00 57.07 55.54 1gkf s TYR 190 Cb -0.04 0.12 0.03 0.00 0.35 0.00 0.00 41.96 42.42 1gkf s TYR 190 CO -0.02 -0.18 0.01 0.08 -1.34 0.00 0.00 175.55 174.10 1gkf s VAL 191 N 0.34 0.17 -1.03 3.14 1.01 -0.40 -1.33 120.40 122.30 1gkf s VAL 191 Ca -0.01 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 61.88 1gkf s VAL 191 Cb -0.03 -0.30 0.08 0.00 0.00 0.00 0.00 36.38 36.13 1gkf s VAL 191 CO -0.01 0.17 1.40 -2.28 0.00 0.00 0.00 175.10 174.38 1gkf s HIS 192 N 1.29 2.73 0.79 5.22 2.46 0.14 -0.59 115.29 127.32 1gkf s HIS 192 Ca -0.06 -1.09 -0.11 0.00 0.47 0.00 0.00 55.06 54.27 1gkf s HIS 192 Cb -0.13 -4.60 0.06 0.00 -0.13 0.00 0.00 32.58 27.79 1gkf s HIS 192 CO -0.02 -1.80 1.09 0.95 -2.47 0.00 0.00 174.74 172.48 1gkf s THR 193 N 4.25 3.27 0.00 0.89 -4.23 -0.24 -4.26 115.64 115.32 1gkf s THR 193 Ca 0.44 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.36 1gkf s THR 193 Cb -0.01 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.76 1gkf s THR 193 CO -0.08 -0.54 0.00 0.61 -0.54 0.00 0.00 174.62 174.08 1gkf n GLY 194 N -1.77 3.00 3.74 3.99 0.00 -1.08 -2.85 105.19 110.23 1gkf n GLY 194 Ca 0.07 -1.86 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 1gkf n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gkf s ALA 195 N -1.99 3.44 0.00 4.61 0.00 -0.01 -4.89 121.76 122.92 1gkf s ALA 195 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1gkf s ALA 195 Cb 0.00 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.34 1gkf s ALA 195 CO 0.00 0.05 -0.11 0.71 0.00 0.00 0.00 175.76 176.41 1gkf s TYR 196 N 0.31 0.95 0.44 0.00 2.02 -1.26 -4.54 117.35 115.27 1gkf s TYR 196 Ca 0.31 -0.21 -0.22 0.00 -0.37 0.00 0.00 57.07 56.58 1gkf s TYR 196 Cb -0.17 -0.60 -0.09 0.00 -0.40 0.00 0.00 41.96 40.69 1gkf s TYR 196 CO 0.15 -0.01 1.01 -1.25 -1.57 0.00 0.00 175.55 173.88 1gkf s PRO 197 N -0.41 4.05 -0.58 -1.71 0.04 -1.26 -0.88 135.00 134.25 1gkf s PRO 197 Ca 0.03 1.33 -0.19 0.00 0.04 0.00 0.00 61.00 62.22 1gkf s PRO 197 Cb -0.05 -2.27 0.10 0.00 0.04 0.00 0.00 34.50 32.33 1gkf s PRO 197 CO -0.00 -0.21 0.68 0.34 0.04 0.00 0.00 177.00 177.85 1gkf s ASP 198 N -1.91 6.19 0.36 6.66 2.15 0.15 -4.60 116.67 125.66 1gkf s ASP 198 Ca 0.63 -1.39 -0.15 0.00 0.43 0.00 0.00 52.55 52.06 1gkf s ASP 198 Cb -0.16 -2.30 -0.09 0.00 -0.30 0.00 0.00 42.92 40.08 1gkf s ASP 198 CO 0.20 -1.08 0.78 -0.13 -0.17 0.00 0.00 175.17 174.77 1gkf s ARG 199 N 2.63 3.99 0.75 4.34 0.52 -1.26 -0.17 118.95 129.75 1gkf s ARG 199 Ca 0.11 0.70 -0.14 0.00 -0.52 0.00 0.00 55.73 55.88 1gkf s ARG 199 Cb -0.24 -2.38 0.05 0.00 0.52 0.00 0.00 34.95 32.90 1gkf s ARG 199 CO 0.07 0.08 1.20 -0.65 0.02 0.00 0.00 175.30 176.02 1gkf s GLN 200 N -3.20 2.00 0.20 3.54 -1.52 -1.26 -4.85 119.66 114.57 1gkf s GLN 200 Ca 0.55 1.74 -0.31 0.00 -1.95 0.00 0.00 55.36 55.39 1gkf s GLN 200 Cb -0.10 -1.82 -0.10 0.00 -0.22 0.00 0.00 33.01 30.77 1gkf s GLN 200 CO 0.20 -1.94 1.52 0.45 -0.25 0.00 0.00 175.29 175.28 1gkf s SER 201 N -2.11 6.59 0.00 5.90 0.15 -1.26 -1.87 113.70 121.10 1gkf s SER 201 Ca 0.74 2.66 0.00 0.00 0.70 0.00 0.00 55.95 60.04 1gkf s SER 201 Cb -0.29 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.42 1gkf s SER 201 CO 0.47 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.73 1gkf n GLY 202 N 3.07 0.35 3.61 9.45 0.00 -1.26 -5.04 105.19 115.37 1gkf n GLY 202 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1gkf n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1gkf s HIS 203 N -2.11 2.90 -0.40 1.61 5.04 -0.78 -4.99 115.29 116.56 1gkf s HIS 203 Ca 0.00 0.80 -0.25 0.00 -1.54 0.00 0.00 55.06 54.07 1gkf s HIS 203 Cb 0.00 -4.22 0.02 0.00 0.04 0.00 0.00 32.58 28.42 1gkf s HIS 203 CO 0.00 -1.14 0.89 0.34 -2.34 0.00 0.00 174.74 172.49 1gkf s ASP 204 N 2.25 6.58 0.00 9.88 -1.08 -1.26 -4.94 116.67 128.11 1gkf s ASP 204 Ca 0.46 0.36 0.19 0.00 -0.52 0.00 0.00 52.55 53.05 1gkf s ASP 204 Cb -0.09 -2.44 1.12 0.00 -1.46 0.00 0.00 42.92 40.05 1gkf s ASP 204 CO 0.27 -0.89 1.57 -0.81 0.52 0.00 0.00 175.17 175.83 1gkf n PRO 205 N 6.81 0.53 0.00 4.34 -0.04 -1.26 -2.61 135.00 142.77 1gkf n PRO 205 Ca 0.06 0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.67 1gkf n PRO 205 Cb 0.48 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.83 1gkf n PRO 205 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1gkf n ARG 206 N -1.07 0.30 -4.12 0.54 1.74 -1.26 -4.81 116.66 107.98 1gkf n ARG 206 Ca 0.13 -0.15 -0.10 0.00 -0.77 0.00 0.00 57.85 56.96 1gkf n ARG 206 Cb 0.09 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.93 1gkf n ARG 206 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1gkf s LEU 207 N -2.80 2.43 0.75 0.55 1.43 -1.07 -5.01 118.68 114.94 1gkf s LEU 207 Ca 0.17 -0.87 -0.14 0.00 -1.03 0.00 0.00 54.13 52.27 1gkf s LEU 207 Cb 0.18 -0.03 0.05 0.00 0.03 0.00 0.00 46.19 46.42 1gkf s LEU 207 CO 0.60 -0.42 1.17 -2.84 0.23 0.00 0.00 176.35 175.09 1gkf s PRO 208 N -3.18 2.11 0.07 1.29 0.02 -1.26 -4.80 135.00 129.25 1gkf s PRO 208 Ca 0.04 1.62 0.09 0.00 0.02 0.00 0.00 61.00 62.76 1gkf s PRO 208 Cb 0.01 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.65 1gkf s PRO 208 CO -0.04 -1.82 -0.22 0.14 -0.33 0.00 0.00 177.00 174.72 1gkf s VAL 209 N -2.22 2.49 0.50 3.83 -7.23 -0.12 -4.95 120.40 112.69 1gkf s VAL 209 Ca 0.71 -1.40 -0.23 0.00 -1.81 0.00 0.00 61.98 59.25 1gkf s VAL 209 Cb -0.26 -2.05 -0.07 0.00 0.56 0.00 0.00 36.38 34.56 1gkf s VAL 209 CO 0.47 0.27 1.23 -2.65 -0.31 0.00 0.00 175.10 174.11 1gkf n PRO 210 N 1.42 1.63 -0.33 4.82 -0.02 -1.26 -0.54 135.00 140.71 1gkf n PRO 210 Ca -0.17 0.59 0.11 0.00 -2.02 0.00 0.00 63.50 62.02 1gkf n PRO 210 Cb 0.52 -2.39 0.30 0.00 -0.02 0.00 0.00 33.50 31.92 1gkf n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gkf n GLY 211 N 0.90 2.17 0.00 -1.23 0.00 0.42 -4.40 105.19 103.05 1gkf n GLY 211 Ca 0.09 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.49 1gkf n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gkf n THR 212 N 1.52 0.22 0.00 2.61 -2.24 -1.26 -4.70 114.28 110.43 1gkf n THR 212 Ca 0.23 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.06 1gkf n THR 212 Cb 0.58 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 1gkf n THR 212 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gkf n GLY 213 N 1.15 2.78 0.27 3.38 0.00 -1.26 -1.02 105.19 110.49 1gkf n GLY 213 Ca 0.07 -0.51 0.16 0.00 0.00 0.00 0.00 46.02 45.74 1gkf n GLY 213 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1gkf h LYS 214 N 0.00 0.00 -0.48 1.61 3.64 -1.90 -2.77 116.57 116.66 1gkf h LYS 214 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1gkf h LYS 214 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1gkf h LYS 214 CO 0.00 0.04 0.00 0.91 -2.27 0.00 0.00 179.45 178.13 1gkf n TRP 215 N -3.15 0.63 -1.72 1.91 7.02 -1.26 -4.98 117.44 115.88 1gkf n TRP 215 Ca 0.00 -0.39 -0.38 0.00 -1.02 0.00 0.00 57.50 55.71 1gkf n TRP 215 Cb 0.31 -0.01 0.05 0.00 -2.42 0.00 0.00 31.31 29.24 1gkf n TRP 215 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1gkf n ASP 216 N 1.22 2.25 -4.70 -0.99 9.92 -1.05 -4.73 116.55 118.46 1gkf n ASP 216 Ca 0.18 0.91 -0.38 0.00 -0.53 0.00 0.00 54.79 54.97 1gkf n ASP 216 Cb 0.54 -1.55 0.06 0.00 -0.64 0.00 0.00 41.12 39.53 1gkf n ASP 216 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1gkf n TRP 217 N -1.42 1.77 0.18 1.24 8.01 -1.26 -4.51 117.44 121.44 1gkf n TRP 217 Ca 0.13 0.43 0.05 0.00 -1.31 0.00 0.00 57.50 56.80 1gkf n TRP 217 Cb 0.46 -2.27 0.25 0.00 -2.01 0.00 0.00 31.31 27.74 1gkf n TRP 217 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1gkf h LYS 218 N 0.83 0.00 0.00 -0.99 1.57 -0.89 -3.49 116.57 113.60 1gkf h LYS 218 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1gkf h LYS 218 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1gkf h LYS 218 CO 0.54 0.41 0.00 0.41 -0.57 0.00 0.00 179.45 180.23 1gkf n GLY 219 N 0.54 -0.24 3.64 3.86 0.00 -1.25 -5.00 105.19 106.73 1gkf n GLY 219 Ca 0.00 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1gkf n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gkf s LEU 220 N 0.00 3.33 0.60 0.99 1.43 -1.26 -0.68 118.68 123.09 1gkf s LEU 220 Ca 0.00 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 1gkf s LEU 220 Cb 0.00 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 1gkf s LEU 220 CO 0.00 0.25 1.15 -0.76 0.23 0.00 0.00 176.35 177.22 1gkf s LEU 221 N -1.70 3.60 0.71 1.79 1.43 -0.06 -4.70 118.68 119.75 1gkf s LEU 221 Ca 0.20 2.19 -0.11 0.00 -1.03 0.00 0.00 54.13 55.37 1gkf s LEU 221 Cb -0.11 -4.58 0.01 0.00 0.03 0.00 0.00 46.19 41.54 1gkf s LEU 221 CO 0.11 -1.48 1.07 -2.16 0.23 0.00 0.00 176.35 174.12 1gkf s PRO 222 N -3.55 2.86 0.58 1.29 0.04 -1.26 -4.74 135.00 130.22 1gkf s PRO 222 Ca 0.72 0.69 0.30 0.00 0.04 0.00 0.00 61.00 62.75 1gkf s PRO 222 Cb -0.25 -2.00 1.80 0.00 0.04 0.00 0.00 34.50 34.09 1gkf s PRO 222 CO 0.33 -1.08 2.24 0.35 0.04 0.00 0.00 177.00 178.88 1gkf h PHE 223 N -0.70 0.00 -0.11 0.56 3.57 -1.95 -0.59 116.94 117.73 1gkf h PHE 223 Ca -0.45 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.08 1gkf h PHE 223 Cb 1.23 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.97 1gkf h PHE 223 CO 0.56 0.01 0.12 1.49 -2.23 0.00 0.00 178.31 178.26 1gkf h GLU 224 N 0.00 0.00 0.00 1.11 4.57 -2.02 -1.62 114.58 116.62 1gkf h GLU 224 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1gkf h GLU 224 Cb 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1gkf h GLU 224 CO 0.00 0.00 -0.46 0.52 -1.18 0.00 0.00 179.01 177.89 1gkf h MET 225 N 0.00 0.00 -6.66 1.92 2.86 -1.46 -3.46 114.93 108.13 1gkf h MET 225 Ca 0.05 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.17 1gkf h MET 225 Cb 0.29 0.00 0.06 0.00 0.06 0.00 0.00 31.60 32.01 1gkf h MET 225 CO -0.00 0.00 1.01 -0.80 1.06 0.00 0.00 176.91 178.18 1gkf s ASN 226 N -4.51 6.39 0.17 1.22 0.01 -0.61 -4.94 114.94 112.66 1gkf s ASN 226 Ca 0.07 2.86 -0.34 0.00 -0.71 0.00 0.00 52.86 54.74 1gkf s ASN 226 Cb 0.12 -2.60 -0.15 0.00 0.41 0.00 0.00 41.25 39.04 1gkf s ASN 226 CO 0.69 -0.97 1.41 -2.65 -1.51 0.00 0.00 177.10 174.08 1gkf n PRO 227 N 3.96 1.73 -3.55 -0.60 -0.02 -1.26 -4.83 135.00 130.44 1gkf n PRO 227 Ca 0.16 0.62 -0.14 0.00 -2.02 0.00 0.00 63.50 62.11 1gkf n PRO 227 Cb 0.35 -2.29 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 1gkf n PRO 227 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1gkf s LYS 228 N 0.26 1.07 -0.07 -0.52 -2.85 -1.26 -0.68 119.74 115.69 1gkf s LYS 228 Ca 0.76 -0.18 -0.13 0.00 -1.00 0.00 0.00 55.97 55.42 1gkf s LYS 228 Cb -0.76 0.49 0.03 0.00 -2.06 0.00 0.00 37.83 35.53 1gkf s LYS 228 CO 0.45 -0.39 0.32 0.54 0.10 0.00 0.00 175.35 176.37 1gkf s VAL 229 N -2.40 0.03 -0.11 1.79 0.11 -0.44 -5.01 120.40 114.37 1gkf s VAL 229 Ca -0.05 -0.25 0.01 0.00 -2.93 0.00 0.00 61.98 58.76 1gkf s VAL 229 Cb -0.01 -0.54 0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1gkf s VAL 229 CO -0.01 -0.14 -0.11 -0.47 -3.33 0.00 0.00 175.10 171.04 1gkf s TYR 230 N -0.59 1.74 -1.12 1.54 5.04 -1.26 -0.91 117.35 121.79 1gkf s TYR 230 Ca -0.07 -0.85 -0.17 0.00 -2.44 0.00 0.00 57.07 53.53 1gkf s TYR 230 Cb -0.04 -1.33 -0.02 0.00 0.35 0.00 0.00 41.96 40.92 1gkf s TYR 230 CO 0.02 -0.50 0.83 0.09 -1.34 0.00 0.00 175.55 174.65 1gkf n ASN 231 N 4.55 -5.67 -4.59 4.32 3.02 0.42 -4.90 115.26 112.41 1gkf n ASN 231 Ca -0.17 -0.94 -0.39 0.00 -0.03 0.00 0.00 54.58 53.05 1gkf n ASN 231 Cb 0.51 -3.82 0.04 0.00 -0.61 0.00 0.00 39.78 35.89 1gkf n ASN 231 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1gkf n PRO 232 N -3.96 0.97 0.24 3.52 -0.04 -1.26 -4.88 135.00 129.59 1gkf n PRO 232 Ca -0.09 0.37 0.16 0.00 -0.04 0.00 0.00 63.50 63.90 1gkf n PRO 232 Cb 0.60 -2.06 0.71 0.00 -0.04 0.00 0.00 33.50 32.71 1gkf n PRO 232 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1gkf h GLN 233 N 0.75 0.00 0.00 0.54 3.07 -1.94 -1.43 115.11 116.10 1gkf h GLN 233 Ca -0.47 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.26 1gkf h GLN 233 Cb 1.36 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.92 1gkf h GLN 233 CO 0.52 0.00 -0.05 0.66 0.09 0.00 0.00 178.83 180.05 1gkf h SER 234 N 0.00 0.00 0.00 0.06 4.64 -2.02 -3.46 113.55 112.76 1gkf h SER 234 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gkf h SER 234 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1gkf h SER 234 CO 0.00 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1gkf n GLY 235 N -0.08 0.86 3.42 -0.77 0.00 -0.54 -4.89 105.19 103.19 1gkf n GLY 235 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1gkf n GLY 235 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1gkf s TYR 236 N -3.42 0.01 -0.16 1.61 -0.85 -1.26 -0.60 117.35 112.68 1gkf s TYR 236 Ca 0.00 -0.36 -0.01 0.00 -0.52 0.00 0.00 57.07 56.19 1gkf s TYR 236 Cb 0.00 0.23 0.04 0.00 0.38 0.00 0.00 41.96 42.61 1gkf s TYR 236 CO 0.00 -0.80 -0.04 0.42 -1.52 0.00 0.00 175.55 173.61 1gkf s ILE 237 N -3.88 0.96 0.02 -3.49 1.01 0.15 -4.88 121.20 111.10 1gkf s ILE 237 Ca 0.10 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1gkf s ILE 237 Cb 0.01 -1.