#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gzj s LYS 11 N 0.00 3.82 -0.25 3.69 -0.14 -1.26 -4.89 119.74 120.72 3gzj s LYS 11 Ca 0.00 0.61 -0.08 0.00 -1.36 0.00 0.00 55.97 55.14 3gzj s LYS 11 Cb 0.00 -2.32 -0.03 0.00 -1.68 0.00 0.00 37.83 33.80 3gzj s LYS 11 CO 0.00 -0.11 0.08 -1.58 -0.76 0.00 0.00 175.35 172.99 3gzj s HIS 12 N -2.45 3.11 -0.24 3.18 5.65 -1.26 -2.21 115.29 121.07 3gzj s HIS 12 Ca 0.53 -0.31 -0.08 0.00 0.25 0.00 0.00 55.06 55.45 3gzj s HIS 12 Cb -0.10 -2.24 -0.03 0.00 -1.18 0.00 0.00 32.58 29.02 3gzj s HIS 12 CO 0.32 -0.29 0.09 -0.06 -0.65 0.00 0.00 174.74 174.15 3gzj s PHE 13 N 1.52 3.14 -0.27 3.88 0.08 0.03 -0.62 117.98 125.74 3gzj s PHE 13 Ca 0.06 -0.22 -0.08 0.00 0.12 0.00 0.00 56.93 56.81 3gzj s PHE 13 Cb -0.15 -2.23 -0.02 0.00 -0.57 0.00 0.00 43.02 40.05 3gzj s PHE 13 CO 0.04 -0.22 0.10 0.08 -0.10 0.00 0.00 175.22 175.12 3gzj s VAL 14 N 1.40 4.41 -0.23 -0.44 1.01 0.68 -1.00 120.40 126.23 3gzj s VAL 14 Ca 0.06 -0.24 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 3gzj s VAL 14 Cb -0.15 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 3gzj s VAL 14 CO 0.05 0.25 0.04 -0.76 0.00 0.00 0.00 175.10 174.68 3gzj s LEU 15 N 1.62 3.35 -0.23 3.92 1.43 0.12 -1.70 118.68 127.18 3gzj s LEU 15 Ca 0.06 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3gzj s LEU 15 Cb -0.16 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.22 3gzj s LEU 15 CO 0.05 0.00 -0.13 -0.69 0.23 0.00 0.00 176.35 175.81 3gzj s VAL 16 N 1.37 2.36 0.74 -1.59 1.01 0.72 -2.72 120.40 122.29 3gzj s VAL 16 Ca 0.05 -1.18 -0.11 0.00 0.00 0.00 0.00 61.98 60.73 3gzj s VAL 16 Cb -0.15 -2.19 0.04 0.00 0.00 0.00 0.00 36.38 34.08 3gzj s VAL 16 CO 0.02 0.25 1.09 -1.38 0.00 0.00 0.00 175.10 175.08 3gzj s HIS 17 N 1.24 2.72 0.35 5.22 -3.43 -1.26 -2.72 115.29 117.41 3gzj s HIS 17 Ca -0.01 1.52 -0.04 0.00 -0.80 0.00 0.00 55.06 55.74 3gzj s HIS 17 Cb -0.16 -3.02 0.08 0.00 -1.43 0.00 0.00 32.58 28.04 3gzj s HIS 17 CO -0.08 -1.63 0.48 0.41 -2.00 0.00 0.00 174.74 171.92 3gzj n GLY 18 N -1.29 -0.40 3.77 -1.38 0.00 -1.19 -3.70 105.19 101.00 3gzj n GLY 18 Ca 0.09 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.92 3gzj n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gzj s GLY 19 N -3.87 2.75 -0.72 -0.02 0.00 -1.26 -3.14 107.32 101.06 3gzj s GLY 19 Ca 0.29 0.92 0.00 0.00 0.00 0.00 0.00 44.72 45.93 3gzj s GLY 19 CO 0.20 1.36 0.00 0.00 0.00 0.00 0.00 173.10 174.65 3gzj n LEU 21 N -0.78 0.00 -3.87 0.00 4.77 -1.19 -3.32 117.00 112.62 3gzj n LEU 21 Ca -0.07 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.83 3gzj n LEU 21 Cb 0.47 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 3gzj n LEU 21 CO 0.10 -0.01 0.43 -0.83 -1.33 0.00 0.00 177.39 175.75 3gzj s GLY 22 N -0.34 0.23 0.45 -0.72 0.00 -1.26 -3.57 107.32 102.11 3gzj s GLY 22 Ca 0.00 -0.60 0.29 0.00 0.00 0.00 0.00 44.72 44.41 3gzj s GLY 22 CO 0.00 -0.28 1.68 0.00 0.00 0.00 0.00 173.10 174.50 3gzj h ALA 23 N 2.04 2.73 0.00 3.20 0.00 -1.89 -2.29 119.26 123.06 3gzj h ALA 23 Ca -0.25 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3gzj h ALA 23 Cb 1.25 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3gzj h ALA 23 CO 0.31 -1.26 0.21 0.11 0.00 0.00 0.00 179.25 178.61 3gzj h TRP 24 N 0.15 0.00 0.00 0.00 5.08 -1.93 -1.14 115.95 118.11 3gzj h TRP 24 Ca 0.74 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.71 3gzj h TRP 24 Cb 2.34 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 28.50 3gzj h TRP 24 CO -0.00 0.00 -0.01 -0.84 -1.28 0.00 0.00 178.44 176.31 3gzj h ILE 25 N 0.00 0.02 -0.27 0.12 3.07 -1.84 -2.95 117.51 115.65 3gzj h ILE 25 Ca 0.00 -0.95 -0.01 0.00 1.55 0.00 0.00 64.86 65.45 3gzj h ILE 25 Cb 0.41 1.93 -0.01 0.00 -0.27 0.00 0.00 36.82 38.89 3gzj h ILE 25 CO 0.00 0.01 0.02 0.79 -1.05 0.00 0.00 178.15 177.92 3gzj n TRP 26 N -3.10 0.98 0.26 0.16 7.02 -0.43 -4.42 117.44 117.90 3gzj n TRP 26 Ca 0.03 -0.38 0.14 0.00 -1.02 0.00 0.00 57.50 56.28 3gzj n TRP 26 Cb 0.50 -0.31 0.63 0.00 -2.42 0.00 0.00 31.31 29.71 3gzj n TRP 26 CO 0.00 0.00 0.00 0.10 -2.02 0.00 0.00 177.69 175.77 3gzj h TYR 27 N 1.74 0.00 0.00 -5.99 -0.00 -1.70 0.12 116.97 111.13 3gzj h TYR 27 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 58.73 58.49 3gzj h TYR 27 Cb 1.22 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.90 3gzj h TYR 27 CO 0.51 0.10 -1.77 1.63 -0.00 0.00 0.00 178.16 178.64 3gzj n LYS 28 N -3.28 0.64 0.02 0.10 5.02 -1.26 -4.38 118.16 115.02 3gzj n LYS 28 Ca -0.00 0.18 -0.22 0.00 -2.02 0.00 0.00 58.31 56.26 3gzj n LYS 28 Cb 0.33 -1.73 -0.14 0.00 -0.02 0.00 0.00 35.03 33.47 3gzj n LYS 28 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3gzj h LEU 29 N 0.00 0.41 -0.63 -0.35 5.85 -1.67 -3.37 115.31 115.55 3gzj h LEU 29 Ca -0.29 -0.87 0.12 0.00 0.84 0.00 0.00 57.88 57.69 3gzj h LEU 29 Cb 1.87 -0.13 -0.12 0.00 0.37 0.00 0.00 40.66 42.65 3gzj h LEU 29 CO 0.05 1.65 -0.24 0.50 -0.34 0.00 0.00 178.44 180.07 3gzj h LYS 30 N -0.24 -0.07 -0.55 1.25 3.64 -0.99 -1.86 116.57 117.75 3gzj h LYS 30 Ca -0.32 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.09 3gzj h LYS 30 Cb 1.82 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.62 3gzj h LYS 30 CO 0.07 -0.05 0.36 -1.00 -2.27 0.00 0.00 179.45 176.57 3gzj h PRO 31 N -0.08 0.67 -0.39 1.90 0.13 -1.77 -1.69 132.00 130.78 3gzj h PRO 31 Ca 0.28 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.28 3gzj h PRO 31 Cb 0.52 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 3gzj h PRO 31 CO -0.68 0.44 -0.11 -0.07 -0.23 0.00 0.00 178.00 177.35 3gzj h LEU 32 N 0.69 0.78 -0.49 1.56 3.38 -1.52 0.26 115.31 119.97 3gzj h LEU 32 Ca 0.21 -0.37 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 3gzj h LEU 32 Cb -0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3gzj h LEU 32 CO -0.05 0.97 -0.52 -0.07 0.09 0.00 0.00 178.44 178.86 3gzj h LEU 33 N 0.58 0.72 -1.19 1.67 3.38 -1.32 -2.87 115.31 116.27 3gzj h LEU 33 Ca 0.10 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 3gzj h LEU 33 Cb 0.63 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3gzj h LEU 33 CO 0.04 1.10 -0.22 -0.33 0.09 0.00 0.00 178.44 179.12 3gzj h GLU 34 N 0.51 0.28 0.00 1.13 5.08 -1.03 -2.58 114.58 117.97 3gzj h GLU 34 Ca 0.02 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3gzj h GLU 34 Cb 1.07 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3gzj h GLU 34 CO 0.10 0.50 0.00 0.77 -1.00 0.00 0.00 179.01 179.38 3gzj h SER 35 N 0.26 0.00 -0.10 1.42 0.02 -0.27 -2.07 113.55 112.80 3gzj h SER 35 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3gzj h SER 35 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 3gzj h SER 35 CO 0.04 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.73 3gzj n ALA 36 N -1.87 2.49 -0.05 3.77 0.00 -0.99 -4.93 120.51 118.92 3gzj n ALA 36 Ca 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.80 3gzj n ALA 36 Cb 0.25 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.76 3gzj n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gzj n GLY 37 N 1.31 0.97 3.66 0.00 0.00 -0.78 -5.04 105.19 105.30 3gzj n GLY 37 Ca 0.16 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 3gzj n GLY 37 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gzj s HIS 38 N -2.00 2.78 0.25 1.61 3.76 -1.08 -4.65 115.29 115.96 3gzj s HIS 38 Ca 