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 1gkf s ILE 237 CO -0.04 0.11 -0.18 0.00 0.00 0.00 0.00 174.94 174.83 1gkf s ALA 238 N 1.70 1.54 -0.14 9.38 0.00 -1.26 -0.35 121.76 132.62 1gkf s ALA 238 Ca 0.01 -0.89 -0.14 0.00 0.00 0.00 0.00 51.96 50.94 1gkf s ALA 238 Cb -0.15 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.68 1gkf s ALA 238 CO -0.07 0.35 0.39 1.21 0.00 0.00 0.00 175.76 177.64 1gkf s ASN 239 N -0.85 -0.40 -0.33 0.00 3.84 -0.32 -5.01 114.94 111.87 1gkf s ASN 239 Ca 0.06 0.76 0.17 0.00 0.21 0.00 0.00 52.86 54.06 1gkf s ASN 239 Cb -0.08 0.77 0.45 0.00 -0.55 0.00 0.00 41.25 41.85 1gkf s ASN 239 CO 0.01 -0.15 0.98 1.87 -2.79 0.00 0.00 177.10 177.02 1gkf n TRP 240 N 2.78 0.80 -1.53 0.43 -0.00 -1.26 -1.41 117.44 117.26 1gkf n TRP 240 Ca -0.14 -2.73 -0.07 0.00 -0.00 0.00 0.00 57.50 54.56 1gkf n TRP 240 Cb 0.57 -0.20 -0.02 0.00 -0.00 0.00 0.00 31.31 31.66 1gkf n TRP 240 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1gkf n ALA 241 N -0.10 -0.15 -1.98 5.87 0.00 -1.17 -4.67 120.51 118.30 1gkf n ALA 241 Ca 0.08 0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.41 1gkf n ALA 241 Cb 0.82 -1.07 0.06 0.00 0.00 0.00 0.00 19.45 19.26 1gkf n ALA 241 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1gkf s ASN 242 N -2.84 4.99 0.41 0.00 4.22 -1.26 -5.02 114.94 115.44 1gkf s ASN 242 Ca 0.00 -0.17 -0.27 0.00 -2.14 0.00 0.00 52.86 50.28 1gkf s ASN 242 Cb 0.00 -0.55 -0.10 0.00 1.28 0.00 0.00 41.25 41.88 1gkf s ASN 242 CO 0.00 -1.37 1.46 -0.55 -2.04 0.00 0.00 177.10 174.60 1gkf s SER 243 N -4.53 6.16 0.30 3.54 0.15 -1.26 -4.94 113.70 113.13 1gkf s SER 243 Ca 0.60 2.99 0.04 0.00 0.70 0.00 0.00 55.95 60.28 1gkf s SER 243 Cb -0.09 -2.66 0.49 0.00 -1.71 0.00 0.00 66.02 62.05 1gkf s SER 243 CO 0.40 -0.99 1.76 -0.65 1.20 0.00 0.00 173.24 174.96 1gkf h PRO 244 N 2.73 0.42 -1.69 5.44 0.11 -1.92 -3.48 132.00 133.62 1gkf h PRO 244 Ca -0.51 -0.15 0.07 0.00 0.11 0.00 0.00 66.00 65.52 1gkf h PRO 244 Cb 1.25 -0.03 -0.22 0.00 0.11 0.00 0.00 31.00 32.11 1gkf h PRO 244 CO 0.63 0.63 0.50 -1.14 -0.21 0.00 0.00 178.00 178.41 1gkf s GLN 245 N -4.53 0.67 0.18 1.05 0.74 -1.26 -4.99 119.66 111.52 1gkf s GLN 245 Ca -0.06 0.11 -0.33 0.00 0.05 0.00 0.00 55.36 55.12 1gkf s GLN 245 Cb 0.14 0.32 -0.14 0.00 1.10 0.00 0.00 33.01 34.43 1gkf s GLN 245 CO 0.78 -0.22 1.54 1.17 -0.55 0.00 0.00 175.29 178.00 1gkf n LYS 246 N 0.64 2.10 -0.99 1.67 3.00 -1.26 -1.87 118.16 121.44 1gkf n LYS 246 Ca -0.11 0.76 0.00 0.00 -0.00 0.00 0.00 58.31 58.95 1gkf n LYS 246 Cb 0.58 -2.50 0.00 0.00 0.00 0.00 0.00 35.03 33.11 1gkf n LYS 246 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1gkf n ASP 247 N 3.12 -3.17 -4.70 3.14 8.00 -1.26 -5.01 116.55 116.67 1gkf n ASP 247 Ca 0.16 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.26 1gkf n ASP 247 Cb 0.29 -0.95 -0.05 0.00 -0.02 0.00 0.00 41.12 40.39 1gkf n ASP 247 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1gkf s TYR 248 N -1.99 3.50 0.10 1.24 5.04 -0.78 -5.04 117.35 119.41 1gkf s TYR 248 Ca 0.00 1.15 -0.25 0.00 -2.44 0.00 0.00 57.07 55.53 1gkf s TYR 248 Cb 0.00 -2.82 -0.06 0.00 0.35 0.00 0.00 41.96 39.43 1gkf s TYR 248 CO 0.00 -0.02 0.77 -1.25 -1.34 0.00 0.00 175.55 173.71 1gkf s PRO 249 N 1.25 4.52 0.84 4.97 0.04 -1.26 -4.87 135.00 140.48 1gkf s PRO 249 Ca 0.35 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.38 1gkf s PRO 249 Cb -0.17 -3.32 0.09 0.00 0.04 0.00 0.00 34.50 31.15 1gkf s PRO 249 CO 0.15 0.41 1.10 0.00 0.04 0.00 0.00 177.00 178.69 1gkf s ALA 250 N -0.52 1.99 0.42 8.56 0.00 -1.26 -4.04 121.76 126.91 1gkf s ALA 250 Ca 0.37 -0.20 -0.18 0.00 0.00 0.00 0.00 51.96 51.95 1gkf s ALA 250 Cb -0.22 -3.12 -0.14 0.00 0.00 0.00 0.00 23.12 19.64 1gkf s ALA 250 CO 0.24 -1.98 -0.03 0.45 0.00 0.00 0.00 175.76 174.45 1gkf n SER 251 N -3.60 -3.06 -0.04 0.00 2.88 0.84 -4.22 113.62 106.42 1gkf n SER 251 Ca 0.07 0.67 0.14 0.00 -1.33 0.00 0.00 58.87 58.42 1gkf n SER 251 Cb 0.56 -0.80 0.79 0.00 -0.75 0.00 0.00 64.21 64.01 1gkf n SER 251 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1gkf n ASP 252 N 2.25 0.11 -4.70 -3.46 5.68 -1.26 -4.88 116.55 110.29 1gkf n ASP 252 Ca 0.09 -1.18 -0.43 0.00 -0.50 0.00 0.00 54.79 52.77 1gkf n ASP 252 Cb 0.41 -0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.35 1gkf n ASP 252 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1gkf n LEU 253 N -0.84 3.72 0.24 -2.12 4.77 -1.26 -4.86 117.00 116.66 1gkf n LEU 253 Ca 0.20 1.07 0.12 0.00 -0.03 0.00 0.00 56.01 57.37 1gkf n LEU 253 Cb 0.11 -1.53 0.73 0.00 -2.33 0.00 0.00 43.42 40.41 1gkf n LEU 253 CO 0.15 0.03 1.10 2.19 -1.33 0.00 0.00 177.39 179.53 1gkf h PHE 254 N 6.40 0.00 -0.41 -1.77 -5.15 -1.99 -1.77 116.94 112.26 1gkf h PHE 254 Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1gkf h PHE 254 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.39 1gkf h PHE 254 CO 0.63 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.94 1gkf n ALA 255 N -2.47 3.03 -3.86 12.09 0.00 -1.26 -4.83 120.51 123.21 1gkf n ALA 255 Ca -0.02 -1.08 -0.28 0.00 0.00 0.00 0.00 53.44 52.06 1gkf n ALA 255 Cb 0.15 -1.04 -0.17 0.00 0.00 0.00 0.00 19.45 18.40 1gkf n ALA 255 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1gkf s PHE 256 N -1.85 1.85 0.02 0.00 2.19 -0.67 -4.53 117.98 115.00 1gkf s PHE 256 Ca 0.34 -0.95 -0.00 0.00 0.33 0.00 0.00 56.93 56.65 1gkf s PHE 256 Cb 0.23 -1.40 -0.02 0.00 -1.31 0.00 0.00 43.02 40.52 1gkf s PHE 256 CO 0.14 -0.55 -0.02 -0.51 1.83 0.00 0.00 175.22 176.11 1gkf s LEU 257 N 1.39 2.23 -0.38 6.12 1.43 -1.26 -4.76 118.68 123.45 1gkf s LEU 257 Ca 0.01 -0.52 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 1gkf s LEU 257 Cb -0.13 0.13 0.09 0.00 0.03 0.00 0.00 46.19 46.30 1gkf s LEU 257 CO -0.07 -0.32 0.15 0.26 0.23 0.00 0.00 176.35 176.60 1gkf s TRP 258 N -1.63 3.46 0.00 0.29 0.51 -1.26 -5.03 118.94 115.29 1gkf s TRP 258 Ca -0.14 -2.12 0.00 0.00 -2.12 0.00 0.00 56.10 51.72 1gkf s TRP 258 Cb -0.09 -2.86 0.00 0.00 -0.81 0.00 0.00 33.47 29.71 1gkf s TRP 258 CO -0.02 -0.90 0.00 0.41 -0.51 0.00 0.00 176.95 175.93 1gkf n GLY 259 N 4.65 4.13 0.33 0.98 0.00 -1.26 -5.03 105.19 108.99 1gkf n GLY 259 Ca -0.06 -1.53 0.08 0.00 0.00 0.00 0.00 46.02 44.50 1gkf n GLY 259 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1gkf h GLY 260 N 0.00 0.56 -6.95 -0.02 0.00 -1.98 -3.36 103.07 91.33 1gkf h GLY 260 Ca 0.00 -0.19 -0.63 0.00 0.00 0.00 0.00 47.33 46.51 1gkf h GLY 260 CO 0.00 0.15 0.24 0.00 0.00 0.00 0.00 176.54 176.93 1gkf s ALA 261 N -5.44 3.38 -0.12 3.60 0.00 -1.26 -5.02 121.76 116.90 1gkf s ALA 261 Ca -0.08 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 50.87 1gkf s ALA 261 Cb 0.18 -3.32 0.04 0.00 0.00 0.00 0.00 23.12 20.03 1gkf s ALA 261 CO 0.74 -1.62 0.29 0.34 0.00 0.00 0.00 175.76 175.51 1gkf s ASP 262 N 1.94 -0.32 0.44 0.00 -1.08 -1.26 -4.94 116.67 111.44 1gkf s ASP 262 Ca 0.27 0.61 0.30 0.00 -0.52 0.00 0.00 52.55 53.22 1gkf s ASP 262 Cb -0.13 0.55 1.40 0.00 -1.46 0.00 0.00 42.92 43.28 1gkf s ASP 262 CO 0.18 -0.14 1.91 0.08 0.52 0.00 0.00 175.17 177.72 1gkf h ARG 263 N 6.51 0.00 0.00 4.34 0.11 -1.93 -2.43 114.38 120.98 1gkf h ARG 263 Ca -0.34 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.74 1gkf h ARG 263 Cb 1.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.25 1gkf h ARG 263 CO 0.34 0.00 -0.04 -0.24 0.10 0.00 0.00 179.97 180.13 1gkf h VAL 264 N 0.00 0.39 -0.09 0.08 3.04 -1.96 -1.16 116.25 116.54 1gkf h VAL 264 Ca 0.00 -0.19 0.03 0.00 -1.01 0.00 0.00 66.70 65.53 1gkf h VAL 264 Cb 0.29 1.13 -0.00 0.00 -2.01 0.00 0.00 31.29 30.70 1gkf h VAL 264 CO 0.00 0.04 0.07 0.74 -1.01 0.00 0.00 177.57 177.40 1gkf h THR 265 N 0.00 0.92 -0.48 3.17 2.02 -1.86 0.21 112.91 116.89 1gkf h THR 265 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 1gkf h THR 265 Cb 0.13 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1gkf h THR 265 CO 0.00 0.00 0.15 -0.33 0.37 0.00 0.00 175.52 175.72 1gkf h GLU 266 N 0.00 0.70 -0.14 6.66 4.39 -1.43 -1.16 114.58 123.59 1gkf h GLU 266 Ca 0.04 -0.11 -0.10 0.00 0.34 0.00 0.00 59.36 59.53 1gkf h GLU 266 Cb 0.18 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1gkf h GLU 266 CO -0.00 0.61 -0.28 0.82 -1.16 0.00 0.00 179.01 178.99 1gkf h ILE 267 N 0.69 1.37 -0.93 3.13 2.04 -1.12 -3.17 117.51 119.51 1gkf h ILE 267 Ca 0.16 -1.55 0.09 0.00 1.00 0.00 0.00 64.86 64.56 1gkf h ILE 267 Cb 0.20 2.02 -0.07 0.00 -0.74 0.00 0.00 36.82 38.22 1gkf h ILE 267 CO -0.01 0.46 0.58 0.44 0.00 0.00 0.00 178.15 179.62 1gkf h ASP 268 N 0.05 0.88 -0.73 1.72 3.32 -1.04 -0.87 116.42 119.75 1gkf h ASP 268 Ca 0.00 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.10 1gkf h ASP 268 Cb 0.88 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.24 1gkf h ASP 268 CO 0.06 0.52 0.47 0.03 -1.72 0.00 0.00 179.24 178.61 1gkf h ARG 269 N 0.99 0.92 -0.12 3.56 3.08 -1.27 -0.27 114.38 121.28 1gkf h ARG 269 Ca 0.43 -0.06 -0.19 0.00 0.07 0.00 0.00 59.98 60.23 1gkf h ARG 269 Cb 0.31 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1gkf h ARG 269 CO -0.22 0.61 -0.72 -0.07 -1.07 0.00 0.00 179.97 178.50 1gkf h LEU 270 N 0.95 0.64 -0.68 3.04 3.38 -1.30 -2.19 115.31 119.15 1gkf h LEU 270 Ca 0.28 -0.41 -0.14 0.00 0.09 0.00 0.00 57.88 57.70 1gkf h LEU 270 Cb -0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1gkf h LEU 270 CO -0.08 1.16 -0.55 -0.07 0.09 0.00 0.00 178.44 179.00 1gkf h LEU 271 N 0.38 0.35 -0.15 1.67 3.38 -0.66 -3.15 115.31 117.12 1gkf h LEU 271 Ca -0.03 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1gkf h LEU 271 Cb 1.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1gkf h LEU 271 CO 0.13 0.83 -0.30 -0.62 0.09 0.00 0.00 178.44 178.57 1gkf n GLU 272 N -3.92 0.31 -0.16 1.13 1.02 -0.16 -4.36 120.64 114.49 1gkf n GLU 272 Ca -0.02 -0.15 -0.05 0.00 -0.02 0.00 0.00 57.16 56.92 1gkf n GLU 272 Cb 0.59 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.55 1gkf n GLU 272 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1gkf h GLN 273 N 0.36 0.52 -6.21 3.49 4.15 -1.34 -3.42 115.11 112.66 1gkf h GLN 273 Ca 0.00 -0.03 -0.57 0.00 0.77 0.00 0.00 58.65 58.82 1gkf h GLN 273 Cb 0.48 -0.12 -0.20 0.00 0.21 0.00 0.00 27.48 27.84 1gkf h GLN 273 CO 0.00 0.35 -0.82 0.15 -1.93 0.00 0.00 178.83 176.58 1gkf s LYS 274 N -6.14 1.23 0.27 1.69 1.02 -1.26 -5.06 119.74 111.48 1gkf s LYS 274 Ca -0.13 -1.28 -0.01 0.00 0.02 0.00 0.00 55.97 54.57 1gkf s LYS 274 Cb 0.13 -1.46 0.53 0.00 -0.52 0.00 0.00 37.83 36.52 1gkf s LYS 274 CO 0.74 0.33 1.77 -1.35 -0.92 0.00 0.00 175.35 175.92 1gkf h PRO 275 N 3.75 0.66 -4.46 -1.68 0.11 -1.88 -3.44 132.00 125.06 1gkf h PRO 275 Ca -0.46 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 65.43 1gkf h PRO 275 Cb 1.19 -0.15 -0.16 0.00 0.11 0.00 0.00 31.00 31.99 1gkf h PRO 275 CO 0.43 0.44 -0.69 1.03 -0.21 0.00 0.00 178.00 179.00 1gkf s ARG 276 N -5.97 0.70 -0.06 1.05 0.52 -1.26 -4.72 118.95 109.21 1gkf s ARG 276 Ca -0.12 -1.21 0.04 0.00 -0.52 0.00 0.00 55.73 53.92 1gkf s ARG 276 Cb 0.22 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.64 1gkf s ARG 276 CO 0.78 -0.05 -0.18 -0.51 0.02 0.00 0.00 175.30 175.37 1gkf s LEU 277 N -2.80 1.89 0.86 2.53 1.02 -0.50 -4.84 118.68 116.85 1gkf s LEU 277 Ca 0.07 -0.39 -0.13 0.00 0.02 0.00 0.00 54.13 53.70 1gkf s LEU 277 Cb 0.04 -1.04 0.12 0.00 0.02 0.00 0.00 46.19 45.33 1gkf s LEU 277 CO -0.06 0.13 1.20 0.42 0.02 0.00 0.00 176.35 178.06 1gkf s THR 278 N 0.22 1.99 0.25 5.49 -4.23 -1.26 -0.52 115.64 117.58 1gkf s THR 278 Ca -0.09 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.37 1gkf s THR 278 Cb -0.14 -2.95 0.26 0.00 1.34 0.00 0.00 72.50 71.01 1gkf s THR 278 CO 0.04 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 176.04 1gkf h ALA 279 N -1.27 1.30 -0.52 3.99 0.00 -1.95 0.52 119.26 121.33 1gkf h ALA 279 Ca -0.46 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 1gkf h ALA 279 Cb 1.31 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1gkf h ALA 279 CO 0.59 0.64 -0.09 -0.44 0.00 0.00 0.00 179.25 179.95 1gkf h ASP 280 N 1.34 0.96 -0.45 0.00 3.32 -1.96 -0.34 116.42 119.28 1gkf h ASP 280 Ca 0.38 -0.30 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 1gkf h ASP 280 Cb -0.12 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.15 1gkf h ASP 280 CO -0.09 1.06 0.06 1.56 -1.72 0.00 0.00 179.24 180.11 1gkf h GLN 281 N 0.86 0.76 -0.83 3.56 4.20 -1.77 -1.19 115.11 120.70 1gkf h GLN 281 Ca 0.14 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1gkf h GLN 281 Cb 0.63 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 1gkf h GLN 281 CO 0.04 0.79 0.44 0.00 -0.67 0.00 0.00 178.83 179.43 1gkf h ALA 282 N 0.94 1.07 -0.57 3.87 0.00 -0.56 -2.42 119.26 121.59 1gkf h ALA 282 Ca 0.14 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1gkf h ALA 282 Cb 0.41 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1gkf h ALA 282 CO 0.01 0.60 0.03 2.35 0.00 0.00 0.00 179.25 182.24 1gkf h TRP 283 N 1.17 1.04 0.00 0.00 2.91 -0.89 -2.92 115.95 117.25 1gkf h TRP 283 Ca 0.29 -0.16 0.00 0.00 1.13 0.00 0.00 58.89 60.16 1gkf h TRP 283 Cb 0.06 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.43 1gkf h TRP 283 CO 0.01 0.91 0.00 -0.25 -1.03 0.00 0.00 178.44 178.08 1gkf n ASP 284 N -4.20 0.51 0.17 2.65 8.00 -0.46 -1.12 116.55 122.10 1gkf n ASP 284 Ca 0.03 0.66 0.05 0.00 0.71 0.00 0.00 54.79 56.24 1gkf n ASP 284 Cb 0.31 -0.76 0.48 0.00 -0.02 0.00 0.00 41.12 41.14 1gkf n ASP 284 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1gkf h VAL 285 N 0.00 1.12 0.47 2.53 2.07 -1.31 -1.81 116.25 119.32 1gkf h VAL 285 Ca 0.00 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1gkf h VAL 285 Cb 0.21 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1gkf h VAL 285 CO 0.00 0.17 -0.23 0.40 0.02 0.00 0.00 177.57 177.93 1gkf h ILE 286 N 0.13 0.54 -0.42 4.57 2.04 -1.29 -0.65 117.51 122.43 1gkf h ILE 286 Ca 0.03 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.92 1gkf h ILE 286 Cb 0.25 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 1gkf h ILE 286 CO 0.01 0.00 0.14 -0.09 0.00 0.00 0.00 178.15 178.22 1gkf h ARG 287 N -0.65 0.29 -0.10 2.37 2.43 -1.59 0.11 114.38 117.24 1gkf h ARG 287 Ca -0.06 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1gkf h ARG 287 Cb 0.49 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1gkf h ARG 287 CO 0.11 0.19 -0.05 1.96 -1.51 0.00 0.00 179.97 180.66 1gkf h GLN 288 N 0.30 0.21 -0.30 0.20 1.08 -1.28 -2.91 115.11 112.42 1gkf h GLN 288 Ca 0.19 -0.10 -0.02 0.00 -1.45 0.00 0.00 58.65 57.28 1gkf h GLN 288 Cb 0.19 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.60 1gkf h GLN 288 CO -0.21 0.58 0.08 1.79 -0.95 0.00 0.00 178.83 180.12 1gkf h THR 289 N -0.15 1.14 0.00 -0.54 1.35 -1.00 -1.97 112.91 111.73 1gkf h THR 289 Ca 0.02 -0.47 -0.01 0.00 -0.55 0.00 0.00 66.41 65.40 1gkf h THR 289 Cb 0.52 0.83 -0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1gkf h THR 289 CO 0.02 0.17 -0.04 0.77 -0.25 0.00 0.00 175.52 176.19 1gkf h SER 290 N 0.42 0.00 -0.15 5.36 4.64 -0.60 -2.96 113.55 120.26 1gkf h SER 290 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1gkf h SER 290 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1gkf h SER 290 CO -0.01 0.04 0.00 0.54 -0.87 0.00 0.00 176.83 176.54 1gkf n ARG 291 N -3.22 1.65 -2.89 4.77 1.74 -0.78 -0.80 116.66 117.13 1gkf n ARG 291 Ca -0.01 -1.68 -0.42 0.00 -0.77 0.00 0.00 57.85 54.98 1gkf n ARG 291 Cb 0.24 -1.33 -0.04 0.00 -1.02 0.00 0.00 32.46 30.31 1gkf n ARG 291 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1gkf s GLN 292 N -1.24 4.15 0.11 5.56 2.00 -0.95 -0.93 119.66 128.36 1gkf s GLN 292 Ca 0.23 0.90 -0.31 0.00 -2.00 0.00 0.00 55.36 54.18 1gkf s GLN 292 Cb 0.14 -3.66 -0.09 0.00 0.80 0.00 0.00 33.01 30.20 1gkf s GLN 292 CO 0.21 -0.55 1.61 0.34 -0.50 0.00 0.00 175.29 176.40 1gkf s ASP 293 N 1.38 6.60 0.08 6.67 -1.08 0.36 -4.89 116.67 125.79 1gkf s ASP 293 Ca 0.35 2.54 0.25 0.00 -0.52 0.00 0.00 52.55 55.18 1gkf s ASP 293 Cb -0.15 -2.58 0.60 0.00 -1.46 0.00 0.00 42.92 39.33 1gkf s ASP 293 CO 0.08 -0.85 1.51 0.18 0.52 0.00 0.00 175.17 176.60 1gkf n LEU 294 N 4.83 0.55 -0.01 -1.34 4.77 -1.26 -4.07 117.00 120.47 1gkf n LEU 294 Ca 0.15 0.26 0.04 0.00 -0.03 0.00 0.00 56.01 56.43 1gkf n LEU 294 Cb 0.40 -0.27 -0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1gkf n LEU 294 CO 0.62 -0.01 -0.68 0.59 -1.33 0.00 0.00 177.39 176.58 1gkf n ASN 295 N -1.86 0.25 -0.06 -1.43 3.02 -1.26 -4.49 115.26 109.43 1gkf n ASN 295 Ca 0.05 0.10 -0.08 0.00 -0.03 0.00 0.00 54.58 54.63 1gkf n ASN 295 Cb 0.39 1.25 -0.02 0.00 -0.61 0.00 0.00 39.78 40.80 1gkf n ASN 295 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1gkf h LEU 296 N 0.00 -0.24 -1.19 3.41 5.85 -1.98 -1.87 115.31 119.29 1gkf h LEU 296 Ca -0.16 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1gkf h LEU 296 Cb 1.40 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.56 1gkf h LEU 296 CO 0.02 -0.08 0.36 -0.09 -0.34 0.00 0.00 178.44 178.30 1gkf h ARG 297 N -0.00 0.92 -0.31 1.25 2.43 -1.82 -0.85 114.38 115.99 1gkf h ARG 297 Ca 0.12 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1gkf h ARG 297 Cb 0.18 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1gkf h ARG 297 CO -0.26 0.68 -0.11 -0.07 -1.51 0.00 0.00 179.97 178.70 1gkf h LEU 298 N 0.93 0.64 0.00 3.80 3.38 -1.59 -3.38 115.31 119.08 1gkf h LEU 298 Ca 0.24 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1gkf h LEU 298 Cb 0.03 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1gkf h LEU 298 CO -0.04 0.88 -1.14 0.49 0.09 0.00 0.00 178.44 178.72 1gkf n PHE 299 N -4.42 0.00 -0.14 1.13 3.72 -0.84 -4.62 117.46 112.29 1gkf n PHE 299 Ca -0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.33 1gkf n PHE 299 Cb 0.35 -0.16 0.04 0.00 -0.94 0.00 0.00 39.48 38.77 1gkf n PHE 299 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1gkf h LEU 300 N 0.00 0.20 -0.94 4.37 5.85 -1.34 -1.38 115.31 122.07 1gkf h LEU 300 Ca 0.00 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.79 1gkf h LEU 300 Cb 0.47 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1gkf h LEU 300 CO 0.00 0.15 0.61 -0.65 -0.34 0.00 0.00 178.44 178.21 1gkf h PRO 301 N 0.35 1.18 -0.64 5.25 0.11 -1.81 0.43 132.00 136.87 1gkf h PRO 301 Ca 0.21 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.23 1gkf h PRO 301 Cb 0.19 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 1gkf h PRO 301 CO -0.20 0.78 0.33 1.15 -0.21 0.00 0.00 178.00 179.85 1gkf h THR 302 N 1.21 1.21 -0.44 -1.15 2.02 -1.70 -0.70 112.91 113.37 1gkf h THR 302 Ca 0.36 -0.56 -0.13 0.00 0.77 0.00 0.00 66.41 66.85 1gkf h THR 302 Cb -0.05 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1gkf h THR 302 CO -0.11 0.24 -0.25 -0.07 0.37 0.00 0.00 175.52 175.70 1gkf h LEU 303 N 0.87 0.94 -0.28 2.58 3.38 -0.59 -1.64 115.31 120.58 1gkf h LEU 303 Ca 0.22 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 1gkf h LEU 303 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1gkf h LEU 303 CO -0.03 1.13 -0.11 1.56 0.09 0.00 0.00 178.44 181.08 1gkf h GLN 304 N 0.78 0.57 -0.70 1.13 4.20 -0.69 -2.59 115.11 117.80 1gkf h GLN 304 Ca 0.10 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1gkf h GLN 304 Cb 0.81 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 1gkf h GLN 304 CO 0.07 0.80 0.28 0.00 -0.67 0.00 0.00 178.83 179.31 1gkf h ALA 305 N 0.75 0.92 -0.06 3.87 0.00 -1.00 -1.53 119.26 122.21 1gkf h ALA 305 Ca 0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1gkf h ALA 305 Cb 0.62 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1gkf h ALA 305 CO 0.04 0.54 -0.34 0.00 0.00 0.00 0.00 179.25 179.49 1gkf h ALA 306 N 1.13 1.33 -0.09 0.00 0.00 -1.22 -3.05 119.26 117.37 1gkf h ALA 306 Ca 0.23 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1gkf h ALA 306 Cb 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1gkf h ALA 306 CO -0.02 0.48 0.00 0.25 0.00 0.00 0.00 179.25 179.96 1gkf n THR 307 N -4.11 0.10 0.15 0.00 -2.24 -0.99 -4.64 114.28 102.55 1gkf n THR 307 Ca -0.02 -0.55 0.06 0.00 -2.27 0.00 0.00 64.05 61.28 1gkf n THR 307 Cb 0.40 1.33 0.55 0.00 -2.10 0.00 0.00 70.33 70.51 1gkf n THR 307 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1gkf h SER 308 N 3.96 0.20 -0.69 3.42 4.64 -1.17 -2.40 113.55 121.52 1gkf h SER 308 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1gkf h SER 308 Cb 0.85 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1gkf h SER 308 CO 0.00 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 1gkf n GLY 309 N -1.50 2.69 3.87 -0.77 0.00 -1.26 -4.98 105.19 103.24 1gkf n GLY 309 Ca -0.00 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 1gkf n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gkf s LEU 310 N -1.67 3.51 0.73 0.99 1.43 -0.91 -5.05 118.68 117.72 1gkf s LEU 310 Ca 0.52 1.35 -0.11 0.00 -1.03 0.00 0.00 54.13 54.86 1gkf s LEU 310 Cb 0.32 -4.33 0.03 0.00 0.03 0.00 0.00 46.19 42.25 1gkf s LEU 310 CO 0.27 -0.66 1.07 0.42 0.23 0.00 0.00 176.35 177.68 1gkf s THR 311 N -2.81 3.71 0.42 5.49 -4.23 -1.26 -4.94 115.64 112.01 1gkf s THR 311 Ca 0.55 0.55 0.08 0.00 -1.18 0.00 0.00 61.69 61.69 1gkf s THR 311 Cb -0.10 -3.23 0.26 0.00 1.34 0.00 0.00 72.50 70.76 1gkf s THR 311 CO 0.42 -0.72 2.06 -0.61 -0.54 0.00 0.00 174.62 175.22 1gkf h GLN 312 N -0.88 0.45 -0.01 3.99 -0.00 -2.00 -1.92 115.11 114.74 1gkf h GLN 312 Ca -0.44 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 1gkf h GLN 312 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 27.48 28.61 1gkf h GLN 312 CO 0.56 0.32 -0.01 -1.13 0.00 0.00 0.00 178.83 178.57 1gkf n SER 313 N -4.46 0.56 -4.68 -0.69 3.41 -1.26 -4.75 113.62 101.74 1gkf n SER 313 Ca 0.02 -1.14 -0.42 0.00 -0.26 0.00 0.00 58.87 57.07 1gkf n SER 313 Cb 0.08 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 1gkf n SER 313 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1gkf s ASP 314 N -2.04 7.04 0.42 4.04 -1.08 -0.72 -4.91 116.67 119.42 1gkf s ASP 314 Ca 0.43 1.79 0.13 0.00 -0.52 0.00 0.00 52.55 54.38 1gkf s ASP 314 Cb 0.21 -2.55 0.92 0.00 -1.46 0.00 0.00 42.92 40.04 1gkf s ASP 314 CO 0.37 -0.61 1.95 1.55 0.52 0.00 0.00 175.17 178.95 1gkf h PRO 315 N 7.57 0.05 -0.64 4.34 0.13 -1.89 -1.78 132.00 139.78 1gkf h PRO 315 Ca -0.33 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.72 1gkf h PRO 315 Cb 1.15 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 1gkf h PRO 315 CO 0.89 0.25 0.12 0.00 -0.23 0.00 0.00 178.00 179.04 1gkf h ARG 316 N 0.04 1.02 -0.34 0.86 3.08 -1.91 -1.41 114.38 115.73 1gkf h ARG 316 Ca 0.01 -0.25 -0.09 0.00 0.07 0.00 0.00 59.98 59.72 1gkf h ARG 316 Cb 0.38 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1gkf h ARG 316 CO 0.03 0.93 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.62 1gkf h ARG 317 N 0.97 0.70 0.00 0.04 2.43 -1.72 -2.99 114.38 113.80 1gkf h ARG 317 Ca 0.20 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1gkf h ARG 317 Cb 0.39 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1gkf h ARG 317 CO 0.01 0.90 0.00 1.04 -1.51 0.00 0.00 179.97 180.40 1gkf n GLN 318 N -4.35 0.19 -0.08 0.20 1.13 -0.73 -0.33 117.38 113.41 1gkf n GLN 318 Ca -0.02 0.27 -0.14 0.00 -1.94 0.00 0.00 57.00 55.17 1gkf n GLN 318 Cb 0.38 -1.78 -0.05 0.00 0.11 0.00 0.00 30.24 28.90 1gkf n GLN 318 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1gkf h LEU 319 N 0.00 0.69 -0.51 1.08 3.38 -1.22 -2.07 115.31 116.66 1gkf h LEU 319 Ca 0.00 -0.49 -0.11 0.00 0.09 0.00 0.00 57.88 57.37 1gkf h LEU 319 Cb 0.54 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1gkf h LEU 319 CO 0.00 1.04 -0.11 0.58 0.09 0.00 0.00 178.44 180.05 1gkf h VAL 320 N 0.35 1.27 -0.40 1.22 2.07 -1.22 -2.46 116.25 117.08 1gkf h VAL 320 Ca 0.03 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 1gkf h VAL 320 Cb 0.87 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1gkf h VAL 320 CO 0.07 0.44 0.20 -0.33 0.02 0.00 0.00 177.57 177.96 1gkf h GLU 321 N 0.83 0.54 -0.42 1.57 4.39 -0.60 0.14 114.58 121.02 1gkf h GLU 321 Ca 0.13 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1gkf h GLU 321 Cb 0.67 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 1gkf h GLU 321 CO 0.05 0.42 0.24 1.15 -1.16 0.00 0.00 179.01 179.71 1gkf h THR 322 N 0.55 1.15 -0.56 1.13 2.02 -1.15 -2.69 112.91 113.35 1gkf h THR 322 Ca 0.14 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 1gkf h THR 322 Cb 0.05 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 1gkf h THR 322 CO -0.02 0.15 0.05 -0.07 0.37 0.00 0.00 175.52 176.00 1gkf h LEU 323 N 0.55 0.88 -1.45 2.58 3.38 -0.84 -3.12 115.31 117.29 1gkf h LEU 323 Ca 0.15 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1gkf h LEU 323 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1gkf h LEU 323 CO -0.03 0.91 -0.11 0.74 0.09 0.00 0.00 178.44 180.04 1gkf h THR 324 N 0.86 1.16 0.00 0.22 2.02 -0.45 -1.26 112.91 115.46 1gkf h THR 324 Ca 0.17 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1gkf h THR 324 Cb 0.44 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1gkf h THR 324 CO 0.02 0.22 0.00 0.54 0.37 0.00 0.00 175.52 176.67 1gkf n ARG 325 N -4.30 0.15 -4.16 6.66 1.74 -1.06 -4.84 116.66 110.84 1gkf n ARG 325 Ca -0.01 0.08 -0.34 0.00 -0.77 0.00 0.00 57.85 56.81 1gkf n ARG 325 Cb 0.25 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.11 1gkf n ARG 325 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1gkf s TRP 326 N -2.82 3.28 -2.39 -1.55 -0.00 -0.48 -5.01 118.94 109.97 1gkf s TRP 326 Ca 0.16 0.24 0.24 0.00 -0.00 0.00 0.00 56.10 56.74 1gkf s TRP 326 Cb 0.16 -1.78 0.86 0.00 -0.00 0.00 0.00 33.47 32.71 1gkf s TRP 326 CO 0.40 0.55 1.62 -0.40 -0.00 0.00 0.00 176.95 179.12 1gkf n ASP 327 N 1.59 1.68 0.00 5.86 5.68 -1.26 -4.93 116.55 125.17 1gkf n ASP 327 Ca -0.16 -1.63 0.00 0.00 -0.50 0.00 0.00 54.79 52.50 1gkf n ASP 327 Cb 0.53 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 1gkf n ASP 327 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gkf n GLY 328 N 1.17 0.76 3.64 6.12 0.00 -1.26 -4.90 105.19 110.73 1gkf n GLY 328 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1gkf n GLY 328 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gkf s ILE 329 N -3.02 4.85 0.09 -0.61 -1.09 -1.26 -0.49 121.20 119.67 1gkf s ILE 329 Ca 0.00 1.55 -0.24 0.00 -2.23 0.00 0.00 60.65 59.73 1gkf s ILE 329 Cb 0.00 -4.11 -0.07 0.00 -1.58 0.00 0.00 42.46 36.71 1gkf s ILE 329 CO 0.00 -0.06 0.72 0.20 -1.23 0.00 0.00 174.94 174.57 1gkf s ASN 330 N 1.33 7.23 -0.01 3.58 0.01 -0.11 -4.97 114.94 122.01 1gkf s ASN 330 Ca 0.35 1.47 0.02 0.00 -0.71 0.00 0.00 52.86 53.98 1gkf s ASN 330 Cb -0.15 -2.45 -0.00 0.00 0.41 0.00 0.00 41.25 39.05 1gkf s ASN 330 CO 0.08 0.14 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.99 1gkf s LEU 331 N -0.67 1.95 0.36 0.60 1.43 -1.26 -4.84 118.68 116.25 1gkf s LEU 331 Ca 0.35 -0.11 -0.27 0.00 -1.03 0.00 0.00 54.13 53.08 1gkf s LEU 331 Cb -0.21 -0.32 -0.09 0.00 0.03 0.00 0.00 46.19 45.60 1gkf s LEU 331 CO 0.23 0.06 1.18 -0.76 0.23 0.00 0.00 176.35 177.29 1gkf s LEU 332 N -0.05 4.31 1.12 1.79 1.43 -1.26 -1.02 118.68 125.00 1gkf s LEU 332 Ca 0.01 2.38 -0.16 0.00 -1.03 0.00 0.00 54.13 55.34 1gkf s LEU 332 Cb -0.03 -3.87 0.25 0.00 0.03 0.00 0.00 46.19 42.56 1gkf s LEU 332 CO -0.00 -0.53 1.09 0.20 0.23 0.00 0.00 176.35 177.34 1gkf s ASN 333 N -0.97 1.61 0.58 2.29 0.01 0.72 -4.71 114.94 114.47 1gkf s ASN 333 Ca 0.53 0.93 0.36 0.00 -0.71 0.00 0.00 52.86 53.97 1gkf s ASN 333 Cb -0.32 -1.41 1.73 0.00 0.41 0.00 0.00 41.25 41.66 1gkf s ASN 333 CO 0.41 -3.73 2.13 0.44 -1.51 0.00 0.00 177.10 174.84 1gkf h ASP 334 N -2.31 0.00 0.58 -1.22 3.32 -1.97 -2.22 116.42 112.60 1gkf h ASP 334 Ca -0.51 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.54 1gkf h ASP 334 Cb 1.