0.00 -0.18 -0.14 0.00 -0.15 0.00 0.00 55.06 54.59 3gzj s HIS 38 Cb 0.00 -1.30 -0.08 0.00 1.11 0.00 0.00 32.58 32.31 3gzj s HIS 38 CO 0.00 0.55 0.66 0.21 -0.85 0.00 0.00 174.74 175.31 3gzj s LYS 39 N -3.25 4.00 -0.06 1.40 2.20 -0.94 -4.02 119.74 119.07 3gzj s LYS 39 Ca 0.29 0.58 -0.03 0.00 -0.36 0.00 0.00 55.97 56.46 3gzj s LYS 39 Cb -0.08 -2.65 0.03 0.00 -1.51 0.00 0.00 37.83 33.62 3gzj s LYS 39 CO 0.19 0.30 0.13 0.08 -0.36 0.00 0.00 175.35 175.68 3gzj s VAL 40 N -1.77 -0.04 -0.21 4.02 1.01 -1.26 -0.79 120.40 121.36 3gzj s VAL 40 Ca 0.48 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.62 3gzj s VAL 40 Cb -0.12 -0.21 0.05 0.00 0.00 0.00 0.00 36.38 36.09 3gzj s VAL 40 CO 0.19 0.06 -0.10 -0.89 0.00 0.00 0.00 175.10 174.37 3gzj s THR 41 N 0.99 1.67 -0.27 3.92 2.01 -0.17 -4.95 115.64 118.84 3gzj s THR 41 Ca -0.08 -1.10 -0.07 0.00 0.31 0.00 0.00 61.69 60.75 3gzj s THR 41 Cb -0.10 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.62 3gzj s THR 41 CO -0.05 0.11 0.08 0.00 -0.69 0.00 0.00 174.62 174.07 3gzj s ALA 42 N 1.37 3.11 0.02 7.40 0.00 -1.26 -0.70 121.76 131.70 3gzj s ALA 42 Ca -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.64 3gzj s ALA 42 Cb -0.17 -2.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.79 3gzj s ALA 42 CO -0.08 -0.71 0.12 0.54 0.00 0.00 0.00 175.76 175.63 3gzj s VAL 43 N 1.56 4.90 -0.27 0.00 0.11 -1.10 -4.84 120.40 120.76 3gzj s VAL 43 Ca 0.05 -0.45 -0.13 0.00 -2.93 0.00 0.00 61.98 58.52 3gzj s VAL 43 Cb -0.16 -3.30 -0.04 0.00 -1.53 0.00 0.00 36.38 31.35 3gzj s VAL 43 CO 0.03 0.26 0.28 -1.81 -3.33 0.00 0.00 175.10 170.53 3gzj s ASP 44 N -2.03 6.15 0.87 3.54 1.01 -1.26 -3.75 116.67 121.19 3gzj s ASP 44 Ca 0.27 0.16 -0.12 0.00 0.71 0.00 0.00 52.55 53.57 3gzj s ASP 44 Cb -0.12 -2.16 0.11 0.00 1.01 0.00 0.00 42.92 41.75 3gzj s ASP 44 CO 0.19 -0.10 1.15 -0.76 0.21 0.00 0.00 175.17 175.85 3gzj s LEU 45 N 1.81 2.23 0.46 1.23 1.43 -1.26 -4.72 118.68 119.86 3gzj s LEU 45 Ca 0.11 0.94 -0.25 0.00 -1.03 0.00 0.00 54.13 53.90 3gzj s LEU 45 Cb -0.16 -3.35 -0.08 0.00 0.03 0.00 0.00 46.19 42.64 3gzj s LEU 45 CO 0.10 -2.28 1.43 -0.44 0.23 0.00 0.00 176.35 175.40 3gzj s SER 46 N -4.20 5.81 -1.18 2.29 0.01 -0.69 -1.61 113.70 114.12 3gzj s SER 46 Ca 0.63 2.94 0.00 0.00 1.31 0.00 0.00 55.95 60.82 3gzj s SER 46 Cb -0.13 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.44 3gzj s SER 46 CO 0.52 -1.23 0.00 0.00 0.41 0.00 0.00 173.24 172.94 3gzj n ALA 47 N -0.26 -0.51 -2.40 1.44 0.00 -1.24 -4.94 120.51 112.59 3gzj n ALA 47 Ca 0.05 0.15 -0.28 0.00 0.00 0.00 0.00 53.44 53.36 3gzj n ALA 47 Cb 0.42 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.31 3gzj n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gzj s ALA 48 N -2.37 2.30 0.00 0.00 0.00 -0.63 -4.76 121.76 116.29 3gzj s ALA 48 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.54 3gzj s ALA 48 Cb 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3gzj s ALA 48 CO 0.00 0.52 0.00 0.41 0.00 0.00 0.00 175.76 176.69 3gzj n GLY 49 N 1.02 2.86 1.32 0.00 0.00 -1.23 -1.29 105.19 107.86 3gzj n GLY 49 Ca -0.18 -0.23 0.08 0.00 0.00 0.00 0.00 46.02 45.70 3gzj n GLY 49 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3gzj n ILE 50 N 0.00 1.89 -1.74 -0.61 -5.35 -1.26 -4.96 119.36 107.33 3gzj n ILE 50 Ca 0.00 -1.34 -0.42 0.00 -0.27 0.00 0.00 62.75 60.73 3gzj n ILE 50 Cb 0.00 0.07 -0.00 0.00 -1.74 0.00 0.00 39.64 37.97 3gzj n ILE 50 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3gzj n ASN 51 N 0.63 3.34 -0.30 7.28 2.85 -0.41 -4.92 115.26 123.74 3gzj n ASN 51 Ca 0.23 1.22 0.14 0.00 -0.11 0.00 0.00 54.58 56.05 3gzj n ASN 51 Cb 0.85 -1.56 0.50 0.00 1.24 0.00 0.00 39.78 40.81 3gzj n ASN 51 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3gzj n PRO 52 N 0.54 1.13 -2.52 1.20 -0.04 -1.26 -4.60 135.00 129.45 3gzj n PRO 52 Ca 0.03 -0.60 -0.36 0.00 -0.04 0.00 0.00 63.50 62.52 3gzj n PRO 52 Cb 0.37 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 3gzj n PRO 52 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3gzj s ARG 53 N -2.28 4.13 0.25 0.54 1.81 -1.26 -4.99 118.95 117.15 3gzj s ARG 53 Ca 0.31 1.53 0.05 0.00 -1.72 0.00 0.00 55.73 55.90 3gzj s ARG 53 Cb 0.20 -2.52 -0.03 0.00 -0.45 0.00 0.00 34.95 32.15 3gzj s ARG 53 CO 0.44 -0.17 0.37 1.03 -0.68 0.00 0.00 175.30 176.28 3gzj s ARG 54 N -2.53 3.41 0.21 3.54 0.52 -1.26 -3.58 118.95 119.26 3gzj s ARG 54 Ca 0.58 -0.78 -0.09 0.00 -0.52 0.00 0.00 55.73 54.92 3gzj s ARG 54 Cb -0.22 -2.88 0.16 0.00 0.52 0.00 0.00 34.95 32.53 3gzj s ARG 54 CO 0.28 0.40 1.85 1.25 0.02 0.00 0.00 175.30 179.10 3gzj h LEU 55 N 1.15 0.94 0.00 2.53 5.85 -1.91 -2.60 115.31 121.27 3gzj h LEU 55 Ca -0.52 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.14 3gzj h LEU 55 Cb 1.23 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3gzj h LEU 55 CO 0.60 0.73 0.00 -0.90 -0.34 0.00 0.00 178.44 178.54 3gzj n ASP 56 N -4.48 0.00 -1.07 1.25 5.68 -1.26 -0.60 116.55 116.07 3gzj n ASP 56 Ca 0.08 0.19 0.12 0.00 -0.50 0.00 0.00 54.79 54.68 3gzj n ASP 56 Cb 0.06 -0.33 0.22 0.00 -1.14 0.00 0.00 41.12 39.93 3gzj n ASP 56 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3gzj n GLU 57 N -1.33 2.41 -3.86 0.11 0.28 -0.98 -4.78 120.64 112.49 3gzj n GLU 57 Ca 0.05 -2.11 -0.35 0.00 -0.16 0.00 0.00 57.16 54.59 3gzj n GLU 57 Cb 0.11 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.35 3gzj n GLU 57 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3gzj s ILE 58 N -1.60 3.04 -0.05 3.84 1.01 0.23 -4.95 121.20 122.70 3gzj s ILE 58 Ca 0.37 -1.86 0.18 0.00 0.00 0.00 0.00 60.65 59.34 3gzj s ILE 58 Cb 0.22 -2.98 -0.28 0.00 0.01 0.00 0.00 42.46 39.43 3gzj s ILE 58 CO 0.31 -0.47 0.35 1.41 0.00 0.00 0.00 174.94 176.54 3gzj n HIS 59 N 4.55 0.00 -4.32 3.97 8.25 -1.26 -4.95 115.22 121.47 3gzj n HIS 59 Ca -0.05 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.12 3gzj n HIS 59 Cb 0.42 -0.50 -0.11 0.00 1.12 0.00 0.00 29.99 30.92 3gzj n HIS 59 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3gzj s THR 60 N -3.15 2.84 0.32 1.59 -4.23 -1.26 -4.82 115.64 106.93 3gzj s THR 60 Ca -0.07 -1.61 0.07 0.00 -1.18 0.00 0.00 61.69 58.90 3gzj s THR 60 Cb 0.11 -2.33 0.08 0.00 1.34 0.00 0.00 72.50 71.70 3gzj s THR 60 CO 0.77 0.03 1.78 0.15 -0.54 0.00 0.00 174.62 176.80 3gzj h PHE 61 N 3.49 0.30 -0.51 3.99 3.57 -1.92 0.38 116.94 126.24 3gzj h PHE 61 Ca -0.49 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 60.96 3gzj h PHE 61 Cb 1.18 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.82 3gzj h PHE 61 CO 0.62 0.54 0.33 0.00 -2.23 0.00 0.00 178.31 177.58 3gzj h ARG 62 N 0.24 0.66 -0.42 1.11 3.08 -1.97 0.39 114.38 117.46 3gzj h ARG 62 Ca 0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3gzj h ARG 62 Cb 0.64 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 3gzj h ARG 62 CO 0.05 0.43 0.26 -0.44 -1.07 0.00 0.00 179.97 179.20 3gzj h ASP 63 N 0.68 0.50 0.05 7.04 3.32 -1.79 -2.12 116.42 124.09 3gzj h ASP 63 Ca 0.19 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.23 3gzj h ASP 63 Cb -0.06 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.32 3gzj h ASP 63 CO -0.05 0.39 -0.35 0.22 -1.72 0.00 0.00 179.24 177.72 3gzj h TYR 64 N 0.56 -0.98 0.00 4.55 3.20 -0.72 -2.90 116.97 120.68 3gzj h TYR 64 Ca 0.15 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.05 