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.87 1gkf h ASP 334 CO 0.46 0.02 -0.03 -2.24 -1.72 0.00 0.00 179.24 175.74 1gkf h ASP 335 N 0.00 0.00 -1.09 6.45 3.04 -1.92 -3.47 116.42 119.43 1gkf h ASP 335 Ca -0.00 0.00 -0.20 0.00 -3.24 0.00 0.00 57.03 53.59 1gkf h ASP 335 Cb 0.32 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.58 1gkf h ASP 335 CO 0.00 0.03 -0.23 0.61 -2.04 0.00 0.00 179.24 177.61 1gkf n GLY 336 N -0.44 0.35 0.00 7.15 0.00 -0.84 -4.81 105.19 106.61 1gkf n GLY 336 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1gkf n GLY 336 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gkf n LYS 337 N -2.20 0.22 -4.45 1.61 4.76 -1.26 -4.88 118.16 111.96 1gkf n LYS 337 Ca -0.11 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.08 1gkf n LYS 337 Cb 0.50 -0.64 -0.11 0.00 -1.84 0.00 0.00 35.03 32.94 1gkf n LYS 337 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1gkf s THR 338 N -1.28 2.43 0.24 -0.18 -4.23 -1.26 -1.25 115.64 110.11 1gkf s THR 338 Ca 0.00 -2.27 -0.15 0.00 -1.18 0.00 0.00 61.69 58.10 1gkf s THR 338 Cb 0.00 -2.23 -0.08 0.00 1.34 0.00 0.00 72.50 71.53 1gkf s THR 338 CO 0.00 -0.29 0.65 0.26 -0.54 0.00 0.00 174.62 174.70 1gkf s TRP 339 N -2.19 3.50 0.32 3.99 0.51 -0.05 -0.20 118.94 124.81 1gkf s TRP 339 Ca 0.26 1.15 0.03 0.00 -2.12 0.00 0.00 56.10 55.42 1gkf s TRP 339 Cb -0.06 -2.46 0.53 0.00 -0.81 0.00 0.00 33.47 30.67 1gkf s TRP 339 CO 0.13 0.26 1.84 1.96 -0.51 0.00 0.00 176.95 180.63 1gkf h GLN 340 N 2.86 0.58 -6.81 4.98 4.20 -1.36 -3.38 115.11 116.18 1gkf h GLN 340 Ca -0.48 -0.14 -0.68 0.00 0.06 0.00 0.00 58.65 57.42 1gkf h GLN 340 Cb 1.18 -0.08 -0.20 0.00 0.30 0.00 0.00 27.48 28.68 1gkf h GLN 340 CO 0.66 0.61 -0.84 -0.65 -0.67 0.00 0.00 178.83 177.94 1gkf s GLN 341 N -4.94 1.54 0.00 1.46 -1.52 -1.26 -5.00 119.66 109.93 1gkf s GLN 341 Ca -0.08 -1.32 0.18 0.00 -1.95 0.00 0.00 55.36 52.19 1gkf s GLN 341 Cb 0.15 -1.96 0.52 0.00 -0.22 0.00 0.00 33.01 31.50 1gkf s GLN 341 CO 0.78 0.45 1.43 -0.35 -0.25 0.00 0.00 175.29 177.35 1gkf n PRO 342 N 0.78 2.35 -0.17 2.91 -0.04 -1.26 -4.58 135.00 134.99 1gkf n PRO 342 Ca -0.16 -2.10 -0.01 0.00 -0.04 0.00 0.00 63.50 61.18 1gkf n PRO 342 Cb 0.53 -1.45 0.23 0.00 -0.04 0.00 0.00 33.50 32.77 1gkf n PRO 342 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1gkf h GLY 343 N 4.72 0.97 1.12 0.55 0.00 -1.96 -1.74 103.07 106.74 1gkf h GLY 343 Ca 0.00 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1gkf h GLY 343 CO 0.00 0.43 0.17 1.76 0.00 0.00 0.00 176.54 178.89 1gkf h SER 344 N 0.91 1.02 -0.55 0.19 0.02 -1.98 0.08 113.55 113.24 1gkf h SER 344 Ca 0.23 -0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 1gkf h SER 344 Cb 0.07 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 1gkf h SER 344 CO -0.03 0.98 0.09 0.00 -1.14 0.00 0.00 176.83 176.73 1gkf h ALA 345 N 1.14 0.73 -0.31 3.77 0.00 -1.72 0.12 119.26 123.00 1gkf h ALA 345 Ca 0.22 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1gkf h ALA 345 Cb 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1gkf h ALA 345 CO 0.00 0.48 0.18 0.82 0.00 0.00 0.00 179.25 180.73 1gkf h ILE 346 N 0.81 1.05 -0.47 0.00 2.04 -1.03 -1.64 117.51 118.26 1gkf h ILE 346 Ca 0.17 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 1gkf h ILE 346 Cb 0.41 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1gkf h ILE 346 CO 0.01 0.07 0.26 -0.07 0.00 0.00 0.00 178.15 178.42 1gkf h LEU 347 N 0.38 0.58 0.12 1.44 3.38 -0.83 -1.04 115.31 119.34 1gkf h LEU 347 Ca 0.12 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1gkf h LEU 347 Cb -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1gkf h LEU 347 CO -0.05 0.49 -0.06 -1.13 0.09 0.00 0.00 178.44 177.79 1gkf h ASN 348 N 0.62 -0.13 -0.38 -0.43 -1.24 -0.59 0.22 115.58 113.65 1gkf h ASN 348 Ca 0.17 -0.02 -0.00 0.00 0.71 0.00 0.00 56.30 57.15 1gkf h ASN 348 Cb 0.04 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.10 1gkf h ASN 348 CO -0.03 -0.06 0.24 0.58 -1.29 0.00 0.00 177.43 176.86 1gkf h VAL 349 N -0.19 1.12 -0.32 2.57 2.07 -1.23 0.07 116.25 120.34 1gkf h VAL 349 Ca -0.02 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1gkf h VAL 349 Cb 0.15 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1gkf h VAL 349 CO 0.03 0.12 0.10 -0.25 0.02 0.00 0.00 177.57 177.58 1gkf h TRP 350 N 0.50 0.52 -0.56 1.57 7.01 -1.08 -1.91 115.95 122.01 1gkf h TRP 350 Ca 0.14 -0.05 -0.07 0.00 2.11 0.00 0.00 58.89 61.01 1gkf h TRP 350 Cb -0.01 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 26.88 1gkf h TRP 350 CO -0.04 0.52 0.06 1.25 -2.79 0.00 0.00 178.44 177.44 1gkf h LEU 351 N 0.36 0.91 -0.65 0.65 5.85 -0.40 0.18 115.31 122.22 1gkf h LEU 351 Ca 0.10 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.56 1gkf h LEU 351 Cb 0.25 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1gkf h LEU 351 CO -0.00 0.96 0.41 0.74 -0.34 0.00 0.00 178.44 180.21 1gkf h THR 352 N 0.83 1.12 -0.32 1.05 2.02 -0.91 0.31 112.91 117.02 1gkf h THR 352 Ca 0.17 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1gkf h THR 352 Cb 0.46 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1gkf h THR 352 CO 0.02 0.15 0.11 -1.28 0.37 0.00 0.00 175.52 174.89 1gkf h SER 353 N 0.83 0.45 -0.64 4.18 0.87 -0.90 -2.07 113.55 116.26 1gkf h SER 353 Ca 0.25 -0.19 0.04 0.00 -1.23 0.00 0.00 61.79 60.65 1gkf h SER 353 Cb -0.03 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.76 1gkf h SER 353 CO -0.08 0.52 0.39 0.24 -0.53 0.00 0.00 176.83 177.37 1gkf h MET 354 N 0.36 0.73 -0.55 2.24 2.07 -0.26 -1.82 114.93 117.69 1gkf h MET 354 Ca 0.10 -0.04 -0.11 0.00 -2.07 0.00 0.00 59.70 57.58 1gkf h MET 354 Cb 0.22 -0.16 -0.02 0.00 -1.87 0.00 0.00 31.60 29.77 1gkf h MET 354 CO -0.01 0.48 -0.10 -0.07 1.07 0.00 0.00 176.91 178.29 1gkf h LEU 355 N 0.75 1.04 -1.07 1.22 3.38 -0.82 -1.36 115.31 118.45 1gkf h LEU 355 Ca 0.27 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1gkf h LEU 355 Cb 0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1gkf h LEU 355 CO -0.12 1.14 0.30 0.50 0.09 0.00 0.00 178.44 180.34 1gkf h LYS 356 N 0.93 0.96 0.00 1.13 3.64 -1.06 -1.25 116.57 120.92 1gkf h LYS 356 Ca 0.15 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1gkf h LYS 356 Cb 0.67 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1gkf h LYS 356 CO 0.05 0.76 -0.16 0.00 -2.27 0.00 0.00 179.45 177.83 1gkf h ARG 357 N 0.95 0.00 0.00 1.90 3.08 -0.87 -3.22 114.38 116.22 1gkf h ARG 357 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1gkf h ARG 357 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1gkf h ARG 357 CO -0.03 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.12 1gkf n THR 358 N -2.77 0.00 -0.13 2.04 -2.24 -0.55 -4.68 114.28 105.95 1gkf n THR 358 Ca 0.04 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.73 1gkf n THR 358 Cb 0.50 -0.07 -0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1gkf n THR 358 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1gkf h VAL 359 N 0.00 1.15 -0.59 2.28 2.07 -1.74 -1.96 116.25 117.45 1gkf h VAL 359 Ca 0.00 -0.39 0.05 0.00 0.82 0.00 0.00 66.70 67.18 1gkf h VAL 359 Cb 0.00 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 1gkf h VAL 359 CO 0.00 0.16 0.32 0.58 0.02 0.00 0.00 177.57 178.65 1gkf h VAL 360 N 0.51 0.97 0.00 2.57 2.07 -1.47 -1.82 116.25 119.08 1gkf h VAL 360 Ca 0.14 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1gkf h VAL 360 Cb 0.06 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1gkf h VAL 360 CO -0.02 0.11 -0.00 0.00 0.02 0.00 0.00 177.57 177.68 1gkf h ALA 361 N 1.31 1.00 0.00 1.67 0.00 -1.38 -2.58 119.26 119.28 1gkf h ALA 361 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1gkf h ALA 361 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1gkf h ALA 361 CO -0.16 0.00 -0.50 0.00 0.00 0.00 0.00 179.25 178.58 1gkf n ALA 362 N -2.09 3.27 -2.79 0.00 0.00 -0.71 -4.87 120.51 113.33 1gkf n ALA 362 Ca -0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.80 1gkf n ALA 362 Cb 0.26 -1.16 -0.11 0.00 0.00 0.00 0.00 19.45 18.45 1gkf n ALA 362 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gkf s VAL 363 N -3.05 4.11 0.55 0.00 1.01 -0.97 -5.08 120.40 116.97 1gkf s VAL 363 Ca 0.10 -0.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.56 1gkf s VAL 363 Cb 0.16 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1gkf s VAL 363 CO 0.69 0.54 1.35 -2.16 0.00 0.00 0.00 175.10 175.53 1gkf s PRO 364 N -0.23 3.09 0.42 2.72 0.04 -1.26 -4.18 135.00 135.59 1gkf s PRO 364 Ca 0.05 2.21 -0.24 0.00 0.04 0.00 0.00 61.00 63.06 1gkf s PRO 364 Cb -0.13 -2.22 -0.08 0.00 0.04 0.00 0.00 34.50 32.11 1gkf s PRO 364 CO 0.02 -1.22 1.13 -1.64 0.04 0.00 0.00 177.00 175.33 1gkf s MET 365 N -2.95 4.00 0.00 4.56 -1.94 -1.26 -1.47 119.30 120.24 1gkf s MET 365 Ca 0.73 1.73 0.20 0.00 -1.71 0.00 0.00 55.69 56.63 1gkf s MET 365 Cb -0.40 -2.56 0.55 0.00 2.01 0.00 0.00 34.83 34.42 1gkf s MET 365 CO 0.47 -0.33 1.46 -0.35 -0.01 0.00 0.00 175.02 176.25 1gkf n PRO 366 N -0.12 2.42 0.24 2.03 -0.04 -1.26 -4.88 135.00 133.39 1gkf n PRO 366 Ca 0.05 -2.20 0.12 0.00 -0.04 0.00 0.00 63.50 61.44 1gkf n PRO 366 Cb 0.48 -1.48 0.58 0.00 -0.04 0.00 0.00 33.50 33.04 1gkf n PRO 366 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1gkf h PHE 367 N 3.68 0.00 -0.61 0.54 0.04 -1.58 -2.98 116.94 116.02 1gkf h PHE 367 Ca 0.00 0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.90 1gkf h PHE 367 Cb 0.84 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.95 1gkf h PHE 367 CO 0.38 0.16 0.42 0.38 -0.60 0.00 0.00 178.31 179.05 1gkf h ASP 368 N 0.00 0.27 0.48 2.17 2.03 -1.63 -0.78 116.42 118.96 1gkf h ASP 368 Ca -0.00 0.01 -0.00 0.00 -0.73 0.00 0.00 57.03 56.31 1gkf h ASP 368 Cb 0.59 -0.04 -0.00 0.00 -0.83 0.00 0.00 39.33 39.04 1gkf h ASP 368 CO 0.02 0.15 -0.01 0.11 -1.03 0.00 0.00 179.24 178.48 1gkf h LYS 369 N 0.29 0.00 0.00 4.15 1.57 -1.86 -1.91 116.57 118.81 1gkf h LYS 369 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1gkf h LYS 369 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1gkf h LYS 369 CO -0.07 0.01 0.00 -1.49 -0.57 0.00 0.00 179.45 177.33 1gkf h TRP 370 N 0.00 0.00 -0.06 -1.35 6.55 -1.35 -3.14 115.95 116.61 1gkf h TRP 370 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1gkf h TRP 370 Cb 0.26 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.56 1gkf h TRP 370 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1gkf n TYR 371 N -2.66 0.07 0.22 0.49 4.01 -0.72 -4.62 117.16 113.96 1gkf n TYR 371 Ca -0.00 -0.20 0.12 0.00 -0.16 0.00 0.00 57.90 57.65 1gkf n TYR 371 Cb 0.17 -0.02 0.03 0.00 -0.31 0.00 0.00 39.34 39.22 1gkf n TYR 371 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1gkf h SER 372 N 0.80 0.00 -3.86 7.72 4.64 -1.53 -3.40 113.55 117.92 1gkf h SER 372 Ca 0.00 -0.06 -0.50 0.00 -0.47 0.00 0.00 61.79 60.75 1gkf h SER 372 Cb 0.34 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.46 1gkf h SER 372 CO 0.00 0.03 0.47 0.00 -0.87 0.00 0.00 176.83 176.47 1gkf s ALA 373 N -3.32 3.31 -0.45 5.18 0.00 -1.26 -4.84 121.76 120.38 1gkf s ALA 373 Ca 0.01 0.88 0.23 0.00 0.00 0.00 0.00 51.96 53.09 1gkf s ALA 373 Cb 0.11 -3.33 0.20 0.00 0.00 0.00 0.00 23.12 20.10 1gkf s ALA 373 CO 0.78 -0.24 1.24 0.66 0.00 0.00 0.00 175.76 178.19 1gkf h SER 374 N 3.37 0.00 0.00 0.00 4.64 -1.91 -3.42 113.55 116.22 1gkf h SER 374 Ca -0.47 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 1gkf h SER 374 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1gkf h SER 374 CO 0.65 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 1gkf n GLY 375 N 1.24 0.33 0.05 -0.77 0.00 -1.26 -4.40 105.19 100.38 1gkf n GLY 375 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.12 1gkf n GLY 375 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1gkf n TYR 376 N -1.99 0.33 -1.62 1.61 4.02 -1.26 -4.68 117.16 113.55 1gkf n TYR 376 Ca 0.00 0.10 -0.48 0.00 -0.01 0.00 0.00 57.90 57.51 1gkf n TYR 376 Cb 0.00 -0.71 -0.04 0.00 -0.02 0.00 0.00 39.34 38.57 1gkf n TYR 376 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1gkf n GLU 377 N -2.46 1.60 -4.01 -0.72 4.71 -1.26 -4.98 120.64 113.51 1gkf n GLU 377 Ca -0.06 0.57 -0.10 0.00 -0.01 0.00 0.00 57.16 57.56 1gkf n GLU 377 Cb 0.64 -2.22 -0.05 0.00 -1.01 0.00 0.00 31.44 28.80 1gkf n GLU 377 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1gkf s THR 378 N 0.33 0.00 0.00 2.62 -4.23 -1.26 -4.92 115.64 108.18 1gkf s THR 378 Ca 0.77 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 1gkf s THR 378 Cb -0.80 -2.29 0.00 0.00 1.34 0.00 0.00 72.50 70.75 1gkf s THR 378 CO 0.46 0.00 0.00 0.35 -0.54 0.00 0.00 174.62 174.89 1gkf n THR 379 N -0.40 0.00 0.10 3.99 -2.24 -1.26 -5.00 114.28 109.47 1gkf n THR 379 Ca -0.01 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.75 1gkf n THR 379 Cb 0.62 -0.93 -0.04 0.00 -2.10 0.00 0.00 70.33 67.88 1gkf n THR 379 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1gkf h GLN 380 N 0.00 0.00 0.00 -0.78 5.75 -2.01 -0.41 115.11 117.65 1gkf h GLN 380 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1gkf h GLN 380 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1gkf h GLN 380 CO 0.00 0.68 0.00 -0.25 -2.65 0.00 0.00 178.83 176.61 1gkf n ASP 381 N -3.26 0.00 0.00 -0.69 8.00 -1.26 -4.71 116.55 114.64 1gkf n ASP 381 Ca 0.00 -0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1gkf n ASP 381 Cb 0.82 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1gkf n ASP 381 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gkf n GLY 382 N 0.82 -0.15 3.70 0.44 0.00 -0.17 -3.26 105.19 106.57 1gkf n GLY 382 Ca 0.12 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.87 1gkf n GLY 382 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1gkf n PRO 383 N -0.19 1.97 0.01 1.61 -0.02 -1.26 -4.53 135.00 132.59 1gkf n PRO 383 Ca 0.00 0.70 0.14 0.00 -2.02 0.00 0.00 63.50 62.31 1gkf n PRO 383 Cb 0.00 -2.38 0.55 0.00 -0.02 0.00 0.00 33.50 31.65 1gkf n PRO 383 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1gkf n THR 384 N -0.13 0.03 -1.01 3.45 -2.24 -1.26 -4.79 114.28 108.34 1gkf n THR 384 Ca 0.06 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1gkf n THR 384 Cb 0.39 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1gkf n THR 384 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gkf n GLY 385 N 1.49 3.74 3.77 3.38 0.00 -1.26 -4.05 105.19 112.25 1gkf n GLY 385 Ca 0.07 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 1gkf n GLY 385 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gkf s SER 386 N 1.85 4.45 0.00 1.61 1.04 -1.26 -4.94 113.70 116.45 1gkf s SER 386 Ca 0.00 1.73 -0.04 0.00 0.48 0.00 0.00 55.95 58.12 1gkf s SER 386 Cb 0.00 -2.45 -0.04 0.00 0.10 0.00 0.00 66.02 63.63 1gkf s SER 386 CO 0.00 -2.05 0.22 -0.76 0.98 0.00 0.00 173.24 171.63 1gkf s LEU 387 N -5.92 4.37 0.24 2.42 1.43 -1.26 -5.09 118.68 114.87 1gkf s LEU 387 Ca 0.61 0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 54.14 1gkf s LEU 387 Cb -0.17 -2.66 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 1gkf s LEU 387 CO 0.56 0.25 0.22 0.21 0.23 0.00 0.00 176.35 177.82 1gkf s ASN 388 N -1.86 0.47 -0.01 2.29 3.84 -1.26 -5.08 114.94 113.33 1gkf s ASN 388 Ca 0.28 -1.42 -0.30 0.00 0.21 0.00 0.00 52.86 51.63 1gkf s ASN 388 Cb -0.13 0.45 -0.04 0.00 -0.55 0.00 0.00 41.25 40.99 1gkf s ASN 388 CO 0.18 -0.94 1.10 -0.63 -2.79 0.00 0.00 177.10 174.01 1gkf s ILE 389 N -3.94 4.47 0.84 -5.21 1.01 -1.26 -4.72 121.20 112.39 1gkf s ILE 389 Ca 0.37 1.77 -0.11 0.00 0.00 0.00 0.00 60.65 62.68 1gkf s ILE 389 Cb 0.05 -4.14 0.09 0.00 0.01 0.00 0.00 42.46 38.47 1gkf s ILE 389 CO 0.15 0.09 1.09 -0.94 0.00 0.00 0.00 174.94 175.33 1gkf s SER 390 N 1.14 3.96 0.19 3.58 1.04 -1.26 -4.81 113.70 117.55 1gkf s SER 390 Ca 0.54 1.69 -0.11 0.00 0.48 0.00 0.00 55.95 58.55 1gkf s SER 390 Cb -0.24 -2.37 0.12 0.00 0.10 0.00 0.00 66.02 63.64 1gkf s SER 390 CO 0.25 -2.36 1.82 1.62 0.98 0.00 0.00 173.24 175.56 1gkf h VAL 391 N -1.35 1.20 -0.75 5.02 3.04 -1.86 -0.16 116.25 121.39 1gkf h VAL 391 Ca -0.46 -0.47 -0.00 0.00 -1.01 0.00 0.00 66.70 64.75 1gkf h VAL 391 Cb 1.26 0.28 -0.04 0.00 -2.01 0.00 0.00 31.29 30.78 1gkf h VAL 391 CO 0.52 0.22 0.45 1.23 -1.01 0.00 0.00 177.57 178.98 1gkf h GLY 392 N 0.94 1.08 1.29 3.17 0.00 -1.81 -1.61 103.07 106.13 1gkf h GLY 392 Ca 0.24 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1gkf h GLY 392 CO -0.04 0.43 0.24 0.00 0.00 0.00 0.00 176.54 177.17 1gkf h ALA 393 N 1.24 1.26 -0.49 3.60 0.00 -1.65 0.59 119.26 123.81 1gkf h ALA 393 Ca 0.27 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1gkf h ALA 393 Cb -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1gkf h ALA 393 CO -0.05 0.54 -0.10 0.87 0.00 0.00 0.00 179.25 180.51 1gkf h LYS 394 N 0.89 0.90 -0.30 0.00 1.57 -0.44 0.32 116.57 119.51 1gkf h LYS 394 Ca 0.21 -0.31 -0.16 0.00 -1.87 0.00 0.00 60.65 58.52 1gkf h LYS 394 Cb 0.19 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1gkf h LYS 394 CO -0.02 0.95 -0.45 0.82 -0.57 0.00 0.00 179.45 180.19 1gkf h ILE 395 N 0.80 1.28 -0.79 1.86 2.04 -0.97 -2.67 117.51 119.07 1gkf h ILE 395 Ca 0.13 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.35 1gkf h ILE 395 Cb 0.62 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 1gkf h ILE 395 CO 0.04 0.53 0.44 0.25 0.00 0.00 0.00 178.15 179.42 1gkf h LEU 396 N 0.61 0.96 -0.70 1.44 5.85 -0.71 -2.33 115.31 120.43 1gkf h LEU 396 Ca 0.03 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1gkf h LEU 396 Cb 1.05 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1gkf h LEU 396 CO 0.10 0.77 0.42 0.22 -0.34 0.00 0.00 178.44 179.61 1gkf h TYR 397 N 1.09 0.92 -0.75 1.25 3.20 -0.78 0.07 116.97 121.97 1gkf h TYR 397 Ca 0.28 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1gkf h TYR 397 Cb 0.01 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 37.94 1gkf h TYR 397 CO 0.01 0.62 0.35 0.93 -1.64 0.00 0.00 178.16 178.43 1gkf h GLU 398 N 0.95 1.08 -0.48 1.82 4.39 -1.10 -1.83 114.58 119.41 1gkf h GLU 398 Ca 0.25 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 1gkf h GLU 398 Cb -0.03 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 1gkf h GLU 398 CO -0.05 0.85 0.29 0.00 -1.16 0.00 0.00 179.01 178.95 1gkf h ALA 399 N 1.18 0.61 0.00 3.43 0.00 -0.81 -2.47 119.26 121.19 1gkf h ALA 399 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1gkf h ALA 399 Cb 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1gkf h ALA 399 CO -0.03 0.09 0.00 1.33 0.00 0.00 0.00 179.25 180.64 1gkf n VAL 400 N -4.72 0.25 1.14 0.00 0.24 -0.07 -2.18 118.33 112.98 1gkf n VAL 400 Ca 0.02 0.06 0.13 0.00 -2.04 0.00 0.00 64.34 62.51 1gkf n VAL 400 Cb 0.05 -0.64 0.48 0.00 -1.47 0.00 0.00 33.84 32.26 1gkf n VAL 400 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gkf n GLN 401 N -1.39 0.27 0.00 7.34 1.13 -0.72 -5.00 117.38 119.02 1gkf n GLN 401 Ca 0.09 -0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 1gkf n GLN 401 Cb 0.24 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.09 1gkf n GLN 401 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gkf n GLY 402 N 1.42 3.39 0.00 1.08 0.00 -0.93 -1.57 105.19 108.58 1gkf n GLY 402 Ca 0.09 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1gkf n GLY 402 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gkf n ASP 403 N 3.90 0.00 0.24 1.61 5.68 -1.26 -1.81 116.55 124.91 1gkf n ASP 403 Ca 0.00 -1.33 0.13 0.00 -0.50 0.00 0.00 54.79 53.09 1gkf n ASP 403 Cb 0.00 0.00 0.43 0.00 -1.14 0.00 0.00 41.12 40.41 1gkf n ASP 403 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1gkf h LYS 404 N 0.00 0.00 -6.60 0.11 6.56 -1.67 -3.44 116.57 111.53 1gkf h LYS 404 Ca 0.00 0.00 -0.51 0.00 -1.06 0.00 0.00 60.65 59.08 1gkf h LYS 404 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.64 1gkf h LYS 404 CO 0.00 0.08 0.31 0.45 -2.06 0.00 0.00 179.45 178.23 1gkf s SER 405 N -6.01 7.51 0.00 0.86 0.15 -0.75 -4.95 113.70 110.50 1gkf s SER 405 Ca 0.03 1.79 0.31 0.00 0.70 0.00 0.00 55.95 58.78 1gkf s SER 405 Cb 0.08 -2.57 1.69 0.00 -1.71 0.00 0.00 66.02 63.51 1gkf s SER 405 CO 0.62 0.07 2.12 -0.81 1.20 0.00 0.00 173.24 176.44 1gkf n PRO 406 N 2.12 0.90 -3.31 5.44 -0.04 -1.26 -4.78 135.00 134.07 1gkf n PRO 406 Ca -0.01 -0.10 -0.39 0.00 -0.04 0.00 0.00 63.50 62.96 1gkf n PRO 406 Cb 0.48 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 1gkf n PRO 406 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1gkf s ILE 407 N -2.17 5.13 0.23 0.52 -1.09 -1.26 -5.03 121.20 117.52 1gkf s ILE 407 Ca 0.41 0.78 -0.32 0.00 -2.23 0.00 0.00 60.65 59.29 1gkf s ILE 407 Cb 0.21 -3.78 -0.12 0.00 -1.58 0.00 0.00 42.46 37.20 1gkf s ILE 407 CO 0.40 0.15 1.70 -2.84 -1.23 0.00 0.00 174.94 173.12 1gkf s PRO 408 N 1.95 4.12 -1.23 2.79 0.02 -1.26 -4.87 135.00 136.53 1gkf s PRO 408 Ca 0.20 2.60 -0.13 0.00 0.02 0.00 0.00 61.00 63.69 1gkf s PRO 408 Cb -0.15 -3.06 0.16 0.00 0.02 0.00 0.00 34.50 31.47 1gkf s PRO 408 CO 0.09 -0.73 1.52 1.04 -0.33 0.00 0.00 177.00 178.59 1gkf n GLN 409 N 3.62 3.39 -0.04 5.54 1.13 -1.26 -4.80 117.38 124.96 1gkf n GLN 409 Ca 0.14 -3.77 0.07 0.00 -1.94 0.00 0.00 57.00 51.51 1gkf n GLN 409 Cb 0.36 -3.05 0.45 0.00 0.11 0.00 0.00 30.24 28.10 1gkf n GLN 409 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1gkf h ALA 410 N 6.96 1.82 -3.72 -1.58 0.00 -2.05 -3.37 119.26 117.33 1gkf h ALA 410 Ca 0.34 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 54.56 1gkf h ALA 410 Cb 0.84 -0.14 -0.32 0.00 0.00 0.00 0.00 17.79 18.17 1gkf h ALA 410 CO 1.31 0.11 -0.88 0.54 0.00 0.00 0.00 179.25 180.34 1gkf s VAL 411 N -5.46 1.98 -0.30 0.00 0.11 -1.26 -5.09 120.40 110.37 1gkf s VAL 411 Ca -0.08 -1.00 -0.29 0.00 -2.93 0.00 0.00 61.98 57.68 1gkf s VAL 411 Cb 0.18 -1.69 0.00 0.00 -1.53 0.00 0.00 36.38 33.35 1gkf s VAL 411 CO 0.74 0.55 1.28 -0.62 -3.33 0.00 0.00 175.10 173.71 1gkf s ASP 412 N 0.08 6.70 0.35 3.54 2.15 -1.26 -4.88 116.67 123.35 1gkf s ASP 412 Ca -0.10 1.18 0.26 0.00 0.43 0.00 0.00 52.55 54.33 1gkf s ASP 412 Cb -0.15 -2.54 1.17 0.00 -0.30 0.00 0.00 42.92 41.09 1gkf s ASP 412 CO 0.06 -1.06 1.79 -0.07 -0.17 0.00 0.00 175.17 175.72 1gkf h LEU 413 N 10.78 0.00 -1.18 -1.34 3.38 -1.93 -0.98 115.31 124.05 1gkf h LEU 413 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1gkf h LEU 413 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1gkf h LEU 413 CO 1.03 0.00 0.00 0.49 0.09 0.00 0.00 178.44 180.05 1gkf n PHE 414 N -2.45 0.16 -3.99 1.13 3.01 -1.26 -4.37 117.46 109.69 1gkf n PHE 414 Ca 0.01 -0.08 -0.30 0.00 1.01 0.00 0.00 57.45 58.08 1gkf n PHE 414 Cb 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 1gkf n PHE 414 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gkf n ALA 415 N 0.39 -1.46 -0.25 4.37 0.00 -0.37 -1.25 120.51 121.94 1gkf n ALA 415 Ca 0.17 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1gkf n ALA 415 Cb 0.36 -3.50 0.00 0.00 0.00 0.00 0.00 19.45 16.32 1gkf n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gkf n GLY 416 N -1.63 2.04 3.87 0.00 0.00 -1.26 -5.03 105.19 103.18 1gkf n GLY 416 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 1gkf n GLY 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkf s LYS 417 N -0.16 3.82 0.32 1.61 1.02 -0.38 -5.03 119.74 120.94 1gkf s LYS 417 Ca 0.00 0.48 -0.29 0.00 0.02 0.00 0.00 55.97 56.17 1gkf s LYS 417 Cb 0.00 -2.42 -0.11 0.00 -0.52 0.00 0.00 37.83 34.78 1gkf s LYS 417 CO 0.00 0.03 1.53 -2.14 -0.92 0.00 0.00 175.35 173.85 1gkf s PRO 418 N -3.61 4.14 0.32 -1.68 0.02 -1.26 -4.83 135.00 128.10 1gkf s PRO 418 Ca 0.51 2.54 0.02 0.00 0.02 0.00 0.00 61.00 64.09 1gkf s PRO 418 Cb -0.10 -3.01 0.60 0.00 0.02 0.00 0.00 34.50 32.00 1gkf s PRO 418 CO 0.28 -0.56 1.93 1.96 -0.33 0.00 0.00 177.00 180.28 1gkf h GLN 419 N 4.06 0.91 -0.96 5.54 4.20 -1.95 -1.86 115.11 125.05 1gkf h GLN 419 Ca -0.49 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.19 1gkf h GLN 419 Cb 1.23 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 28.75 1gkf h GLN 419 CO 0.73 0.60 0.63 