3gzj h TYR 64 Cb -0.03 0.42 0.00 0.00 1.54 0.00 0.00 36.73 38.67 3gzj h TYR 64 CO -0.04 -0.45 0.00 0.43 -1.64 0.00 0.00 178.16 176.46 3gzj n SER 65 N -5.43 0.00 -0.31 -2.11 7.64 0.11 -1.71 113.62 111.81 3gzj n SER 65 Ca -0.06 -0.49 0.14 0.00 1.01 0.00 0.00 58.87 59.47 3gzj n SER 65 Cb 0.34 -0.10 0.32 0.00 -1.01 0.00 0.00 64.21 63.76 3gzj n SER 65 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3gzj h GLU 66 N 0.00 0.43 -0.75 1.43 4.57 -1.17 -0.94 114.58 118.15 3gzj h GLU 66 Ca 0.00 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 3gzj h GLU 66 Cb 0.08 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 3gzj h GLU 66 CO 0.00 0.29 0.46 -1.35 -1.18 0.00 0.00 179.01 177.22 3gzj h PRO 67 N 0.44 1.02 -0.16 0.92 0.11 -1.84 -1.20 132.00 131.30 3gzj h PRO 67 Ca 0.57 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.60 3gzj h PRO 67 Cb 1.07 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 3gzj h PRO 67 CO -0.51 0.71 0.10 1.25 -0.21 0.00 0.00 178.00 179.34 3gzj h LEU 68 N 1.04 0.18 -0.87 2.35 5.85 -1.49 -2.50 115.31 119.86 3gzj h LEU 68 Ca 0.27 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.00 3gzj h LEU 68 Cb -0.05 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 3gzj h LEU 68 CO -0.05 0.15 0.56 0.24 -0.34 0.00 0.00 178.44 179.01 3gzj h MET 69 N 0.20 1.08 -0.69 1.25 2.86 -1.16 -0.15 114.93 118.31 3gzj h MET 69 Ca 0.06 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.71 3gzj h MET 69 Cb -0.00 -0.24 -0.06 0.00 0.06 0.00 0.00 31.60 31.35 3gzj h MET 69 CO -0.01 0.71 0.37 0.93 1.06 0.00 0.00 176.91 179.97 3gzj h GLU 70 N 1.11 0.63 -0.23 1.72 5.08 -1.08 0.36 114.58 122.17 3gzj h GLU 70 Ca 0.34 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.64 3gzj h GLU 70 Cb -0.02 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3gzj h GLU 70 CO -0.11 0.42 0.04 0.28 -1.00 0.00 0.00 179.01 178.64 3gzj h VAL 71 N 0.65 1.23 -0.34 3.13 2.07 -0.79 -2.67 116.25 119.53 3gzj h VAL 71 Ca 0.33 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 67.16 3gzj h VAL 71 Cb 0.27 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 3gzj h VAL 71 CO -0.22 0.24 -0.03 0.24 0.02 0.00 0.00 177.57 177.81 3gzj h MET 72 N 0.18 0.06 0.00 1.57 2.86 -0.37 -2.70 114.93 116.53 3gzj h MET 72 Ca 0.07 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 3gzj h MET 72 Cb 0.32 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 3gzj h MET 72 CO 0.00 0.04 -0.13 0.00 1.06 0.00 0.00 176.91 177.89 3gzj h ALA 73 N 1.31 1.72 -0.01 6.32 0.00 -0.21 -2.63 119.26 125.76 3gzj h ALA 73 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3gzj h ALA 73 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3gzj h ALA 73 CO -0.30 0.16 0.00 -1.13 0.00 0.00 0.00 179.25 177.97 3gzj n SER 74 N -4.29 0.79 -4.70 0.00 3.41 -1.02 -4.87 113.62 102.94 3gzj n SER 74 Ca -0.03 -1.27 -0.42 0.00 -0.26 0.00 0.00 58.87 56.89 3gzj n SER 74 Cb 0.20 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 3gzj n SER 74 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3gzj s ILE 75 N -2.00 3.75 0.25 -1.33 -1.09 -1.00 -4.99 121.20 114.81 3gzj s ILE 75 Ca 0.42 1.21 -0.30 0.00 -2.23 0.00 0.00 60.65 59.75 3gzj s ILE 75 Cb 0.21 -3.77 -0.14 0.00 -1.58 0.00 0.00 42.46 37.18 3gzj s ILE 75 CO 0.35 0.05 1.24 -2.65 -1.23 0.00 0.00 174.94 172.70 3gzj n PRO 76 N 4.56 1.71 0.00 2.79 -0.02 -1.26 -4.81 135.00 137.97 3gzj n PRO 76 Ca 0.11 0.60 0.02 0.00 -2.02 0.00 0.00 63.50 62.22 3gzj n PRO 76 Cb 0.44 -2.15 0.11 0.00 -0.02 0.00 0.00 33.50 31.88 3gzj n PRO 76 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3gzj n PRO 77 N 1.41 0.06 -0.09 0.52 -0.04 -1.26 -1.22 135.00 134.38 3gzj n PRO 77 Ca 0.11 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 63.93 3gzj n PRO 77 Cb 0.31 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.47 3gzj n PRO 77 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3gzj n ASP 78 N -1.29 3.03 -4.25 3.54 4.64 -1.26 -5.01 116.55 115.95 3gzj n ASP 78 Ca 0.02 -1.95 -0.14 0.00 -1.38 0.00 0.00 54.79 51.34 3gzj n ASP 78 Cb 0.03 -0.12 -0.10 0.00 -1.04 0.00 0.00 41.12 39.89 3gzj n ASP 78 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 3gzj s GLU 79 N -1.76 1.11 0.26 -0.67 2.02 -0.35 -5.17 118.70 114.14 3gzj s GLU 79 Ca 0.34 -1.52 0.05 0.00 0.02 0.00 0.00 54.97 53.85 3gzj s GLU 79 Cb 0.21 -0.39 -0.06 0.00 0.10 0.00 0.00 34.13 34.00 3gzj s GLU 79 CO 0.31 -0.07 -0.02 0.15 0.02 0.00 0.00 175.26 175.65 3gzj s LYS 80 N -3.87 1.46 0.15 1.61 1.02 -1.26 -4.70 119.74 114.14 3gzj s LYS 80 Ca 0.22 -1.75 0.08 0.00 0.02 0.00 0.00 55.97 54.55 3gzj s LYS 80 Cb 0.05 -0.85 -0.04 0.00 -0.52 0.00 0.00 37.83 36.47 3gzj s LYS 80 CO 0.03 -0.06 -0.18 0.14 -0.92 0.00 0.00 175.35 174.36 3gzj s VAL 81 N -3.25 1.73 -0.22 3.17 -7.23 -0.14 -4.39 120.40 110.08 3gzj s VAL 81 Ca 0.30 -1.82 -0.09 0.00 -1.81 0.00 0.00 61.98 58.56 3gzj s VAL 81 Cb 0.05 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 3gzj s VAL 81 CO 0.11 -0.28 0.11 -0.69 -0.31 0.00 0.00 175.10 174.03 3gzj s VAL 82 N -1.89 4.98 -0.01 1.32 1.01 0.21 -1.48 120.40 124.55 3gzj s VAL 82 Ca 0.13 0.04 -0.07 0.00 0.00 0.00 0.00 61.98 62.08 3gzj s VAL 82 Cb -0.06 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 3gzj s VAL 82 CO 0.06 0.40 0.26 -0.76 0.00 0.00 0.00 175.10 175.06 3gzj s LEU 83 N 0.82 4.38 -0.05 3.92 1.43 -0.90 -0.23 118.68 128.04 3gzj s LEU 83 Ca 0.05 0.58 -0.02 0.00 -1.03 0.00 0.00 54.13 53.71 3gzj s LEU 83 Cb -0.13 -2.61 0.04 0.00 0.03 0.00 0.00 46.19 43.52 3gzj s LEU 83 CO 0.02 0.27 0.10 -0.22 0.23 0.00 0.00 176.35 176.75 3gzj s LEU 84 N -1.64 0.37 0.09 1.79 2.96 -0.69 -0.69 118.68 120.87 3gzj s LEU 84 Ca 0.26 0.18 0.05 0.00 -0.22 0.00 0.00 54.13 54.40 3gzj s LEU 84 Cb -0.13 0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.60 3gzj s LEU 84 CO 0.15 -0.21 -0.13 -0.83 -1.32 0.00 0.00 176.35 174.01 3gzj s GLY 85 N 1.81 0.90 0.08 7.98 0.00 -0.75 -0.20 107.32 117.13 3gzj s GLY 85 Ca -0.01 -1.12 0.04 0.00 0.00 0.00 0.00 44.72 43.64 3gzj s GLY 85 CO -0.04 -1.17 -0.12 -2.38 0.00 0.00 0.00 173.10 169.39 3gzj s HIS 86 N -1.83 1.09 0.00 1.90 -3.43 -1.10 -1.11 115.29 110.81 3gzj s HIS 86 Ca 0.03 -0.53 0.00 0.00 -0.80 0.00 0.00 55.06 53.75 3gzj s HIS 86 Cb -0.07 -0.61 0.00 0.00 -1.43 0.00 0.00 32.58 30.47 3gzj s HIS 86 CO 0.02 0.02 0.00 0.45 -2.00 0.00 0.00 174.74 173.23 3gzj n SER 87 N 1.03 0.00 0.15 7.38 2.88 -0.22 -0.72 113.62 124.13 3gzj n SER 87 Ca -0.19 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.48 3gzj n SER 87 Cb 0.55 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.52 3gzj n SER 87 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 3gzj h PHE 88 N 0.00 0.00 -0.15 0.66 3.57 -1.88 -2.70 116.94 116.44 3gzj h PHE 88 Ca 0.00 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.54 3gzj h PHE 88 Cb 0.