0.37 -0.67 0.00 0.00 178.83 180.49 1gkf h GLN 420 N 0.94 1.24 -0.35 1.46 4.15 -1.97 -1.00 115.11 119.57 1gkf h GLN 420 Ca 0.36 -0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.74 1gkf h GLN 420 Cb 0.20 -0.28 -0.04 0.00 0.21 0.00 0.00 27.48 27.57 1gkf h GLN 420 CO -0.13 0.82 0.12 1.49 -1.93 0.00 0.00 178.83 179.20 1gkf h GLU 421 N 1.27 0.26 -0.27 1.69 4.81 -1.71 -0.63 114.58 120.00 1gkf h GLU 421 Ca 0.36 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.41 1gkf h GLU 421 Cb -0.11 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 1gkf h GLU 421 CO -0.09 0.17 -0.46 0.28 -0.73 0.00 0.00 179.01 178.19 1gkf h VAL 422 N 0.27 1.29 -0.43 0.32 2.07 -1.31 -1.24 116.25 117.22 1gkf h VAL 422 Ca 0.16 -1.65 0.05 0.00 0.82 0.00 0.00 66.70 66.07 1gkf h VAL 422 Cb 0.13 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1gkf h VAL 422 CO -0.16 0.53 0.18 0.58 0.02 0.00 0.00 177.57 178.72 1gkf h VAL 423 N 0.55 0.91 -0.49 2.57 2.07 -1.05 -0.47 116.25 120.34 1gkf h VAL 423 Ca 0.02 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1gkf h VAL 423 Cb 1.06 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 1gkf h VAL 423 CO 0.10 0.07 -0.10 -0.07 0.02 0.00 0.00 177.57 177.59 1gkf h LEU 424 N 0.36 0.89 -0.73 2.57 3.38 -1.05 -1.64 115.31 119.10 1gkf h LEU 424 Ca 0.19 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1gkf h LEU 424 Cb 0.15 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1gkf h LEU 424 CO -0.17 1.01 0.34 0.00 0.09 0.00 0.00 178.44 179.71 1gkf h ALA 425 N 1.07 0.95 -0.24 1.53 0.00 -0.78 0.13 119.26 121.92 1gkf h ALA 425 Ca 0.13 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1gkf h ALA 425 Cb 0.62 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1gkf h ALA 425 CO 0.04 0.52 -0.27 0.00 0.00 0.00 0.00 179.25 179.54 1gkf h ALA 426 N 1.17 1.09 -0.51 0.00 0.00 -0.86 -1.47 119.26 118.66 1gkf h ALA 426 Ca 0.25 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1gkf h ALA 426 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1gkf h ALA 426 CO -0.03 0.56 0.06 -0.07 0.00 0.00 0.00 179.25 179.77 1gkf h LEU 427 N 0.41 0.77 -0.52 0.00 3.38 -0.61 -1.31 115.31 117.43 1gkf h LEU 427 Ca 0.06 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 1gkf h LEU 427 Cb 0.70 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1gkf h LEU 427 CO 0.05 0.80 -0.15 -0.08 0.09 0.00 0.00 178.44 179.15 1gkf h GLU 428 N 0.77 1.03 -0.57 1.13 4.81 -0.18 -0.78 114.58 120.79 1gkf h GLU 428 Ca 0.16 -0.41 0.03 0.00 -0.13 0.00 0.00 59.36 59.01 1gkf h GLU 428 Cb 0.38 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1gkf h GLU 428 CO 0.01 1.09 0.34 -0.44 -0.73 0.00 0.00 179.01 179.28 1gkf h ASP 429 N 0.90 0.55 -0.24 1.04 3.32 -1.15 -1.33 116.42 119.51 1gkf h ASP 429 Ca 0.13 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1gkf h ASP 429 Cb 0.73 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 1gkf h ASP 429 CO 0.06 0.38 0.14 0.74 -1.72 0.00 0.00 179.24 178.84 1gkf h THR 430 N 0.67 1.10 -0.53 0.35 2.02 -0.84 -0.74 112.91 114.94 1gkf h THR 430 Ca 0.23 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 1gkf h THR 430 Cb 0.04 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1gkf h THR 430 CO -0.11 0.10 0.22 -0.25 0.37 0.00 0.00 175.52 175.85 1gkf h TRP 431 N 0.29 0.79 0.02 3.16 2.91 -0.92 -0.91 115.95 121.29 1gkf h TRP 431 Ca 0.09 -0.05 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 1gkf h TRP 431 Cb 0.03 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 28.44 1gkf h TRP 431 CO -0.04 0.64 -0.01 1.49 -1.03 0.00 0.00 178.44 179.49 1gkf h GLU 432 N 0.71 -0.02 0.51 2.65 4.57 -1.00 0.81 114.58 122.80 1gkf h GLU 432 Ca 0.18 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 1gkf h GLU 432 Cb 0.18 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1gkf h GLU 432 CO -0.02 0.06 -0.26 1.15 -1.18 0.00 0.00 179.01 178.76 1gkf h THR 433 N -0.10 0.48 -0.09 0.32 2.02 -1.02 -2.03 112.91 112.50 1gkf h THR 433 Ca -0.00 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.98 1gkf h THR 433 Cb 0.09 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1gkf h THR 433 CO 0.00 0.00 -0.76 -0.07 0.37 0.00 0.00 175.52 175.06 1gkf h LEU 434 N -0.70 0.60 -0.99 2.58 3.38 -1.14 -2.98 115.31 116.06 1gkf h LEU 434 Ca -0.07 -0.40 -0.10 0.00 0.09 0.00 0.00 57.88 57.40 1gkf h LEU 434 Cb 0.54 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1gkf h LEU 434 CO 0.11 1.16 -0.48 0.77 0.09 0.00 0.00 178.44 180.09 1gkf h SER 435 N 0.34 0.00 -0.02 -0.43 4.64 -0.85 0.09 113.55 117.32 1gkf h SER 435 Ca -0.04 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 1gkf h SER 435 Cb 1.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.44 1gkf h SER 435 CO 0.14 0.48 -0.39 0.11 -0.87 0.00 0.00 176.83 176.30 1gkf h LYS 436 N 0.00 0.53 0.08 4.77 1.79 -1.34 0.22 116.57 122.61 1gkf h LYS 436 Ca -0.00 -0.26 -0.23 0.00 -2.18 0.00 0.00 60.65 57.98 1gkf h LYS 436 Cb 0.89 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.57 1gkf h LYS 436 CO 0.06 0.84 -0.93 -0.09 -1.08 0.00 0.00 179.45 178.25 1gkf h ARG 437 N 0.44 0.49 -0.00 3.15 2.43 -1.30 -3.39 114.38 116.20 1gkf h ARG 437 Ca 0.04 -0.63 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 1gkf h ARG 437 Cb 0.88 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1gkf h ARG 437 CO 0.08 1.26 -0.51 0.66 -1.51 0.00 0.00 179.97 179.94 1gkf n TYR 438 N -4.01 0.00 0.00 2.20 4.01 -0.02 -5.12 117.16 114.22 1gkf n TYR 438 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1gkf n TYR 438 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.87 1gkf n TYR 438 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gkf n GLY 439 N 1.25 -0.26 0.69 2.72 0.00 0.77 -4.71 105.19 105.64 1gkf n GLY 439 Ca 0.02 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.29 1gkf n GLY 439 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gkf n ASN 440 N -0.42 2.11 -4.30 1.61 5.03 -1.26 -4.38 115.26 113.65 1gkf n ASN 440 Ca 0.00 -1.72 -0.46 0.00 0.87 0.00 0.00 54.58 53.27 1gkf n ASN 440 Cb 0.00 -0.05 -0.03 0.00 -1.02 0.00 0.00 39.78 38.68 1gkf n ASN 440 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1gkf s ASN 441 N -1.85 6.62 0.39 6.41 2.47 -1.26 -4.95 114.94 122.78 1gkf s ASN 441 Ca 0.34 -2.79 0.11 0.00 0.42 0.00 0.00 52.86 50.95 1gkf s ASN 441 Cb 0.20 -2.17 0.91 0.00 -1.45 0.00 0.00 41.25 38.74 1gkf s ASN 441 CO 0.31 -0.52 1.91 0.58 -3.72 0.00 0.00 177.10 175.66 1gkf h VAL 442 N 4.75 0.86 0.00 -5.21 2.07 -1.94 -1.20 116.25 115.57 1gkf h VAL 442 Ca 0.10 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1gkf h VAL 442 Cb 1.02 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1gkf h VAL 442 CO 0.76 0.11 0.00 0.77 0.02 0.00 0.00 177.57 179.23 1gkf h SER 443 N 0.58 0.00 -0.30 0.57 4.64 -1.99 -1.02 113.55 116.04 1gkf h SER 443 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1gkf h SER 443 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1gkf h SER 443 CO -0.14 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.36 1gkf n ASN 444 N -2.93 2.89 -4.68 4.97 0.23 -0.46 -4.98 115.26 110.30 1gkf n ASN 444 Ca -0.03 -1.86 -0.42 0.00 -0.53 0.00 0.00 54.58 51.74 1gkf n ASN 444 Cb 0.07 -0.19 -0.03 0.00 -2.08 0.00 0.00 39.78 37.55 1gkf n ASN 444 CO 0.00 0.00 0.00 0.26 -0.93 0.00 0.00 177.26 176.59 1gkf s TRP 445 N -1.13 2.54 -0.57 -2.53 0.52 -0.39 -4.95 118.94 112.43 1gkf s TRP 445 Ca 0.27 0.53 -0.01 0.00 0.02 0.00 0.00 56.10 56.90 1gkf s TRP 445 Cb 0.15 -3.82 0.15 0.00 -1.15 0.00 0.00 33.47 28.81 1gkf s TRP 445 CO 0.21 -3.21 0.37 0.15 0.02 0.00 0.00 176.95 174.50 1gkf s LYS 446 N 2.81 2.36 0.34 4.98 1.02 -1.26 -4.69 119.74 125.30 1gkf s LYS 446 Ca 0.69 -2.45 -0.14 0.00 0.02 0.00 0.00 55.97 54.08 1gkf s LYS 446 Cb -0.35 -3.62 -0.08 0.00 -0.52 0.00 0.00 37.83 33.25 1gkf s LYS 446 CO 0.29 -1.14 0.75 0.95 -0.92 0.00 0.00 175.35 175.28 1gkf s THR 447 N 0.05 4.69 0.23 2.17 -4.23 -1.26 -4.90 115.64 112.39 1gkf s THR 447 Ca 0.16 0.90 -0.30 0.00 -1.18 0.00 0.00 61.69 61.26 1gkf s THR 447 Cb -0.21 -3.63 -0.10 0.00 1.34 0.00 0.00 72.50 69.89 1gkf s THR 447 CO -0.03 -0.26 1.47 -2.16 -0.54 0.00 0.00 174.62 173.10 1gkf s PRO 448 N -3.17 4.25 0.32 3.99 0.04 -1.26 -0.87 135.00 138.29 1gkf s PRO 448 Ca 0.54 2.32 -0.12 0.00 0.04 0.00 0.00 61.00 63.77 1gkf s PRO 448 Cb -0.10 -3.12 -0.08 0.00 0.04 0.00 0.00 34.50 31.24 1gkf s PRO 448 CO 0.20 -0.46 0.69 0.00 0.04 0.00 0.00 177.00 177.47 1gkf s ALA 449 N 0.25 3.40 0.29 8.56 0.00 -0.38 -4.63 121.76 129.23 1gkf s ALA 449 Ca 0.62 -0.11 -0.26 0.00 0.00 0.00 0.00 51.96 52.21 1gkf s ALA 449 Cb -0.42 -2.66 -0.09 0.00 0.00 0.00 0.00 23.12 19.95 1gkf s ALA 449 CO 0.41 0.29 0.90 -1.64 0.00 0.00 0.00 175.76 175.72 1gkf s MET 450 N -3.17 4.58 0.52 0.00 -1.94 -1.26 -4.90 119.30 113.13 1gkf s MET 450 Ca 0.52 1.27 0.06 0.00 -1.71 0.00 0.00 55.69 55.83 1gkf s MET 450 Cb -0.10 -2.91 0.03 0.00 2.01 0.00 0.00 34.83 33.85 1gkf s MET 450 CO 0.22 0.35 0.42 0.00 -0.01 0.00 0.00 175.02 176.00 1gkf s ALA 451 N -1.51 4.35 0.01 3.03 0.00 -1.26 -1.05 121.76 125.34 1gkf s ALA 451 Ca 0.47 -1.50 0.05 0.00 0.00 0.00 0.00 51.96 50.97 1gkf s ALA 451 Cb -0.20 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.08 1gkf s ALA 451 CO 0.25 -0.43 -0.15 -1.17 0.00 0.00 0.00 175.76 174.26 1gkf s LEU 452 N -4.27 2.08 -0.08 0.00 0.20 -0.23 -4.11 118.68 112.27 1gkf s LEU 452 Ca 0.40 -0.34 0.02 0.00 0.69 0.00 0.00 54.13 54.90 1gkf s LEU 452 Cb -0.02 -0.71 0.01 0.00 -0.43 0.00 0.00 46.19 45.04 1gkf s LEU 452 CO 0.24 0.13 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.42 1gkf s THR 453 N -0.52 1.22 -0.63 3.68 2.01 -1.20 -0.99 115.64 119.20 1gkf s THR 453 Ca 0.04 -0.50 -0.24 0.00 0.31 0.00 0.00 61.69 61.31 1gkf s THR 453 Cb -0.06 -1.12 0.05 0.00 0.01 0.00 0.00 72.50 71.38 1gkf s THR 453 CO 0.00 0.38 1.00 -0.36 -0.69 0.00 0.00 174.62 174.95 1gkf s PHE 454 N 0.85 2.66 0.31 4.92 0.40 0.55 -4.48 117.98 123.19 1gkf s PHE 454 Ca -0.11 -0.28 -0.28 0.00 -0.60 0.00 0.00 56.93 55.66 1gkf s PHE 454 Cb -0.15 -4.26 -0.09 0.00 0.51 0.00 0.00 43.02 39.02 1gkf s PHE 454 CO 0.01 -1.60 1.04 1.03 0.70 0.00 0.00 175.22 176.40 1gkf s ARG 455 N 4.26 4.54 0.00 0.44 0.52 -0.17 -1.62 118.95 126.91 1gkf s ARG 455 Ca 0.27 1.62 0.28 0.00 -0.52 0.00 0.00 55.73 57.37 1gkf s ARG 455 Cb -0.14 -2.98 1.00 0.00 0.52 0.00 0.00 34.95 33.35 1gkf s ARG 455 CO 0.14 0.17 1.73 0.00 0.02 0.00 0.00 175.30 177.36 1gkf n ALA 456 N 0.82 2.92 -2.67 2.13 0.00 -1.26 -0.64 120.51 121.80 1gkf n ALA 456 Ca 0.01 -0.30 -0.37 0.00 0.00 0.00 0.00 53.44 52.78 1gkf n ALA 456 Cb 0.47 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 1gkf n ALA 456 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1gkf s ASN 457 N -2.61 6.62 1.24 0.00 0.01 -1.26 -0.89 114.94 118.04 1gkf s ASN 457 Ca 0.24 0.73 -0.20 0.00 -0.71 0.00 0.00 52.86 52.92 1gkf s ASN 457 Cb 0.19 -2.23 0.29 0.00 0.41 0.00 0.00 41.25 39.91 1gkf s ASN 457 CO 0.53 0.13 1.03 -0.46 -1.51 0.00 0.00 177.10 176.81 1gkf n ASN 458 N 3.15 -2.06 0.30 -1.22 0.23 0.44 -4.80 115.26 111.30 1gkf n ASN 458 Ca -0.11 -1.13 0.19 0.00 -0.53 0.00 0.00 54.58 53.01 1gkf n ASN 458 Cb 0.52 -0.95 0.90 0.00 -2.08 0.00 0.00 39.78 38.18 1gkf n ASN 458 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 1gkf h PHE 459 N -2.68 0.00 0.00 -2.53 -5.15 -1.91 0.79 116.94 105.46 1gkf h PHE 459 Ca -0.39 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.38 1gkf h PHE 459 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.35 1gkf h PHE 459 CO 0.00 0.01 0.00 1.19 -2.00 0.00 0.00 178.31 177.51 1gkf n PHE 460 N -3.15 0.56 -0.41 6.09 3.72 -1.26 -4.89 117.46 118.12 1gkf n PHE 460 Ca -0.01 0.20 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1gkf n PHE 460 Cb 0.21 -0.83 0.00 0.00 -0.94 0.00 0.00 39.48 37.92 1gkf n PHE 460 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gkf n GLY 461 N 0.36 0.76 3.48 1.37 0.00 0.27 -5.07 105.19 106.37 1gkf n GLY 461 Ca 0.03 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1gkf n GLY 461 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gkf s VAL 462 N -2.00 4.01 0.08 1.61 1.01 -1.25 -4.83 120.40 119.04 1gkf s VAL 462 Ca 0.00 -0.30 -0.37 0.00 0.00 0.00 0.00 61.98 61.31 1gkf s VAL 462 Cb 0.00 -2.79 -0.17 0.00 0.00 0.00 0.00 36.38 33.42 1gkf s VAL 462 CO 0.00 0.45 1.28 -2.65 0.00 0.00 0.00 175.10 174.18 1gkf n PRO 463 N 3.92 0.97 -0.07 2.72 -0.02 -1.26 -0.42 135.00 140.84 1gkf n PRO 463 Ca -0.17 0.35 0.03 0.00 -2.02 0.00 0.00 63.50 61.68 1gkf n PRO 463 Cb 0.52 -1.95 0.04 0.00 -0.02 0.00 0.00 33.50 32.08 1gkf n PRO 463 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gkf n GLN 464 N 2.29 1.74 -3.61 -0.52 10.64 -0.07 -4.80 117.38 123.05 1gkf n GLN 464 Ca 0.18 -1.55 -0.01 0.00 -1.83 0.00 0.00 57.00 53.80 1gkf n GLN 464 Cb 0.18 -0.99 -0.01 0.00 -0.86 0.00 0.00 30.24 28.56 1gkf n GLN 464 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1gkf s ALA 465 N -1.20 -2.19 0.59 2.61 0.00 -1.12 -4.59 121.76 115.86 1gkf s ALA 465 Ca 0.08 1.14 -0.15 0.00 0.00 0.00 0.00 51.96 53.03 1gkf s ALA 465 Cb 0.07 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 1gkf s ALA 465 CO 0.01 -0.85 1.04 0.00 0.00 0.00 0.00 175.76 175.97 1gkf s ALA 466 N -2.37 2.80 0.37 0.00 0.00 -1.26 -4.74 121.76 116.55 1gkf s ALA 466 Ca 0.12 0.30 0.09 0.00 0.00 0.00 0.00 51.96 52.47 1gkf s ALA 466 Cb 0.02 -3.20 0.82 0.00 0.00 0.00 0.00 23.12 20.77 1gkf s ALA 466 CO -0.04 -0.75 1.90 0.00 0.00 0.00 0.00 175.76 176.86 1gkf h ALA 467 N 0.35 1.83 0.00 0.00 0.00 -2.01 0.20 119.26 119.63 1gkf h ALA 467 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1gkf h ALA 467 Cb 1.