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3gzj h PHE 88 CO 0.00 0.00 0.31 0.78 -2.23 0.00 0.00 178.31 177.17 3gzj h GLY 89 N 2.63 0.00 0.80 2.40 0.00 -1.00 -1.28 103.07 106.62 3gzj h GLY 89 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 3gzj h GLY 89 CO 0.00 0.00 0.50 -1.33 0.00 0.00 0.00 176.54 175.71 3gzj h GLY 90 N 0.00 0.86 1.21 4.60 0.00 -1.64 0.20 103.07 108.31 3gzj h GLY 90 Ca 0.07 -0.24 -0.25 0.00 0.00 0.00 0.00 47.33 46.91 3gzj h GLY 90 CO -0.00 0.11 -0.95 -0.33 0.00 0.00 0.00 176.54 175.37 3gzj h MET 91 N 0.56 0.73 -0.26 4.80 2.07 -1.42 -0.22 114.93 121.19 3gzj h MET 91 Ca 0.36 -0.71 -0.02 0.00 -2.07 0.00 0.00 59.70 57.26 3gzj h MET 91 Cb 0.62 0.19 -0.01 0.00 -1.87 0.00 0.00 31.60 30.52 3gzj h MET 91 CO -0.13 1.30 0.09 0.77 1.07 0.00 0.00 176.91 180.01 3gzj h SER 92 N 0.44 0.36 -0.65 1.22 0.02 -1.53 -0.44 113.55 112.98 3gzj h SER 92 Ca -0.10 -0.18 0.14 0.00 -0.84 0.00 0.00 61.79 60.80 3gzj h SER 92 Cb 1.60 -0.09 -0.11 0.00 0.14 0.00 0.00 62.40 63.93 3gzj h SER 92 CO 0.19 0.45 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.24 3gzj h LEU 93 N 0.26 -0.33 -0.05 5.07 4.07 -0.56 -0.09 115.31 123.68 3gzj h LEU 93 Ca 0.08 0.17 0.04 0.00 0.08 0.00 0.00 57.88 58.25 3gzj h LEU 93 Cb 0.21 0.30 -0.05 0.00 1.08 0.00 0.00 40.66 42.20 3gzj h LEU 93 CO -0.00 -0.14 -0.25 1.23 -1.08 0.00 0.00 178.44 178.20 3gzj h GLY 94 N 0.10 -0.34 0.97 0.83 0.00 -0.64 0.42 103.07 104.42 3gzj h GLY 94 Ca 0.34 0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.98 3gzj h GLY 94 CO -0.57 -0.20 0.30 -2.00 0.00 0.00 0.00 176.54 174.07 3gzj h LEU 95 N -0.36 0.51 -0.97 3.11 5.85 -0.66 0.43 115.31 123.22 3gzj h LEU 95 Ca 0.08 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.81 3gzj h LEU 95 Cb 0.47 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 3gzj h LEU 95 CO -0.25 0.37 0.64 0.00 -0.34 0.00 0.00 178.44 178.86 3gzj h ALA 96 N 1.19 1.25 -0.68 1.25 0.00 -0.42 -0.67 119.26 121.19 3gzj h ALA 96 Ca 0.18 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3gzj h ALA 96 Cb -0.04 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.34 3gzj h ALA 96 CO -0.05 0.59 0.12 0.52 0.00 0.00 0.00 179.25 180.42 3gzj h MET 97 N 1.29 1.12 -0.60 0.00 2.86 0.51 0.45 114.93 120.55 3gzj h MET 97 Ca 0.37 -0.30 -0.07 0.00 -2.06 0.00 0.00 59.70 57.64 3gzj h MET 97 Cb -0.10 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 3gzj h MET 97 CO -0.09 1.02 0.11 1.49 1.06 0.00 0.00 176.91 180.49 3gzj h GLU 98 N 1.04 0.99 0.07 1.72 4.57 -0.67 -3.21 114.58 119.08 3gzj h GLU 98 Ca 0.21 -0.26 -0.15 0.00 -1.18 0.00 0.00 59.36 57.98 3gzj h GLU 98 Cb 0.44 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 3gzj h GLU 98 CO 0.01 0.93 -0.72 1.15 -1.18 0.00 0.00 179.01 179.20 3gzj h THR 99 N 0.90 1.43 -2.27 0.32 2.02 -0.83 -3.41 112.91 111.07 3gzj h THR 99 Ca 0.18 -2.40 -0.58 0.00 0.77 0.00 0.00 66.41 64.38 3gzj h THR 99 Cb 0.41 3.04 -0.42 0.00 -1.74 0.00 0.00 68.15 69.44 3gzj h THR 99 CO 0.01 0.62 -0.67 -1.22 0.37 0.00 0.00 175.52 174.63 3gzj n TYR 100 N -4.29 3.79 -0.06 3.16 4.01 0.16 -4.93 117.16 119.00 3gzj n TYR 100 Ca -0.17 -4.00 -0.01 0.00 -0.16 0.00 0.00 57.90 53.56 3gzj n TYR 100 Cb 0.70 -0.49 0.26 0.00 -0.31 0.00 0.00 39.34 39.50 3gzj n TYR 100 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3gzj h PRO 101 N 3.05 0.65 0.00 -0.72 0.13 -1.73 -1.69 132.00 131.70 3gzj h PRO 101 Ca 0.13 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3gzj h PRO 101 Cb 0.54 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.57 3gzj h PRO 101 CO 0.80 0.63 0.00 -0.85 -0.23 0.00 0.00 178.00 178.35 3gzj n GLU 102 N -4.28 0.65 0.00 0.86 0.00 -1.26 -2.68 120.64 113.92 3gzj n GLU 102 Ca 0.03 0.02 0.11 0.00 0.00 0.00 0.00 57.16 57.32 3gzj n GLU 102 Cb 0.23 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.20 3gzj n GLU 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3gzj n LYS 103 N -1.12 1.61 -4.04 3.44 4.76 -0.63 -4.84 118.16 117.33 3gzj n LYS 103 Ca 0.17 -1.32 -0.34 0.00 -2.87 0.00 0.00 58.31 53.95 3gzj n LYS 103 Cb 0.14 -1.46 -0.15 0.00 -1.84 0.00 0.00 35.03 31.71 3gzj n LYS 103 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3gzj s ILE 104 N -2.29 2.51 0.09 -0.18 1.01 -1.09 -0.97 121.20 120.28 3gzj s ILE 104 Ca 0.22 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 59.74 3gzj s ILE 104 Cb 0.19 -2.17 -0.08 0.00 0.01 0.00 0.00 42.46 40.40 3gzj s ILE 104 CO 0.47 0.38 1.51 0.77 0.00 0.00 0.00 174.94 178.06 3gzj h SER 105 N 7.97 0.48 -3.71 3.58 4.64 -1.57 -3.44 113.55 121.50 3gzj h SER 105 Ca -0.39 -0.33 -0.07 0.00 -0.47 0.00 0.00 61.79 60.52 3gzj h SER 105 Cb 1.13 -0.13 -0.23 0.00 -0.31 0.00 0.00 62.40 62.86 3gzj h SER 105 CO 0.60 0.69 -0.08 0.54 -0.87 0.00 0.00 176.83 177.71 3gzj s VAL 106 N -4.90 -0.00 -0.30 0.95 0.11 -1.26 -4.18 120.40 110.83 3gzj s VAL 106 Ca -0.14 0.01 -0.13 0.00 -2.93 0.00 0.00 61.98 58.80 3gzj s VAL 106 Cb 0.08 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 3gzj s VAL 106 CO 0.76 0.01 0.27 0.00 -3.33 0.00 0.00 175.10 172.80 3gzj s ALA 107 N 0.63 3.53 -0.23 1.54 0.00 -0.04 -2.12 121.76 125.07 3gzj s ALA 107 Ca -0.03 -1.09 -0.08 0.00 0.00 0.00 0.00 51.96 50.76 3gzj s ALA 107 Cb -0.05 -2.62 -0.03 0.00 0.00 0.00 0.00 23.12 20.42 3gzj s ALA 107 CO -0.04 -0.72 0.08 0.08 0.00 0.00 0.00 175.76 175.16 3gzj s VAL 108 N 1.87 4.53 -0.30 0.00 1.01 0.13 0.07 120.40 127.71 3gzj s VAL 108 Ca 0.09 -0.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 3gzj s VAL 108 Cb -0.16 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.13 3gzj s VAL 108 CO 0.11 0.36 0.07 -0.36 0.00 0.00 0.00 175.10 175.28 3gzj s PHE 109 N 1.27 3.16 -0.31 5.22 0.08 -0.10 -1.82 117.98 125.48 3gzj s PHE 109 Ca 0.05 -1.10 -0.03 0.00 0.12 0.00 0.00 56.93 55.97 3gzj s PHE 109 Cb -0.15 -2.24 0.05 0.00 -0.57 0.00 0.00 43.02 40.11 3gzj s PHE 109 CO 0.04 -0.62 0.03 1.41 -0.10 0.00 0.00 175.22 175.98 3gzj s MET 110 N 1.47 2.45 -1.42 0.44 -2.45 -0.26 0.10 119.30 119.63 3gzj s MET 110 Ca 0.02 -1.27 -0.11 0.00 -1.25 0.00 0.00 55.69 53.07 3gzj s MET 110 Cb -0.18 -3.26 0.01 0.00 1.25 0.00 0.00 34.83 32.66 3gzj s MET 110 CO 0.02 -0.65 0.29 0.45 1.05 0.00 0.00 175.02 176.18 3gzj n SER 111 N 4.66 -0.96 -4.20 1.11 2.88 -0.44 -3.58 113.62 113.09 3gzj n SER 111 Ca -0.12 -1.24 -0.19 0.00 -1.33 0.00 0.00 58.87 55.99 3gzj n SER 111 Cb 0.44 -1.90 -0.12 0.00 -0.75 0.00 0.00 64.21 61.88 3gzj n SER 111 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gzj s ALA 112 N -4.04 1.32 0.14 -1.46 0.00 -1.26 -1.06 121.76 115.41 3gzj s ALA 112 Ca 0.16 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.71 3gzj s ALA 112 Cb -0.09 -0.10 -0.08 0.00 0.00 0.00 0.00 23.12 22.85 3gzj s ALA 112 CO 0.97 0.16 1.26 0.00 0.00 0.00 0.00 175.76 178.15 3gzj s MET 113 N -2.04 4.42 -0.35 0.00 0.00 -1.22 -4.89 119.30 115.22 3gzj s MET 113 Ca 0.02 1.92 -0.09 0.00 0.00 0.00 0.00 55.69 57.54 3gzj s MET 113 Cb -0.08 -3.26 0.03 0.00 0.00 0.00 0.00 34.83 31.51 3gzj s MET 113 CO 0.03 -0.23 0.17 1.41 0.00 0.00 0.00 175.02 176.40 3gzj s MET 114 N 0.36 2.84 1.03 3.16 1.75 -1.26 -4.34 119.30 122.84 3gzj s MET 114 Ca 0.57 -1.06 -0.13 0.00 -1.25 0.00 0.00 55.69 53.83 3gzj s MET 114 Cb -0.33 -3.63 0.16 0.00 2.84 0.00 0.00 34.83 33.86 3gzj s MET 114 CO 0.34 -0.65 0.77 -2.30 -0.65 0.00 0.00 175.02 172.53 3gzj n PRO 115 N 4.94 -1.18 -3.86 4.11 -0.02 -1.26 -4.97 135.00 132.77 3gzj n PRO 115 Ca -0.12 -0.30 -0.23 0.00 -2.02 0.00 0.00 63.50 60.83 3gzj n PRO 115 Cb 0.46 -2.10 -0.17 0.00 -0.02 0.00 0.00 33.50 31.67 3gzj n PRO 115 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3gzj s ASP 116 N -2.31 1.60 0.00 2.55 -1.08 -1.26 -5.01 116.67 111.16 3gzj s ASP 116 Ca 0.63 -0.13 0.18 0.00 -0.52 0.00 0.00 52.55 52.71 3gzj s ASP 116 Cb -0.22 -0.52 1.01 0.00 -1.46 0.00 