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1gkf h ALA 467 CO 0.58 -0.04 0.00 -0.85 0.00 0.00 0.00 179.25 178.95 1gkf n GLU 468 N -4.53 0.15 0.00 0.00 0.00 -1.26 -1.89 120.64 113.11 1gkf n GLU 468 Ca 0.15 0.18 0.14 0.00 0.00 0.00 0.00 57.16 57.64 1gkf n GLU 468 Cb 0.41 -1.50 0.56 0.00 0.00 0.00 0.00 31.44 30.91 1gkf n GLU 468 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1gkf n GLU 469 N -1.32 1.18 -1.75 3.44 1.02 0.06 -4.86 120.64 118.40 1gkf n GLU 469 Ca 0.06 -0.58 -0.41 0.00 -0.02 0.00 0.00 57.16 56.20 1gkf n GLU 469 Cb 0.11 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1gkf n GLU 469 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1gkf n THR 470 N -0.40 2.15 -4.37 2.62 -1.04 -0.79 -4.85 114.28 107.59 1gkf n THR 470 Ca 0.17 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.39 1gkf n THR 470 Cb 0.31 -1.84 -0.13 0.00 -1.82 0.00 0.00 70.33 66.85 1gkf n THR 470 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1gkf s ARG 471 N -2.11 1.48 0.02 -2.82 1.81 -0.64 -4.98 118.95 111.71 1gkf s ARG 471 Ca 0.55 -1.31 0.06 0.00 -1.72 0.00 0.00 55.73 53.31 1gkf s ARG 471 Cb -0.49 -1.95 -0.02 0.00 -0.45 0.00 0.00 34.95 32.04 1gkf s ARG 471 CO 0.62 0.46 -0.17 -1.01 -0.68 0.00 0.00 175.30 174.52 1gkf s HIS 472 N -1.08 1.53 -0.06 -0.53 3.76 -1.26 -0.33 115.29 117.33 1gkf s HIS 472 Ca 0.15 -0.33 0.02 0.00 -0.15 0.00 0.00 55.06 54.76 1gkf s HIS 472 Cb -0.10 -0.95 0.01 0.00 1.11 0.00 0.00 32.58 32.65 1gkf s HIS 472 CO 0.07 0.02 -0.11 -1.14 -0.85 0.00 0.00 174.74 172.73 1gkf s GLN 473 N -0.79 1.52 0.22 1.40 0.74 -0.16 -5.00 119.66 117.59 1gkf s GLN 473 Ca 0.06 -0.38 -0.08 0.00 0.05 0.00 0.00 55.36 55.00 1gkf s GLN 473 Cb -0.07 -1.29 0.17 0.00 1.10 0.00 0.00 33.01 32.92 1gkf s GLN 473 CO 0.00 0.04 1.83 0.00 -0.55 0.00 0.00 175.29 176.62 1gkf h ALA 474 N 6.86 1.04 -2.35 1.58 0.00 -1.90 -0.58 119.26 123.91 1gkf h ALA 474 Ca -0.32 -0.13 -0.67 0.00 0.00 0.00 0.00 54.91 53.79 1gkf h ALA 474 Cb 1.18 -0.32 -0.17 0.00 0.00 0.00 0.00 17.79 18.48 1gkf h ALA 474 CO 0.48 0.57 -0.09 -2.00 0.00 0.00 0.00 179.25 178.20 1gkf s GLU 475 N -5.81 3.29 0.29 0.00 2.12 -1.26 -4.00 118.70 113.33 1gkf s GLU 475 Ca -0.13 -0.50 -0.30 0.00 0.36 0.00 0.00 54.97 54.40 1gkf s GLU 475 Cb 0.16 -3.92 -0.11 0.00 0.26 0.00 0.00 34.13 30.52 1gkf s GLU 475 CO 0.82 -0.83 1.56 -0.47 -0.54 0.00 0.00 175.26 175.80 1gkf s TYR 476 N 2.37 2.80 -0.08 5.30 5.04 -0.21 -4.49 117.35 128.07 1gkf s TYR 476 Ca 0.16 0.84 -0.00 0.00 -2.44 0.00 0.00 57.07 55.63 1gkf s TYR 476 Cb -0.16 -4.02 0.02 0.00 0.35 0.00 0.00 41.96 38.15 1gkf s TYR 476 CO 0.15 -3.40 -0.05 -0.65 -1.34 0.00 0.00 175.55 170.25 1gkf s GLN 477 N -0.53 1.16 -1.27 4.97 -0.21 -1.26 -4.89 119.66 117.62 1gkf s GLN 477 Ca 0.62 -0.15 -0.15 0.00 0.02 0.00 0.00 55.36 55.70 1gkf s GLN 477 Cb -0.47 -1.24 0.12 0.00 1.00 0.00 0.00 33.01 32.42 1gkf s GLN 477 CO 0.48 -0.20 1.65 -1.71 -2.12 0.00 0.00 175.29 173.38 1gkf n ASN 478 N 4.67 5.01 -3.83 5.90 5.15 0.02 -4.86 115.26 127.32 1gkf n ASN 478 Ca -0.15 -2.95 -0.12 0.00 -0.60 0.00 0.00 54.58 50.76 1gkf n ASN 478 Cb 0.50 -1.65 -0.06 0.00 -0.53 0.00 0.00 39.78 38.04 1gkf n ASN 478 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gkf s ARG 479 N 2.77 1.55 0.45 1.20 1.70 -1.26 -3.81 118.95 121.54 1gkf s ARG 479 Ca 0.48 -1.54 -0.24 0.00 -0.47 0.00 0.00 55.73 53.97 1gkf s ARG 479 Cb 0.02 0.40 -0.10 0.00 -0.57 0.00 0.00 34.95 34.70 1gkf s ARG 479 CO 0.03 -0.61 1.07 0.41 -1.08 0.00 0.00 175.30 175.12 1gkf n GLY 480 N -0.41 -0.03 0.33 3.88 0.00 -1.25 -4.78 105.19 102.93 1gkf n GLY 480 Ca 0.01 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.19 1gkf n GLY 480 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1gkf h THR 481 N 1.53 0.91 -2.85 2.61 2.02 -0.84 -3.40 112.91 112.88 1gkf h THR 481 Ca -0.46 -0.30 -0.50 0.00 0.77 0.00 0.00 66.41 65.92 1gkf h THR 481 Cb 1.33 -0.04 -0.15 0.00 -1.74 0.00 0.00 68.15 67.55 1gkf h THR 481 CO 0.57 0.16 -0.75 -1.83 0.37 0.00 0.00 175.52 174.03 1gkf s GLU 482 N -6.00 1.39 0.01 6.66 4.04 -1.26 -4.72 118.70 118.82 1gkf s GLU 482 Ca -0.12 -1.58 0.05 0.00 0.04 0.00 0.00 54.97 53.36 1gkf s GLU 482 Cb 0.21 -1.31 -0.02 0.00 0.02 0.00 0.00 34.13 33.03 1gkf s GLU 482 CO 0.79 0.24 -0.16 -0.80 -1.84 0.00 0.00 175.26 173.49 1gkf s ASN 483 N -3.19 1.85 0.01 0.83 -0.87 -1.25 -3.87 114.94 108.45 1gkf s ASN 483 Ca 0.22 -0.35 0.00 0.00 -1.57 0.00 0.00 52.86 51.16 1gkf s ASN 483 Cb -0.03 -0.18 -0.01 0.00 -0.02 0.00 0.00 41.25 41.02 1gkf s ASN 483 CO 0.08 0.15 -0.01 1.51 -2.57 0.00 0.00 177.10 176.26 1gkf s ASP 484 N -0.65 0.09 -0.04 -1.22 -4.77 -0.95 -2.46 116.67 106.67 1gkf s ASP 484 Ca 0.05 -0.18 0.02 0.00 -3.30 0.00 0.00 52.55 49.13 1gkf s ASP 484 Cb -0.07 0.04 0.01 0.00 -1.09 0.00 0.00 42.92 41.81 1gkf s ASP 484 CO 0.00 -0.11 -0.08 -0.32 0.70 0.00 0.00 175.17 175.37 1gkf s MET 485 N -0.54 1.05 -0.09 2.11 1.75 -0.13 -1.50 119.30 121.95 1gkf s MET 485 Ca -0.06 -0.23 0.03 0.00 -1.25 0.00 0.00 55.69 54.18 1gkf s MET 485 Cb -0.04 -0.96 0.00 0.00 2.84 0.00 0.00 34.83 36.67 1gkf s MET 485 CO -0.00 0.01 -0.21 0.42 -0.65 0.00 0.00 175.02 174.59 1gkf s ILE 486 N 0.61 1.81 -0.14 10.11 1.09 -0.12 -1.20 121.20 133.37 1gkf s ILE 486 Ca -0.10 -0.87 0.02 0.00 -1.10 0.00 0.00 60.65 58.60 1gkf s ILE 486 Cb -0.13 -1.58 0.00 0.00 -1.06 0.00 0.00 42.46 39.69 1gkf s ILE 486 CO 0.01 0.50 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.47 1gkf s VAL 487 N 0.46 2.37 -0.12 2.92 1.01 0.18 -0.78 120.40 126.43 1gkf s VAL 487 Ca -0.17 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 1gkf s VAL 487 Cb -0.17 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1gkf s VAL 487 CO 0.07 0.54 -0.08 -0.36 0.00 0.00 0.00 175.10 175.27 1gkf s PHE 488 N 0.69 2.92 -1.26 5.22 0.40 0.11 -1.02 117.98 125.04 1gkf s PHE 488 Ca -0.09 -0.34 -0.15 0.00 -0.60 0.00 0.00 56.93 55.75 1gkf s PHE 488 Cb -0.16 -1.85 0.00 0.00 0.51 0.00 0.00 43.02 41.52 1gkf s PHE 488 CO 0.01 -0.00 0.62 0.43 0.70 0.00 0.00 175.22 176.98 1gkf n SER 489 N 3.19 -3.13 -4.75 1.36 7.64 0.70 -0.56 113.62 118.07 1gkf n SER 489 Ca -0.18 -1.06 -0.38 0.00 1.01 0.00 0.00 58.87 58.26 1gkf n SER 489 Cb 0.53 -2.96 0.05 0.00 -1.01 0.00 0.00 64.21 60.81 1gkf n SER 489 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1gkf s PRO 490 N -6.44 3.05 0.00 1.43 0.04 -1.26 -3.42 135.00 128.39 1gkf s PRO 490 Ca 0.29 2.24 0.27 0.00 0.04 0.00 0.00 61.00 63.84 1gkf s PRO 490 Cb -0.12 -2.21 0.83 0.00 0.04 0.00 0.00 34.50 33.05 1gkf s PRO 490 CO 0.89 -1.26 1.62 0.25 0.04 0.00 0.00 177.00 178.54 1gkf n THR 491 N -1.15 0.00 1.03 1.26 -2.24 -0.00 -3.89 114.28 109.29 1gkf n THR 491 Ca 0.11 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.95 1gkf n THR 491 Cb 0.45 0.17 0.23 0.00 -2.10 0.00 0.00 70.33 69.08 1gkf n THR 491 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gkf n THR 492 N -1.02 0.08 -3.87 4.28 -2.24 -1.26 -4.91 114.28 105.33 1gkf n THR 492 Ca 0.10 -0.47 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 1gkf n THR 492 Cb 0.33 1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 69.62 1gkf n THR 492 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1gkf s SER 493 N -1.91 0.09 0.00 3.42 0.15 -1.25 -5.05 113.70 109.15 1gkf s SER 493 Ca 0.32 -0.49 0.26 0.00 0.70 0.00 0.00 55.95 56.74 1gkf s SER 493 Cb 0.20 0.29 0.71 0.00 -1.71 0.00 0.00 66.02 65.52 1gkf s SER 493 CO 0.31 -0.60 1.55 -0.90 1.20 0.00 0.00 173.24 174.80 1gkf n ASP 494 N 0.47 0.48 -4.73 5.45 5.75 -1.26 -4.64 116.55 118.07 1gkf n ASP 494 Ca -0.18 -0.23 -0.34 0.00 -0.01 0.00 0.00 54.79 54.03 1gkf n ASP 494 Cb 0.60 0.09 0.08 0.00 -1.03 0.00 0.00 41.12 40.86 1gkf n ASP 494 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1gkf s ARG 495 N -2.90 2.30 0.39 0.11 3.00 -1.26 -4.92 118.95 115.67 1gkf s ARG 495 Ca 0.14 1.73 0.22 0.00 0.00 0.00 0.00 55.73 57.82 1gkf s ARG 495 Cb 0.18 -1.86 0.26 0.00 0.00 0.00 0.00 34.95 33.54 1gkf s ARG 495 CO 0.63 -1.71 1.53 -1.35 0.00 0.00 0.00 175.30 174.40 1gkf h PRO 496 N -0.13 0.00 -3.34 3.54 0.11 -1.92 -3.39 132.00 126.87 1gkf h PRO 496 Ca -0.48 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 1gkf h PRO 496 Cb 1.29 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.19 1gkf h PRO 496 CO 0.51 0.09 -0.43 0.54 -0.21 0.00 0.00 178.00 178.49 1gkf s VAL 497 N -3.18 0.06 0.00 3.15 0.11 -1.26 -0.21 120.40 119.08 1gkf s VAL 497 Ca 0.06 -0.53 0.02 0.00 -2.93 0.00 0.00 61.98 58.59 1gkf s VAL 497 Cb 0.06 -0.46 -0.01 0.00 -1.53 0.00 0.00 36.38 34.44 1gkf s VAL 497 CO 0.69 -0.29 -0.06 -0.76 -3.33 0.00 0.00 175.10 171.35 1gkf s LEU 498 N -1.15 2.05 0.01 2.54 1.43 -0.19 -5.00 118.68 118.37 1gkf s LEU 498 Ca -0.12 -0.18 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 1gkf s LEU 498 Cb -0.06 -0.29 0.01 0.00 0.03 0.00 0.00 46.19 45.89 1gkf s LEU 498 CO 0.02 0.03 0.25 0.00 0.23 0.00 0.00 176.35 176.88 1gkf s ALA 499 N -0.34 -0.60 0.04 4.21 0.00 -1.26 -0.65 121.76 123.16 1gkf s ALA 499 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.00 1gkf s ALA 499 Cb -0.04 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 1gkf s ALA 499 CO -0.00 -0.29 0.07 -1.58 0.00 0.00 0.00 175.76 173.96 1gkf s TRP 500 N -1.71 0.27 0.18 0.00 0.51 -0.34 -1.33 118.94 116.51 1gkf s TRP 500 Ca -0.11 -0.64 -0.03 0.00 -2.12 0.00 0.00 56.10 53.20 1gkf s TRP 500 Cb -0.04 -0.19 0.01 0.00 -0.81 0.00 0.00 33.47 32.44 1gkf s TRP 500 CO 0.01 -0.37 0.30 -0.40 -0.51 0.00 0.00 176.95 175.98 1gkf n ASP 501 N 0.60 -0.85 -3.67 2.95 5.75 -0.41 -0.95 116.55 119.98 1gkf n ASP 501 Ca -0.18 -1.88 -0.09 0.00 -0.01 0.00 0.00 54.79 52.63 1gkf n ASP 501 Cb 0.59 1.50 -0.10 0.00 -1.03 0.00 0.00 41.12 42.09 1gkf n ASP 501 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gkf s VAL 502 N -2.60 -0.42 -0.49 2.12 0.11 -1.03 -1.09 120.40 117.01 1gkf s VAL 502 Ca 0.12 0.12 0.03 0.00 -2.93 0.00 0.00 61.98 59.33 1gkf s VAL 502 Cb -0.01 -0.68 0.13 0.00 -1.53 0.00 0.00 36.38 34.29 1gkf s VAL 502 CO 0.09 0.05 0.26 -0.69 -3.33 0.00 0.00 175.10 171.48 1gkf s VAL 503 N 2.16 2.07 -0.04 2.04 1.01 -1.26 -3.95 120.40 122.43 1gkf s VAL 503 Ca -0.05 -3.02 -0.01 0.00 0.00 0.00 0.00 61.98 58.90 1gkf s VAL 503 Cb -0.10 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 1gkf s VAL 503 CO -0.13 -0.85 0.06 0.00 0.00 0.00 0.00 175.10 174.18 1gkf s ALA 504 N -0.05 3.53 0.12 5.51 0.00 -1.26 -2.37 121.76 127.24 1gkf s ALA 504 Ca 0.18 -0.83 0.20 0.00 0.00 0.00 0.00 51.96 51.50 1gkf s ALA 504 Cb -0.24 -1.59 0.67 0.00 0.00 0.00 0.00 23.12 21.95 1gkf s ALA 504 CO -0.01 0.65 1.72 -1.35 0.00 0.00 0.00 175.76 176.78 1gkf h PRO 505 N 4.48 0.00 -1.70 0.00 0.11 -1.86 -3.39 132.00 129.64 1gkf h PRO 505 Ca -0.50 0.00 0.37 0.00 0.11 0.00 0.00 66.00 65.98 1gkf h PRO 505 Cb 1.19 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.20 1gkf h PRO 505 CO 0.60 0.35 0.94 0.20 -0.21 0.00 0.00 178.00 179.87 1gkf s GLY 506 N -4.35 -0.29 0.19 -0.55 0.00 -1.00 -1.02 107.32 100.30 1gkf s GLY 506 Ca 0.01 0.41 -0.09 0.00 0.00 0.00 0.00 44.72 45.05 1gkf s GLY 506 CO 0.68 3.55 1.67 -1.61 0.00 0.00 0.00 173.10 177.39 1gkf h GLN 507 N 2.00 1.09 -5.64 2.90 5.75 -1.64 -3.41 115.11 116.17 1gkf h GLN 507 Ca -0.26 -0.31 -0.67 0.00 -0.15 0.00 0.00 58.65 57.26 1gkf h GLN 507 Cb 1.19 -0.12 -0.07 0.00 1.07 0.00 0.00 27.48 29.55 1gkf h GLN 507 CO 0.30 1.02 -0.48 0.45 -2.65 0.00 0.00 178.83 177.47 1gkf s SER 508 N -6.51 6.37 0.00 -0.69 0.15 -0.68 -4.90 113.70 107.44 1gkf s SER 508 Ca -0.12 0.46 0.17 0.00 0.70 0.00 0.00 55.95 57.16 1gkf s SER 508 Cb 0.14 -2.06 0.40 0.00 -1.71 0.00 0.00 66.02 62.79 1gkf s SER 508 CO 0.85 0.40 1.32 0.61 1.20 0.00 0.00 173.24 177.63 1gkf n GLY 509 N 2.02 2.05 3.73 9.45 0.00 -1.26 -3.88 105.19 117.30 1gkf n GLY 509 Ca -0.20 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 1gkf n GLY 509 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gkf s PHE 510 N -1.12 3.46 -0.08 1.61 5.36 -1.26 -4.97 117.98 120.98 1gkf s PHE 510 Ca 0.33 1.44 0.01 0.00 -0.96 0.00 0.00 56.93 57.75 1gkf s PHE 510 Cb 0.18 -3.40 0.02 0.00 -0.34 0.00 0.00 43.02 39.48 1gkf s PHE 510 CO 0.25 -1.09 -0.10 0.42 -1.46 0.00 0.00 175.22 173.24 1gkf s ILE 511 N 0.09 1.05 0.87 3.12 1.01 -1.26 -1.18 121.20 124.90 1gkf s ILE 511 Ca 0.53 -0.38 -0.12 0.00 0.00 0.00 0.00 60.65 60.69 1gkf