0.00 42.92 41.74 3gzj s ASP 116 CO 0.63 -0.16 1.51 -0.81 0.52 0.00 0.00 175.17 176.86 3gzj n PRO 117 N 4.94 0.44 0.00 4.34 -0.04 -1.26 -2.41 135.00 141.01 3gzj n PRO 117 Ca -0.11 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.53 3gzj n PRO 117 Cb 0.50 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.78 3gzj n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3gzj n ASN 118 N -1.12 1.78 -4.39 3.54 3.02 -1.26 -4.61 115.26 112.22 3gzj n ASN 118 Ca 0.12 -1.46 -0.19 0.00 -0.03 0.00 0.00 54.58 53.01 3gzj n ASN 118 Cb 0.09 0.10 -0.10 0.00 -0.61 0.00 0.00 39.78 39.26 3gzj n ASN 118 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3gzj s HIS 119 N -2.19 1.77 0.80 3.10 3.76 -1.01 -5.14 115.29 116.37 3gzj s HIS 119 Ca 0.30 -1.02 -0.11 0.00 -0.15 0.00 0.00 55.06 54.08 3gzj s HIS 119 Cb 0.20 -1.10 0.07 0.00 1.11 0.00 0.00 32.58 32.86 3gzj s HIS 119 CO 0.41 -0.10 1.09 -1.54 -0.85 0.00 0.00 174.74 173.74 3gzj s SER 120 N -3.40 4.40 0.59 1.40 1.04 -1.26 -4.62 113.70 111.85 3gzj s SER 120 Ca 0.35 1.58 0.36 0.00 0.48 0.00 0.00 55.95 58.72 3gzj s SER 120 Cb 0.08 -2.32 1.84 0.00 0.10 0.00 0.00 66.02 65.72 3gzj s SER 120 CO 0.14 -2.07 2.18 -0.07 0.98 0.00 0.00 173.24 174.41 3gzj h LEU 121 N -1.15 0.00 0.00 2.42 3.38 -1.86 -2.67 115.31 115.43 3gzj h LEU 121 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3gzj h LEU 121 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3gzj h LEU 121 CO 0.55 0.04 0.00 0.35 0.09 0.00 0.00 178.44 179.47 3gzj n THR 122 N -3.32 0.11 -0.23 0.22 -2.24 -1.26 -4.31 114.28 103.25 3gzj n THR 122 Ca -0.02 0.03 -0.06 0.00 -2.27 0.00 0.00 64.05 61.73 3gzj n THR 122 Cb 0.18 -0.56 0.04 0.00 -2.10 0.00 0.00 70.33 67.89 3gzj n THR 122 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3gzj h TYR 123 N 0.00 0.86 -0.02 4.78 3.20 -1.85 -0.04 116.97 123.89 3gzj h TYR 123 Ca 0.00 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 3gzj h TYR 123 Cb 0.40 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 3gzj h TYR 123 CO 0.00 0.60 0.02 -1.35 -1.64 0.00 0.00 178.16 175.79 3gzj h PRO 124 N 0.87 0.00 0.03 1.82 0.11 -1.82 -1.03 132.00 131.98 3gzj h PRO 124 Ca 0.23 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 66.05 3gzj h PRO 124 Cb 0.01 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.08 3gzj h PRO 124 CO -0.04 0.00 -1.59 0.74 -0.21 0.00 0.00 178.00 176.91 3gzj h PHE 125 N 0.00 0.11 -0.09 0.65 0.04 -1.48 -2.09 116.94 114.08 3gzj h PHE 125 Ca 0.01 -0.08 -0.12 0.00 2.80 0.00 0.00 57.97 60.58 3gzj h PHE 125 Cb 0.05 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 3gzj h PHE 125 CO 0.00 1.13 -0.48 0.93 -0.60 0.00 0.00 178.31 179.29 3gzj h GLU 126 N 0.02 0.23 -0.24 1.51 5.08 -0.82 -2.78 114.58 117.57 3gzj h GLU 126 Ca -0.24 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 57.87 3gzj h GLU 126 Cb 1.97 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.22 3gzj h GLU 126 CO 0.10 0.66 -0.35 0.87 -1.00 0.00 0.00 179.01 179.29 3gzj h LYS 127 N 0.18 0.52 -0.01 2.33 1.79 -1.15 -2.31 116.57 117.93 3gzj h LYS 127 Ca 0.01 -0.24 -0.00 0.00 -2.18 0.00 0.00 60.65 58.24 3gzj h LYS 127 Cb 0.92 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.56 3gzj h LYS 127 CO 0.07 0.80 0.00 -0.92 -1.08 0.00 0.00 179.45 178.33 3gzj h TYR 128 N 0.44 0.01 -0.61 -1.35 3.20 -1.37 -0.77 116.97 116.53 3gzj h TYR 128 Ca 0.05 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.04 3gzj h TYR 128 Cb 0.82 -0.00 -0.11 0.00 1.54 0.00 0.00 36.73 38.98 3gzj h TYR 128 CO 0.03 0.15 -0.03 -0.91 -1.64 0.00 0.00 178.16 175.76 3gzj h ASN 129 N -0.13 -0.33 -0.41 -2.11 2.35 -1.46 0.21 115.58 113.70 3gzj h ASN 129 Ca 0.00 0.16 0.03 0.00 -0.55 0.00 0.00 56.30 55.94 3gzj h ASN 129 Cb 0.14 0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.76 3gzj h ASN 129 CO -0.00 -0.13 0.21 -0.08 -1.65 0.00 0.00 177.43 175.77 3gzj h GLU 130 N 0.09 0.40 0.00 0.81 4.81 -1.21 -3.24 114.58 116.24 3gzj h GLU 130 Ca 0.31 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 3gzj h GLU 130 Cb 0.50 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3gzj h GLU 130 CO -0.54 0.27 -1.09 1.63 -0.73 0.00 0.00 179.01 178.55 3gzj n LYS 131 N -4.92 0.41 -4.45 1.92 5.02 -0.31 -4.92 118.16 110.91 3gzj n LYS 131 Ca 0.02 0.02 -0.30 0.00 -2.02 0.00 0.00 58.31 56.02 3gzj n LYS 131 Cb 0.10 -1.65 -0.11 0.00 -0.02 0.00 0.00 35.03 33.34 3gzj n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gzj s PRO 133 N -1.79 1.90 0.00 0.00 0.04 -1.26 -4.64 135.00 129.25 3gzj s PRO 133 Ca 0.17 1.10 0.16 0.00 0.04 0.00 0.00 61.00 62.47 3gzj s PRO 133 Cb -0.11 -1.86 0.68 0.00 0.04 0.00 0.00 34.50 33.25 3gzj s PRO 133 CO 0.09 -1.87 1.50 0.00 0.04 0.00 0.00 177.00 176.76 3gzj n ALA 134 N -3.67 1.73 -0.73 8.56 0.00 -1.26 -2.43 120.51 122.71 3gzj n ALA 134 Ca 0.09 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.55 3gzj n ALA 134 Cb 0.54 -1.25 0.34 0.00 0.00 0.00 0.00 19.45 19.07 3gzj n ALA 134 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3gzj n ASP 135 N -1.49 4.73 -0.33 0.00 5.68 -1.26 -4.68 116.55 119.20 3gzj n ASP 135 Ca 0.04 -2.65 0.22 0.00 -0.50 0.00 0.00 54.79 51.91 3gzj n ASP 135 Cb 0.18 -0.57 0.45 0.00 -1.14 0.00 0.00 41.12 40.04 3gzj n ASP 135 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 3gzj h MET 136 N 3.48 0.35 -0.71 0.11 4.05 -1.85 -2.51 114.93 117.85 3gzj h MET 136 Ca 0.00 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.40 3gzj h MET 136 Cb 1.54 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 32.26 3gzj h MET 136 CO 0.28 0.23 0.00 -1.33 0.23 0.00 0.00 176.91 176.33 3gzj n MET 137 N -5.03 3.70 0.00 0.39 2.81 -1.26 -5.00 117.12 112.73 3gzj n MET 137 Ca 0.31 -2.18 0.00 0.00 -1.81 0.00 0.00 57.70 54.02 3gzj n MET 137 Cb 0.94 -2.03 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 3gzj n MET 137 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3gzj n LEU 138 N 0.43 0.00 -1.28 4.03 4.77 -0.95 -0.69 117.00 123.31 3gzj n LEU 138 Ca 0.19 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.23 3gzj n LEU 138 Cb 0.91 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 42.26 3gzj n LEU 138 CO 0.23 0.00 0.69 -0.90 -1.33 0.00 0.00 177.39 176.08 3gzj n ASP 139 N 5.30 3.74 -4.74 -1.43 5.75 -1.26 -4.92 116.55 118.99 3gzj n ASP 139 Ca 0.00 -2.40 -0.36 0.00 -0.01 0.00 0.00 54.79 52.01 3gzj n ASP 139 Cb 0.00 -0.52 0.06 0.00 -1.03 0.00 0.00 41.12 39.63 3gzj n ASP 139 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 3gzj s SER 140 N -0.72 4.76 -0.03 -1.12 0.01 0.14 -4.08 113.70 112.66 3gzj s SER 140 Ca 0.37 2.51 0.03 0.00 1.31 0.00 0.00 55.95 60.17 3gzj s SER 140 Cb 0.25 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.87 3gzj s SER 140 CO 0.16 -1.89 -0.11 -1.10 0.41 0.00 0.00 173.24 170.70 3gzj s GLN 141 N -3.42 1.19 0.00 12.44 -0.21 -0.90 -4.86 119.66 123.90 3gzj s GLN 141 Ca 0.80 -0.39 0.07 0.00 0.02 0.00 0.00 55.36 55.86 3gzj s GLN 141 Cb -0.34 -1.08 -0.02 0.00 1.00 0.00 0.00 33.01 32.57 3gzj s GLN 141 CO 0.38 0.15 -0.22 -0.06 -2.12 0.00 0.00 175.29 173.43 3gzj s PHE 142 N 0.13 1.93 -0.07 0.91 0.08 -1.26 -1.62 117.98 118.08 3gzj s PHE 142 Ca -0.03 -0.37 -0.24 0.00 0.12 0.00 0.00 56.93 56.41 3gzj s PHE 142 Cb -0.09 -1.21 0.05 0.00 -0.57 0.00 0.00 43.02 41.20 3gzj s PHE 142 CO 0.01 0.01 0.55 -1.54 -0.10 0.00 0.00 175.22 174.15 3gzj s SER 143 N -0.75 -0.50 0.72 1.36 1.04 0.13 -4.95 113.70 110.74 3gzj s SER 143 Ca 0.08 0.61 -0.13 0.00 0.48 0.00 0.00 55.95 56.99 3gzj s SER 143 Cb -0.09 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.66 3gzj s SER 143 CO 0.00 -0.48 1.12 0.42 0.98 0.00 0.00 173.24 175.28 3gzj s THR 144 N -0.93 3.09 0.18 2.02 -4.23 -1.26 0.27 115.64 114.77 3gzj s THR 144 Ca -0.10 0.45 -0.17 0.00 -1.18 0.00 0.00 61.69 60.69 3gzj s THR 144 Cb -0.02 -2.93 0.03 0.00 1.34 0.00 0.00 72.50 70.92 3gzj s THR 144 CO 0.06 -0.37 0.50 -0.72 -0.54 0.00 0.00 174.62 173.55 3gzj s TYR 145 N -2.49 -0.16 0.00 3.99 -0.85 -0.84 -4.77 117.35 112.22 3gzj s TYR 145 Ca 0.66 -0.16 0.00 0.00 -0.52 0.00 0.00 57.07 57.05 3gzj s TYR 145 Cb -0.21 0.37 0.00 0.00 0.38 0.00 0.00 41.96 42.50 3gzj s TYR 145 CO 0.47 -0.86 0.00 0.41 -1.52 0.00 0.00 175.55 174.06 3gzj n GLY 146 N -0.31 0.95 3.56 5.49 0.00 -1.26 -0.64 105.19 112.98 3gzj n GLY 146 Ca -0.12 -1.30 -0.38 0.00 0.00 0.00 0.00 46.02 44.22 3gzj n GLY 146 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3gzj s ASN 147 N -4.00 4.96 0.00 1.61 3.84 -1.26 -4.79 114.94 115.30 3gzj s ASN 147 Ca 0.00 0.91 0.05 0.00 0.21 0.00 0.00 52.86 54.03 3gzj s ASN 147 Cb 0.00 -2.51 0.29 0.00 -0.55 0.00 0.00 41.25 38.48 3gzj s ASN 147 CO 0.00 -2.51 0.67 -0.81 -2.79 0.00 0.00 177.10 171.66 3gzj n PRO 148 N 8.99 0.31 0.00 0.43 -0.04 -1.26 -1.53 135.00 141.91 3gzj n PRO 148 Ca 0.29 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 3gzj n PRO 148 Cb 0.52 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 3gzj n PRO 148 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3gzj n GLU 149 N -0.75 0.00 -2.77 0.54 -0.58 -1.26 -4.75 120.64 111.08 3gzj n GLU 149 Ca 0.04 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.35 3gzj n GLU 149 Cb 0.02 -0.02 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 3gzj n GLU 149 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 3gzj s ASN 150 N -1.00 6.55 0.39 1.62 3.84 -1.14 -5.04 114.94 120.16 3gzj s ASN 150 Ca 0.00 -1.74 -0.06 0.00 0.21 0.00 0.00 52.86 51.27 3gzj s ASN 150 Cb 0.00 -2.47 -0.05 0.00 -0.55 0.00 0.00 41.25 38.18 3gzj s ASN 150 CO 0.00 -1.27 0.69 -2.16 -2.79 0.00 0.00 177.10 171.57 3gzj s PRO 151 N 3.72 3.64 0.84 0.43 0.04 -0.58 -4.27 135.00 138.82 3gzj s PRO 151 Ca 0.38 0.17 -0.12 0.00 0.04 0.00 0.00 61.00 61.47 3gzj s PRO 151 Cb -0.03 -2.49 0.12 0.00 0.04 0.00 0.00 34.50 32.14 3gzj s PRO 151 CO -0.09 0.01 1.19 0.20 0.04 0.00 0.00 177.00 178.35 3gzj s GLY 152 N -3.52 1.69 -0.19 0.56 0.00 0.19 -4.88 107.32 101.17 3gzj s GLY 152 Ca 0.47 -0.96 -0.01 0.00 0.00 0.00 0.00 44.72 44.21 3gzj s GLY 152 CO 0.35 -0.38 -0.11 -0.29 0.00 0.00 0.00 173.10 172.68 3gzj s MET 153 N -5.61 3.27 0.19 2.90 1.75 -1.26 -1.98 119.30 118.55 3gzj s MET 153 Ca 0.66 -0.70 0.03 0.00 -1.25 0.00 0.00 55.69 54.43 3gzj s MET 153 Cb -0.08 -2.79 -0.03 0.00 2.84 0.00 0.00 34.83 34.77 3gzj s MET 153 CO 0.49 -0.09 0.32 -1.54 -0.65 0.00 0.00 175.02 173.55 3gzj s SER 154 N 1.13 6.34 0.05 1.11 1.04 0.14 -4.40 113.70 119.11 3gzj s SER 154 Ca 0.01 0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.63 3gzj s SER 154 Cb -0.14 -1.90 -0.03 0.00 0.10 0.00 0.00 66.02 64.05 3gzj s SER 154 CO -0.03 -0.00 -0.09 0.00 0.98 0.00 0.00 173.24 174.10 3gzj s MET 155 N -3.51 0.59 -0.07 4.02 0.23 0.98 -0.69 119.30 120.85 3gzj s MET 155 Ca 0.35 -0.82 0.02 0.00 -1.03 0.00 0.00 55.69 54.21 3gzj s MET 155 Cb -0.10 -0.37 0.01 0.00 -1.53 0.00 0.00 34.83 32.84 3gzj s MET 155 CO 0.29 0.07 -0.13 0.96 -2.03 0.00 0.00 175.02 174.18 3gzj s ILE 156 N -1.49 1.18 0.10 3.16 -4.36 -0.64 -0.21 121.20 118.93 3gzj s ILE 156 Ca -0.08 -0.50 -0.31 0.00 -0.26 0.00 0.00 60.65 59.51 3gzj s ILE 156 Cb -0.09 -1.08 -0.08 0.00 1.25 0.00 0.00 42.46 42.46 3gzj s ILE 156 CO 0.00 0.37 1.44 -0.76 0.24 0.00 0.00 174.94 176.23 3gzj s LEU 157 N 0.70 4.36 0.47 0.37 1.43 -1.26 -2.11 118.68 122.64 3gzj s LEU 157 Ca -0.14 2.34 -0.21 0.00 -1.03 0.00 0.00 54.13 55.09 3gzj s LEU 157 Cb -0.16 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.40 3gzj s LEU 157 CO 0.03 -0.71 1.07 -0.83 0.23 0.00 0.00 176.35 176.14 3gzj s GLY 158 N 1.40 2.60 0.24 -3.19 0.00 -1.26 -4.86 107.32 102.25 3gzj s GLY 158 Ca 0.66 0.69 -0.05 0.00 0.00 0.00 0.00 44.72 46.02 3gzj s GLY 158 CO 0.30 1.05 1.77 -0.56 0.00 0.00 0.00 173.10 175.67 3gzj h PRO 159 N 1.76 0.60 -0.24 2.90 0.13 -1.95 -1.54 132.00 133.66 3gzj h PRO 159 Ca -0.49 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.43 3gzj h PRO 159 Cb 1.23 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3gzj h PRO 159 CO 0.60 0.40 -0.54 0.37 -0.23 0.00 0.00 178.00 178.59 3gzj h GLN 160 N 0.62 0.71 -0.66 0.86 4.15 -1.93 -0.95 115.11 117.91 3gzj h GLN 160 Ca 0.39 -0.45 0.05 0.00 0.77 0.00 0.00 58.65 59.41 3gzj h GLN 160 Cb 0.45 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.14 3gzj h GLN 160 CO -0.30 1.07 0.38 0.35 -1.93 0.00 0.00 178.83 178.40 3gzj h PHE 161 N 0.55 0.70 -0.02 3.99 3.57 -1.76 -0.90 116.94 123.06 3gzj h PHE 161 Ca 0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3gzj h PHE 161 Cb 1.12 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 3gzj h PHE 161 CO 0.06 0.35 -0.02 0.52 -2.23 0.00 0.00 178.31 176.99 3gzj h MET 162 N 0.71 0.05 -0.02 1.11 2.86 -1.22 0.43 114.93 118.86 3gzj h MET 162 Ca 0.29 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 3gzj h MET 162 Cb 0.14 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 3gzj h MET 162 CO -0.16 0.48 0.01 0.00 1.06 0.00 0.00 176.91 178.30 3gzj h ALA 163 N 0.57 0.02 0.04 6.32 0.00 -1.03 0.15 119.26 125.33 3gzj h ALA 163 Ca 0.00 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.55 3gzj h ALA 163 Cb 0.47 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3gzj h ALA 163 CO 0.00 -0.43 -1.76 -0.07 0.00 0.00 0.00 179.25 176.99 3gzj h LEU 164 N -0.07 0.13 -0.98 0.00 3.38 -1.28 -3.14 115.31 113.35 3gzj h LEU 164 Ca 0.01 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3gzj h LEU 164 Cb 0.10 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3gzj h LEU 164 CO -0.00 1.25 -0.12 0.29 0.09 0.00 0.00 178.44 179.95 3gzj n LYS 165 N -3.19 1.46 0.00 1.13 5.02 0.15 -4.66 118.16 118.08 3gzj n LYS 165 Ca -0.21 -0.77 0.00 0.00 -2.02 0.00 0.00 58.31 55.31 3gzj n LYS 165 Cb 1.05 -1.11 0.00 0.00 -0.02 0.00 0.00 35.03 34.95 3gzj n LYS 165 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3gzj n MET 166 N 0.04 0.00 -0.71 1.97 2.81 -1.02 -2.61 117.12 117.60 3gzj n MET 166 Ca 0.05 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.93 3gzj n MET 166 Cb 0.22 -0.71 0.20 0.00 -0.71 0.00 0.00 33.22 32.22 3gzj n MET 166 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 3gzj n PHE 167 N -2.07 0.83 0.38 2.03 3.72 0.49 -2.80 117.46 120.04 3gzj n PHE 167 Ca 0.00 -1.50 0.12 0.00 -0.05 0.00 0.00 57.45 56.02 3gzj n PHE 167 Cb 0.25 -0.42 0.25 0.00 -0.94 0.00 0.00 39.48 38.63 3gzj n PHE 167 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3gzj h GLN 168 N 1.02 0.00 -0.51 -1.08 -0.00 -1.75 -2.37 115.11 110.42 3gzj h GLN 168 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 3gzj h GLN 168 Cb 1.49 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.97 3gzj h GLN 168 CO 0.29 0.00 0.00 0.09 -0.00 0.00 0.00 178.83 179.21 3gzj n ASN 169 N -2.74 3.63 -4.99 0.06 3.02 -1.26 -4.99 115.26 108.00 3gzj n ASN 169 Ca 0.04 -2.15 -0.19 0.00 -0.03 0.00 0.00 54.58 52.25 3gzj n ASN 169 Cb 0.49 -0.39 -0.01 0.00 -0.61 0.00 0.00 39.78 39.26 3gzj n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gzj s SER 171 N -4.14 4.97 0.40 0.00 1.04 -1.26 -4.88 113.70 109.83 3gzj s SER 171 Ca 0.43 2.29 0.26 0.00 0.48 0.00 0.00 55.95 59.41 3gzj s SER 171 Cb -0.09 -2.59 1.43 0.00 0.10 0.00 0.00 66.02 64.87 3gzj s SER 171 CO 0.31 -1.74 1.80 0.58 0.98 0.00 0.00 173.24 175.17 3gzj h VAL 172 N 0.45 0.00 -0.06 5.02 2.07 -1.98 -2.02 116.25 119.73 3gzj h VAL 172 Ca -0.49 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 3gzj h VAL 172 Cb 1.28 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 3gzj h VAL 172 CO 0.54 0.00 -0.15 -0.33 0.02 0.00 0.00 177.57 177.65 3gzj h GLU 173 N 0.00 0.20 -0.17 1.57 3.07 -1.98 -0.87 114.58 116.40 3gzj h GLU 173 Ca 0.00 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 58.65 3gzj h GLU 173 Cb 0.04 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 3gzj h GLU 173 CO 0.00 0.75 -0.18 -0.44 -1.40 0.00 0.00 179.01 177.74 3gzj h ASP 174 N -0.31 0.27 -0.19 1.42 3.32 -1.74 0.21 116.42 119.41 3gzj h ASP 174 Ca -0.00 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 3gzj h ASP 174 Cb 0.76 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3gzj h ASP 174 CO 0.03 0.48 -0.14 0.25 -1.72 0.00 0.00 179.24 178.14 3gzj h LEU 175 N 0.26 0.45 -0.64 1.55 5.85 -1.45 0.33 115.31 121.66 3gzj h LEU 175 Ca 0.05 -0.45 0.06 0.00 0.84 0.00 0.00 57.88 58.38 3gzj h LEU 175 Cb 0.48 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 3gzj h LEU 175 CO 0.03 0.80 0.34 -0.08 -0.34 0.00 0.00 178.44 179.19 3gzj h GLU 176 N 0.10 0.61 -0.35 1.25 4.57 -0.64 0.43 114.58 120.54 3gzj h GLU 176 Ca 0.04 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.19 3gzj h GLU 176 Cb 0.66 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 3gzj h GLU 176 CO 0.04 0.40 0.21 1.25 -1.18 0.00 0.00 179.01 179.73 3gzj h LEU 177 N 0.63 0.35 -0.74 1.64 5.85 -0.42 -2.40 115.31 120.22 3gzj h LEU 177 Ca 0.29 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 3gzj h LEU 177 Cb 0.21 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 3gzj h LEU 177 CO -0.20 0.25 0.27 0.00 -0.34 0.00 0.00 178.44 178.43 3gzj h ALA 178 N 1.15 0.96 0.00 1.25 0.00 -0.19 -1.70 119.26 120.73 3gzj h ALA 178 Ca 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3gzj h ALA 178 Cb -0.01 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 3gzj h ALA 178 CO -0.06 0.61 -0.05 0.87 0.00 0.00 0.00 179.25 180.62 3gzj h LYS 179 N 1.07 0.00 0.02 0.00 1.57 -0.45 -0.55 116.57 118.24 3gzj h LYS 179 Ca 0.24 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.79 3gzj h LYS 179 Cb 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 3gzj h LYS 179 CO -0.02 0.05 -1.12 0.52 -0.57 0.00 0.00 179.45 178.32 3gzj h MET 180 N 0.00 0.05 0.00 3.15 2.86 -0.98 -3.39 114.93 116.62 3gzj h MET 180 Ca -0.00 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3gzj h MET 180 Cb 0.23 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.93 3gzj h MET 180 CO 0.01 1.00 -0.69 1.28 1.06 0.00 0.00 176.91 179.56 3gzj n LEU 181 N -3.36 0.50 -4.77 1.22 4.77 -0.54 -4.99 117.00 109.83 3gzj n LEU 181 Ca -0.03 -0.44 -0.40 0.00 -0.03 0.00 0.00 56.01 55.10 3gzj n LEU 181 Cb 0.97 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.03 3gzj n LEU 181 CO 0.48 0.13 0.91 0.28 -1.33 0.00 0.00 177.39 177.86 3gzj s THR 182 N -2.23 2.99 0.19 -5.08 -1.32 -0.33 -4.70 115.64 105.17 3gzj s THR 182 Ca 0.03 1.00 0.08 0.00 -1.21 0.00 0.00 61.69 61.59 3gzj s THR 182 Cb 0.09 -3.63 -0.04 0.00 -1.51 0.00 0.00 72.50 67.40 3gzj s THR 182 CO 0.50 0.24 -0.15 -0.13 -2.21 0.00 0.00 174.62 172.87 3gzj s ARG 183 N -1.68 1.28 0.51 7.08 0.52 -1.21 -5.04 118.95 120.41 3gzj s ARG 183 Ca 0.47 -1.52 -0.22 0.00 -0.52 0.00 0.00 55.73 53.95 3gzj s ARG 183 Cb -0.37 -1.12 -0.08 0.00 0.52 0.00 0.00 34.95 33.90 3gzj s ARG 183 CO 0.49 0.20 1.05 -2.30 0.02 0.00 0.00 175.30 174.75 3gzj n PRO 184 N -0.16 1.27 -4.39 3.54 -0.02 -1.26 -4.32 135.00 129.65 3gzj n PRO 184 Ca -0.10 0.47 -0.20 0.00 -2.02 0.00 0.00 63.50 61.65 3gzj n PRO 184 Cb 0.59 -2.19 -0.10 0.00 -0.02 0.00 0.00 33.50 31.79 3gzj n PRO 184 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3gzj s GLY 185 N -0.94 1.99 0.13 -1.23 0.00 0.71 -4.77 107.32 103.22 3gzj s GLY 185 Ca 0.69 -1.85 0.06 0.00 0.00 0.00 0.00 44.72 43.62 3gzj s GLY 185 CO 0.52 -1.70 -0.15 -0.45 0.00 0.00 0.00 173.10 171.33 3gzj s SER 186 N -3.41 2.10 0.00 1.64 0.15 -1.26 -0.01 113.70 112.91 3gzj s SER 186 Ca 0.36 -0.83 0.22 0.00 0.70 0.00 0.00 55.95 56.40 3gzj s SER 186 Cb 0.07 -0.08 0.38 0.00 -1.71 0.00 0.00 66.02 64.68 3gzj s SER 186 CO 0.15 -0.13 1.34 0.18 1.20 0.00 0.00 173.24 175.98 3gzj n LEU 187 N 0.47 3.31 -3.82 3.45 4.77 -1.26 -4.96 117.00 118.95 3gzj n LEU 187 Ca -0.15 -1.47 -0.29 0.00 -0.03 0.00 0.00 56.01 54.06 3gzj n LEU 187 Cb 0.57 -0.22 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 3gzj n LEU 187 CO 0.28 0.71 0.08 0.49 -1.33 0.00 0.00 177.39 177.61 3gzj n PHE 188 N 1.37 -2.21 -0.13 -1.77 3.72 -1.26 -4.86 117.46 112.32 3gzj n PHE 188 Ca 0.18 0.83 -0.06 0.00 -0.05 0.00 0.00 57.45 58.35 3gzj n PHE 188 Cb 0.57 -3.84 0.02 0.00 -0.94 0.00 0.00 39.48 35.30 3gzj n PHE 188 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3gzj h PHE 189 N -1.90 0.41 -0.50 1.38 3.57 -1.95 0.30 116.94 118.24 3gzj h PHE 189 Ca -0.56 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 60.91 3gzj h PHE 189 Cb 1.37 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 3gzj h PHE 189 CO 0.58 0.22 0.14 -0.56 -2.23 0.00 0.00 178.31 176.46 3gzj h GLN 190 N 0.44 0.75 0.17 1.11 -0.00 -1.92 -0.58 115.11 115.08 3gzj h GLN 190 Ca 0.17 -0.14 -0.25 0.00 -0.00 0.00 0.00 58.65 58.44 3gzj h GLN 190 Cb 0.06 -0.12 0.03 0.00 -0.00 0.00 0.00 27.48 27.45 3gzj h GLN 190 CO -0.11 0.67 -1.07 0.22 -0.00 0.00 0.00 178.83 178.54 3gzj h ASP 191 N 0.73 0.65 -0.93 0.06 3.58 -1.80 -3.22 116.42 115.50 3gzj h ASP 191 Ca 0.17 -0.91 0.10 0.00 0.42 0.00 0.00 57.03 56.81 3gzj h ASP 191 Cb 0.24 -0.21 -0.08 0.00 1.72 0.00 0.00 39.33 41.00 3gzj h ASP 191 CO -0.01 1.51 0.56 -0.07 -2.88 0.00 0.00 179.24 178.36 3gzj h LEU 192 N -0.10 0.83 -1.50 2.28 3.38 -0.04 -2.33 115.31 117.83 3gzj h LEU 192 Ca -0.18 0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.84 3gzj h LEU 192 Cb 1.83 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.43 3gzj h LEU 192 CO 0.20 0.46 0.35 0.00 0.09 0.00 0.00 178.44 179.54 3gzj h ALA 193 N 1.49 1.64 0.00 1.53 0.00 -1.18 -0.99 119.26 121.77 3gzj h ALA 193 Ca 0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3gzj h ALA 193 Cb 0.40 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3gzj h ALA 193 CO -0.25 0.33 0.00 -0.22 0.00 0.00 0.00 179.25 179.11 3gzj h LYS 194 N 0.69 0.00 -7.04 0.00 3.64 -1.44 -3.48 116.57 108.95 3gzj h LYS 194 Ca 0.19 0.00 -0.48 0.00 -1.27 0.00 0.00 60.65 59.10 3gzj h LYS 194 Cb -0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3gzj h LYS 194 CO -0.04 0.00 0.28 0.00 -2.27 0.00 0.00 179.45 177.41 3gzj s ALA 195 N -3.22 3.16 0.12 5.00 0.00 -0.37 -5.02 121.76 121.42 3gzj s ALA 195 Ca 0.08 0.10 -0.31 0.00 0.00 0.00 0.00 51.96 51.83 3gzj s ALA 195 Cb 0.09 -2.98 -0.07 0.00 0.00 0.00 