s ILE 511 Cb -0.31 -1.01 0.11 0.00 0.01 0.00 0.00 42.46 41.26 1gkf s ILE 511 CO 0.35 0.35 1.10 0.00 0.00 0.00 0.00 174.94 176.74 1gkf s ALA 512 N 1.10 1.80 0.38 9.38 0.00 -0.30 -4.88 121.76 129.24 1gkf s ALA 512 Ca -0.07 -0.22 0.11 0.00 0.00 0.00 0.00 51.96 51.78 1gkf s ALA 512 Cb -0.14 -3.13 0.88 0.00 0.00 0.00 0.00 23.12 20.73 1gkf s ALA 512 CO -0.01 -2.14 1.89 -1.35 0.00 0.00 0.00 175.76 174.15 1gkf h PRO 513 N -1.39 0.60 -0.00 0.00 0.11 -2.01 -0.00 132.00 129.30 1gkf h PRO 513 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1gkf h PRO 513 Cb 1.29 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1gkf h PRO 513 CO 0.58 0.39 0.00 -0.40 -0.21 0.00 0.00 178.00 178.36 1gkf n ASP 514 N -4.53 0.03 0.00 -2.05 5.75 -1.26 -4.89 116.55 109.60 1gkf n ASP 514 Ca 0.16 -1.23 0.00 0.00 -0.01 0.00 0.00 54.79 53.71 1gkf n ASP 514 Cb 0.48 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 1gkf n ASP 514 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gkf n GLY 515 N 0.89 0.26 3.62 6.12 0.00 -0.01 -5.05 105.19 111.02 1gkf n GLY 515 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1gkf n GLY 515 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gkf s THR 516 N -2.00 3.74 0.52 2.61 2.01 -1.26 -4.75 115.64 116.52 1gkf s THR 516 Ca 0.00 0.80 -0.18 0.00 0.31 0.00 0.00 61.69 62.62 1gkf s THR 516 Cb 0.00 -3.84 -0.07 0.00 0.01 0.00 0.00 72.50 68.60 1gkf s THR 516 CO 0.00 -0.43 1.03 0.68 -0.69 0.00 0.00 174.62 175.21 1gkf s VAL 517 N 5.53 3.97 0.69 3.82 -7.23 -1.26 -1.15 120.40 124.77 1gkf s VAL 517 Ca 0.70 1.08 -0.15 0.00 -1.81 0.00 0.00 61.98 61.79 1gkf s VAL 517 Cb -0.21 -3.48 0.02 0.00 0.56 0.00 0.00 36.38 33.27 1gkf s VAL 517 CO 0.30 -0.41 1.17 -0.62 -0.31 0.00 0.00 175.10 175.23 1gkf s ASP 518 N -2.45 4.62 0.57 4.85 2.15 -0.32 -4.89 116.67 121.20 1gkf s ASP 518 Ca 0.64 2.21 0.27 0.00 0.43 0.00 0.00 52.55 56.10 1gkf s ASP 518 Cb -0.15 -2.57 1.53 0.00 -0.30 0.00 0.00 42.92 41.43 1gkf s ASP 518 CO 0.27 -1.97 2.04 0.07 -0.17 0.00 0.00 175.17 175.41 1gkf h LYS 519 N -0.10 0.00 -0.59 4.34 2.10 -1.95 -2.19 116.57 118.19 1gkf h LYS 519 Ca -0.47 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 57.85 1gkf h LYS 519 Cb 1.27 0.00 -0.19 0.00 -0.90 0.00 0.00 32.23 32.41 1gkf h LYS 519 CO 0.52 0.00 0.11 0.72 -2.00 0.00 0.00 179.45 178.80 1gkf n HIS 520 N -3.97 1.85 0.10 0.07 8.25 -1.26 -4.66 115.22 115.60 1gkf n HIS 520 Ca 0.05 -1.84 -0.02 0.00 -0.26 0.00 0.00 57.72 55.65 1gkf n HIS 520 Cb 0.45 -0.67 -0.02 0.00 1.12 0.00 0.00 29.99 30.87 1gkf n HIS 520 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1gkf h TYR 521 N 1.17 0.00 0.00 4.41 3.20 -1.50 -1.73 116.97 122.52 1gkf h TYR 521 Ca 0.36 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.23 1gkf h TYR 521 Cb 1.87 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1gkf h TYR 521 CO 1.20 0.74 -0.19 -0.85 -1.64 0.00 0.00 178.16 177.42 1gkf n GLU 522 N -3.32 0.00 -0.02 1.82 0.28 -1.25 -3.94 120.64 114.20 1gkf n GLU 522 Ca 0.01 -0.48 0.10 0.00 -0.16 0.00 0.00 57.16 56.62 1gkf n GLU 522 Cb 0.82 -0.29 0.51 0.00 1.43 0.00 0.00 31.44 33.91 1gkf n GLU 522 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1gkf n ASP 523 N 0.00 0.45 -0.08 -1.84 5.75 -1.18 -3.05 116.55 116.60 1gkf n ASP 523 Ca 0.00 -1.49 0.01 0.00 -0.01 0.00 0.00 54.79 53.30 1gkf n ASP 523 Cb 0.58 -0.03 0.01 0.00 -1.03 0.00 0.00 41.12 40.65 1gkf n ASP 523 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gkf n GLN 524 N -0.50 -0.54 0.04 0.11 6.02 -0.19 -4.77 117.38 117.56 1gkf n GLN 524 Ca 0.15 -0.67 -0.13 0.00 -0.01 0.00 0.00 57.00 56.35 1gkf n GLN 524 Cb 0.14 -1.04 -0.08 0.00 1.02 0.00 0.00 30.24 30.28 1gkf n GLN 524 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1gkf h LEU 525 N 0.37 -0.06 -0.58 1.08 5.85 -1.40 -0.83 115.31 119.75 1gkf h LEU 525 Ca 0.00 -0.16 -0.11 0.00 0.84 0.00 0.00 57.88 58.45 1gkf h LEU 525 Cb 0.10 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1gkf h LEU 525 CO 0.00 0.13 -0.08 0.11 -0.34 0.00 0.00 178.44 178.27 1gkf h LYS 526 N -0.24 1.06 -0.84 1.25 1.79 -1.87 -2.38 116.57 115.33 1gkf h LYS 526 Ca -0.01 -0.37 0.04 0.00 -2.18 0.00 0.00 60.65 58.13 1gkf h LYS 526 Cb 0.22 -0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 1gkf h LYS 526 CO 0.01 1.07 0.54 1.98 -1.08 0.00 0.00 179.45 181.97 1gkf h MET 527 N 0.94 1.01 0.25 3.15 4.05 -1.85 -2.00 114.93 120.49 1gkf h MET 527 Ca 0.15 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1gkf h MET 527 Cb 0.65 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.22 1gkf h MET 527 CO 0.04 0.67 -0.12 -0.92 0.23 0.00 0.00 176.91 176.81 1gkf h TYR 528 N 1.04 -0.31 -0.81 1.39 3.20 -0.86 0.41 116.97 121.02 1gkf h TYR 528 Ca 0.34 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.27 1gkf h TYR 528 Cb 0.03 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 1gkf h TYR 528 CO -0.02 -0.18 0.53 1.49 -1.64 0.00 0.00 178.16 178.34 1gkf h GLU 529 N -0.35 0.83 -0.64 1.82 4.81 -1.00 -2.05 114.58 117.99 1gkf h GLU 529 Ca -0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1gkf h GLU 529 Cb 0.27 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1gkf h GLU 529 CO 0.06 0.55 0.00 0.27 -0.73 0.00 0.00 179.01 179.16 1gkf n ASN 530 N -4.49 4.71 -1.37 1.04 0.23 -0.79 -4.91 115.26 109.68 1gkf n ASN 530 Ca 0.12 -2.55 -0.14 0.00 -0.53 0.00 0.00 54.58 51.49 1gkf n ASN 530 Cb 0.24 -0.59 -0.03 0.00 -2.08 0.00 0.00 39.78 37.32 1gkf n ASN 530 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1gkf n PHE 531 N 0.87 -0.41 -1.97 -2.53 3.72 -0.77 -5.00 117.46 111.37 1gkf n PHE 531 Ca 0.24 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.37 1gkf n PHE 531 Cb 0.92 -2.76 0.18 0.00 -0.94 0.00 0.00 39.48 36.88 1gkf n PHE 531 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gkf n GLY 532 N -1.12 -1.20 3.54 1.37 0.00 0.12 -5.04 105.19 102.85 1gkf n GLY 532 Ca -0.15 -1.75 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 1gkf n GLY 532 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gkf s ARG 533 N -5.65 0.87 0.17 1.61 1.70 -1.26 -4.68 118.95 111.72 1gkf s ARG 533 Ca 0.70 0.13 0.07 0.00 -0.47 0.00 0.00 55.73 56.16 1gkf s ARG 533 Cb -0.02 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 34.73 1gkf s ARG 533 CO 0.49 -0.29 0.03 -1.59 -1.08 0.00 0.00 175.30 172.86 1gkf s LYS 534 N -1.43 2.52 0.20 3.89 -2.85 -0.25 -4.94 119.74 116.89 1gkf s LYS 534 Ca -0.06 -1.05 -0.30 0.00 -1.00 0.00 0.00 55.97 53.56 1gkf s LYS 534 Cb -0.00 -2.42 -0.08 0.00 -2.06 0.00 0.00 37.83 33.26 1gkf s LYS 534 CO 0.04 0.46 1.21 -1.12 0.10 0.00 0.00 175.35 176.04 1gkf s SER 535 N -2.99 7.06 -0.29 0.03 0.01 -1.26 -1.29 113.70 114.98 1gkf s SER 535 Ca 0.28 2.28 -0.21 0.00 1.31 0.00 0.00 55.95 59.61 1gkf s SER 535 Cb -0.09 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.52 1gkf s SER 535 CO 0.20 -0.38 0.68 -0.76 0.41 0.00 0.00 173.24 173.39 1gkf s LEU 536 N -0.39 4.10 0.18 2.44 1.43 -0.44 -4.84 118.68 121.16 1gkf s LEU 536 Ca 0.52 0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 54.17 1gkf s LEU 536 Cb -0.33 -2.92 -0.06 0.00 0.03 0.00 0.00 46.19 42.91 1gkf s LEU 536 CO 0.38 -0.48 0.45 0.26 0.23 0.00 0.00 176.35 177.19 1gkf s TRP 537 N 2.68 3.46 0.03 0.29 0.52 -1.26 -4.49 118.94 120.16 1gkf s TRP 537 Ca 0.28 0.67 0.00 0.00 0.02 0.00 0.00 56.10 57.07 1gkf s TRP 537 Cb -0.15 -2.10 0.00 0.00 -1.15 0.00 0.00 33.47 30.07 1gkf s TRP 537 CO 0.11 0.36 0.00 -0.11 0.02 0.00 0.00 176.95 177.32 1gkf n LEU 538 N -0.08 0.10 -4.79 2.99 7.94 -1.26 -4.75 117.00 117.16 1gkf n LEU 538 Ca -0.01 0.04 -0.33 0.00 -1.11 0.00 0.00 56.01 54.60 1gkf n LEU 538 Cb 0.52 -0.01 0.03 0.00 0.53 0.00 0.00 43.42 44.49 1gkf n LEU 538 CO 0.47 -0.26 0.72 0.42 -1.11 0.00 0.00 177.39 177.64 1gkf s THR 539 N -2.00 3.60 0.30 1.96 -4.23 -1.26 -4.85 115.64 109.17 1gkf s THR 539 Ca 0.00 0.72 -0.00 0.00 -1.18 0.00 0.00 61.69 61.23 1gkf s THR 539 Cb 0.00 -3.26 0.27 0.00 1.34 0.00 0.00 72.50 70.85 1gkf s THR 539 CO 0.00 -0.48 1.95 0.11 -0.54 0.00 0.00 174.62 175.66 1gkf h LYS 540 N 0.15 1.03 -0.27 3.99 1.57 -1.99 -0.54 116.57 120.51 1gkf h LYS 540 Ca -0.46 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.11 1gkf h LYS 540 Cb 1.23 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1gkf h LYS 540 CO 0.56 0.68 -0.41 1.96 -0.57 0.00 0.00 179.45 181.67 1gkf h GLN 541 N 1.06 0.65 -0.27 3.15 7.50 -1.99 -0.27 115.11 124.94 1gkf h GLN 541 Ca 0.33 -0.33 -0.18 0.00 0.50 0.00 0.00 58.65 58.97 1gkf h GLN 541 Cb 0.02 0.01 -0.00 0.00 0.05 0.00 0.00 27.48 27.55 1gkf h GLN 541 CO -0.10 0.94 -0.54 -0.44 -1.50 0.00 0.00 178.83 177.19 1gkf h ASP 542 N 0.53 0.90 -0.34 1.46 3.32 -1.81 -0.67 116.42 119.81 1gkf h ASP 542 Ca 0.04 -0.48 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1gkf h ASP 542 Cb 0.93 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 1gkf h ASP 542 CO 0.08 1.26 0.16 0.58 -1.72 0.00 0.00 179.24 179.61 1gkf h VAL 543 N 0.62 1.16 -0.75 -1.35 2.07 -1.05 -2.74 116.25 114.21 1gkf h VAL 543 Ca 0.01 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1gkf h VAL 543 Cb 1.14 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1gkf h VAL 543 CO 0.12 0.17 0.32 -0.08 0.02 0.00 0.00 177.57 178.11 1gkf h GLU 544 N 0.41 1.10 0.00 1.57 4.57 -0.87 -1.60 114.58 119.76 1gkf h GLU 544 Ca 0.12 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1gkf h GLU 544 Cb 0.11 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1gkf h GLU 544 CO -0.02 0.88 -0.04 0.00 -1.18 0.00 0.00 179.01 178.65 1gkf h ALA 545 N 1.26 1.07 -0.05 2.92 0.00 -0.94 -2.68 119.26 120.85 1gkf h ALA 545 Ca 0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1gkf h ALA 545 Cb 0.17 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1gkf h ALA 545 CO -0.03 0.05 -0.06 0.72 0.00 0.00 0.00 179.25 179.93 1gkf n HIS 546 N -3.24 0.19 -2.28 0.00 8.25 -0.79 -5.05 115.22 112.30 1gkf n HIS 546 Ca -0.01 -1.07 -0.42 0.00 -0.26 0.00 0.00 57.72 55.97 1gkf n HIS 546 Cb 0.23 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.11 1gkf n HIS 546 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1gkf s LYS 547 N -2.93 4.40 -0.26 -0.41 2.20 -0.67 -4.94 119.74 117.14 1gkf s LYS 547 Ca 0.35 1.96 0.02 0.00 -0.36 0.00 0.00 55.97 57.94 1gkf s LYS 547 Cb 0.31 -3.25 -0.17 0.00 -1.51 0.00 0.00 37.83 33.21 1gkf s LYS 547 CO 0.03 -0.26 -0.23 -1.91 -0.36 0.00 0.00 175.35 172.61 1gkf n GLU 548 N 3.19 0.65 -3.80 4.03 2.13 -1.26 -5.07 120.64 120.51 1gkf n GLU 548 Ca 0.08 0.15 -0.09 0.00 0.66 0.00 0.00 57.16 57.95 1gkf n GLU 548 Cb 0.44 -1.52 -0.04 0.00 0.27 0.00 0.00 31.44 30.59 1gkf n GLU 548 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1gkf s SER 549 N -6.51 -0.23 0.01 4.31 1.04 -1.26 -5.18 113.70 105.87 1gkf s SER 549 Ca -0.35 -0.57 -0.19 0.00 0.48 0.00 0.00 55.95 55.32 1gkf s SER 549 Cb 0.09 0.60 0.04 0.00 0.10 0.00 0.00 66.02 66.84 1gkf s SER 549 CO 0.60 -1.10 0.42 0.00 0.98 0.00 0.00 173.24 174.14 1gkf s GLN 550 N -3.90 0.87 0.04 4.02 -2.07 -1.26 -5.17 119.66 112.20 1gkf s GLN 550 Ca 0.12 -0.22 0.04 0.00 -1.82 0.00 0.00 55.36 53.48 1gkf s GLN 550 Cb -0.01 0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 32.28 1gkf s GLN 550 CO 0.00 -0.28 -0.12 -2.00 -1.32 0.00 0.00 175.29 171.57 1gkf s GLU 551 N -1.95 0.77 -0.14 9.60 2.12 -1.26 -5.15 118.70 122.70 1gkf s GLU 551 Ca -0.09 -0.75 0.01 0.00 0.36 0.00 0.00 54.97 54.51 1gkf s GLU 551 Cb -0.02 -0.72 0.02 0.00 0.26 0.00 0.00 34.13 33.67 1gkf s GLU 551 CO 0.01 0.17 -0.16 0.08 -0.54 0.00 0.00 175.26 174.82 1gkf s VAL 552 N -0.99 1.70 0.11 3.70 1.01 -1.26 -5.13 120.40 119.54 1gkf s VAL 552 Ca -0.02 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1gkf s VAL 552 Cb -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1gkf s VAL 552 CO 0.01 0.48 0.00 -0.76 0.00 0.00 0.00 175.10 174.83 1gkf s LEU 553 N 1.24 3.43 -0.29 3.92 1.43 -1.26 -5.10 118.68 122.05 1gkf s LEU 553 Ca 0.00 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1gkf s LEU 553 Cb -0.14 -2.15 0.09 0.00 0.03 0.00 0.00 46.19 44.02 1gkf s LEU 553 CO -0.08 0.15 0.04 -1.00 0.23 0.00 0.00 176.35 175.70 1gkf s HIS 554 N -1.40 2.31 -0.01 0.29 3.76 -1.26 -5.12 115.29 113.87 1gkf s HIS 554 Ca 0.26 -1.97 0.02 0.00 -0.15 0.00 0.00 55.06 53.22 1gkf s HIS 554 Cb -0.11 -1.91 -0.00 0.00 1.11 0.00 0.00 32.58 31.67 1gkf s HIS 554 CO 0.18 -0.85 -0.07 0.08 -0.85 0.00 0.00 174.74 173.23 1gkf s VAL 555 N 1.41 0.58 -0.14 -0.90 1.01 -1.26 -5.14 120.40 115.97 1gkf s VAL 555 Ca 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 1gkf s VAL 555 Cb -0.18 -0.50 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1gkf s VAL 555 CO -0.15 0.17 -0.07 -1.10 0.00 0.00 0.00 175.10 173.95 1gkf s GLN 556 N -0.12 3.52 0.00 2.72 -0.21 -1.26 -5.36 119.66 118.95 1gkf s GLN 556 Ca 0.02 -0.58 0.20 0.00 0.02 0.00 0.00 55.36 55.02 1gkf s GLN 556 Cb -0.03 -2.79 1.19 0.00 1.00 0.00 0.00 33.01 32.37 1gkf s GLN 556 CO -0.00 0.26 1.58 -2.13 -2.12 0.00 0.00 175.29 172.87