0.00 23.12 20.15 3gzj s ALA 195 CO 0.60 -0.07 1.28 0.21 0.00 0.00 0.00 175.76 177.78 3gzj s LYS 196 N -3.79 4.40 0.85 0.00 2.20 -1.26 -4.76 119.74 117.38 3gzj s LYS 196 Ca 0.57 1.93 -0.12 0.00 -0.36 0.00 0.00 55.97 57.99 3gzj s LYS 196 Cb -0.10 -3.27 0.10 0.00 -1.51 0.00 0.00 37.83 33.05 3gzj s LYS 196 CO 0.27 -0.28 1.12 -1.59 -0.36 0.00 0.00 175.35 174.51 3gzj s LYS 197 N 0.66 1.62 0.48 4.03 -2.85 -1.26 -4.92 119.74 117.50 3gzj s LYS 197 Ca 0.59 0.48 -0.15 0.00 -1.00 0.00 0.00 55.97 55.89 3gzj s LYS 197 Cb -0.33 -1.88 -0.08 0.00 -2.06 0.00 0.00 37.83 33.48 3gzj s LYS 197 CO 0.32 -1.91 0.92 -0.06 0.10 0.00 0.00 175.35 174.72 3gzj s PHE 198 N -3.21 3.45 0.09 1.78 0.08 -1.26 -5.06 117.98 113.86 3gzj s PHE 198 Ca 0.62 1.35 0.08 0.00 0.12 0.00 0.00 56.93 59.09 3gzj s PHE 198 Cb -0.15 -2.69 -0.04 0.00 -0.57 0.00 0.00 43.02 39.57 3gzj s PHE 198 CO 0.54 -0.29 -0.14 -1.54 -0.10 0.00 0.00 175.22 173.69 3gzj s SER 199 N -3.07 4.12 0.43 1.36 1.04 -1.26 -4.42 113.70 111.89 3gzj s SER 199 Ca 0.57 -0.44 0.23 0.00 0.48 0.00 0.00 55.95 56.78 3gzj s SER 199 Cb -0.10 -0.71 0.86 0.00 0.10 0.00 0.00 66.02 66.18 3gzj s SER 199 CO 0.31 0.20 1.80 0.71 0.98 0.00 0.00 173.24 177.24 3gzj h THR 200 N 3.51 0.63 -0.06 2.02 1.35 -1.95 -1.55 112.91 116.86 3gzj h THR 200 Ca -0.49 -1.21 -0.11 0.00 -0.55 0.00 0.00 66.41 64.05 3gzj h THR 200 Cb 1.17 1.80 -0.01 0.00 -1.73 0.00 0.00 68.15 69.37 3gzj h THR 200 CO 0.49 0.25 -0.48 -0.33 -0.25 0.00 0.00 175.52 175.20 3gzj h GLU 201 N 0.00 0.14 0.00 4.72 3.07 -1.95 -2.81 114.58 117.75 3gzj h GLU 201 Ca -0.00 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 3gzj h GLU 201 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 3gzj h GLU 201 CO 0.03 0.60 0.00 0.54 -1.40 0.00 0.00 179.01 178.78 3gzj n ARG 202 N -3.96 0.00 -0.26 2.33 1.74 -1.08 -4.30 116.66 111.12 3gzj n ARG 202 Ca -0.02 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.17 3gzj n ARG 202 Cb 0.52 -0.00 0.36 0.00 -1.02 0.00 0.00 32.46 32.32 3gzj n ARG 202 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 3gzj h TYR 203 N 0.00 0.84 0.00 -1.55 3.20 -1.37 -1.74 116.97 116.35 3gzj h TYR 203 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3gzj h TYR 203 Cb 0.00 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.00 3gzj h TYR 203 CO 0.00 0.34 0.00 0.41 -1.64 0.00 0.00 178.16 177.27 3gzj n GLY 204 N -1.43 -1.56 0.01 1.82 0.00 -1.11 -3.31 105.19 99.61 3gzj n GLY 204 Ca 0.16 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.31 3gzj n GLY 204 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gzj n SER 205 N -2.24 0.04 -4.74 1.61 3.41 -0.65 -4.83 113.62 106.21 3gzj n SER 205 Ca 0.04 0.51 -0.38 0.00 -0.26 0.00 0.00 58.87 58.78 3gzj n SER 205 Cb 0.36 -0.52 -0.06 0.00 -0.26 0.00 0.00 64.21 63.74 3gzj n SER 205 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3gzj s VAL 206 N -3.01 5.09 0.44 -3.33 1.01 -1.21 -5.05 120.40 114.33 3gzj s VAL 206 Ca 0.12 1.07 -0.26 0.00 0.00 0.00 0.00 61.98 62.91 3gzj s VAL 206 Cb 0.16 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.59 3gzj s VAL 206 CO 0.45 0.37 1.41 -0.75 0.00 0.00 0.00 175.10 176.57 3gzj s LYS 207 N 0.27 3.78 0.02 2.72 2.20 -1.26 -4.87 119.74 122.60 3gzj s LYS 207 Ca 0.28 2.37 0.06 0.00 -0.36 0.00 0.00 55.97 58.32 3gzj s LYS 207 Cb -0.16 -2.70 -0.02 0.00 -1.51 0.00 0.00 37.83 33.44 3gzj s LYS 207 CO 0.13 -0.73 -0.17 1.03 -0.36 0.00 0.00 175.35 175.25 3gzj s ARG 208 N -2.38 1.21 0.18 4.03 0.52 -1.26 -0.86 118.95 120.40 3gzj s ARG 208 Ca 0.59 -0.76 0.06 0.00 -0.52 0.00 0.00 55.73 55.10 3gzj s ARG 208 Cb -0.43 -1.24 -0.05 0.00 0.52 0.00 0.00 34.95 33.75 3gzj s ARG 208 CO 0.55 0.32 -0.12 0.00 0.02 0.00 0.00 175.30 176.08 3gzj s ALA 209 N -0.68 1.75 -0.04 2.13 0.00 0.11 -1.14 121.76 123.90 3gzj s ALA 209 Ca 0.05 -1.59 0.02 0.00 0.00 0.00 0.00 51.96 50.44 3gzj s ALA 209 Cb -0.08 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.06 3gzj s ALA 209 CO 0.01 -0.03 -0.09 -0.47 0.00 0.00 0.00 175.76 175.18 3gzj s TYR 210 N -3.16 1.07 -0.23 0.00 5.04 0.17 -0.92 117.35 119.31 3gzj s TYR 210 Ca 0.20 -0.31 -0.01 0.00 -2.44 0.00 0.00 57.07 54.51 3gzj s TYR 210 Cb 0.01 -0.79 0.02 0.00 0.35 0.00 0.00 41.96 41.56 3gzj s TYR 210 CO 0.04 -0.15 -0.09 0.42 -1.34 0.00 0.00 175.55 174.43 3gzj s ILE 211 N 0.40 2.73 0.25 3.14 1.01 0.11 -0.29 121.20 128.54 3gzj s ILE 211 Ca -0.07 -0.99 -0.30 0.00 0.00 0.00 0.00 60.65 59.29 3gzj s ILE 211 Cb -0.11 -2.34 -0.09 0.00 0.01 0.00 0.00 42.46 39.92 3gzj s ILE 211 CO 0.01 0.27 0.99 -0.36 0.00 0.00 0.00 174.94 175.85 3gzj s PHE 212 N 1.32 3.87 -0.41 3.97 0.08 -0.08 -1.32 117.98 125.40 3gzj s PHE 212 Ca 0.01 1.85 -0.02 0.00 0.12 0.00 0.00 56.93 58.89 3gzj s PHE 212 Cb -0.16 -3.07 0.11 0.00 -0.57 0.00 0.00 43.02 39.33 3gzj s PHE 212 CO -0.06 0.17 0.20 0.00 -0.10 0.00 0.00 175.22 175.42 3gzj h ASN 214 N 7.94 0.50 -0.65 0.00 4.21 -1.40 -2.36 115.58 123.82 3gzj h ASN 214 Ca -0.11 -0.08 -0.11 0.00 1.21 0.00 0.00 56.30 57.20 3gzj h ASN 214 Cb 1.04 -0.13 -0.07 0.00 -1.12 0.00 0.00 38.32 38.04 3gzj h ASN 214 CO 0.68 0.54 0.14 -0.62 -1.29 0.00 0.00 177.43 176.88 3gzj n GLU 215 N -4.30 4.25 -2.28 0.81 1.02 -0.57 -4.47 120.64 115.10 3gzj n GLU 215 Ca 0.02 -3.13 -0.43 0.00 -0.02 0.00 0.00 57.16 53.60 3gzj n GLU 215 Cb 0.22 -2.23 -0.02 0.00 -0.02 0.00 0.00 31.44 29.38 3gzj n GLU 215 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3gzj s ASP 216 N -0.96 6.86 -0.00 1.62 -1.08 -0.89 -4.49 116.67 117.72 3gzj s ASP 216 Ca 0.55 1.90 0.21 0.00 -0.52 0.00 0.00 52.55 54.69 3gzj s ASP 216 Cb 0.43 -2.54 -0.23 0.00 -1.46 0.00 0.00 42.92 39.11 3gzj s ASP 216 CO 0.14 -0.79 0.85 0.29 0.52 0.00 0.00 175.17 176.19 3gzj n LYS 217 N 6.52 0.09 0.12 4.34 5.02 -1.25 -3.53 118.16 129.47 3gzj n LYS 217 Ca 0.15 -0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.52 3gzj n LYS 217 Cb 0.44 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.98 3gzj n LYS 217 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3gzj h SER 218 N 0.00 0.00 -1.81 4.39 4.64 -1.85 -3.42 113.55 115.50 3gzj h SER 218 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 3gzj h SER 218 Cb 0.57 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.35 3gzj h SER 218 CO 0.00 0.01 -0.83 0.33 -0.87 0.00 0.00 176.83 175.47 3gzj n PHE 219 N -2.76 -1.82 -1.81 4.77 -0.00 -1.25 -5.09 117.46 109.51 3gzj n PHE 219 Ca 0.01 -2.71 -0.37 0.00 -0.00 0.00 0.00 57.45 54.38 3gzj n PHE 219 Cb 0.55 0.61 0.06 0.00 -0.00 0.00 0.00 39.48 40.70 3gzj n PHE 219 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 3gzj s PRO 220 N 0.18 2.68 0.49 -7.13 0.02 -1.23 -4.62 135.00 125.39 3gzj s PRO 220 Ca 0.32 2.02 0.26 0.00 0.02 0.00 0.00 61.00 63.63 3gzj s PRO 220 Cb 0.05 -1.89 1.27 0.00 0.02 0.00 0.00 34.50 33.95 3gzj s PRO 220 CO -0.15 -1.49 1.99 -0.24 -0.33 0.00 0.00 177.00 176.78 3gzj h VAL 221 N 0.67 0.57 -0.66 3.83 3.04 -1.78 0.78 116.25 122.71 3gzj h VAL 221 Ca -0.51 -0.75 -0.04 0.00 -1.01 0.00 0.00 66.70 64.39 3gzj h VAL 221 Cb 1.33 1.49 -0.03 0.00 -2.01 0.00 0.00 31.29 32.07 3gzj h VAL 221 CO 0.54 0.16 0.23 1.05 -1.01 0.00 0.00 177.57 178.54 3gzj h GLU 222 N 0.00 0.99 -0.00 4.17 9.09 -1.94 0.89 114.58 127.77 3gzj h GLU 222 Ca -0.00 -0.18 -0.26 0.00 0.05 0.00 0.00 59.36 58.97 3gzj h GLU 222 Cb 0.48 -0.16 0.02 0.00 -1.65 0.00 0.00 28.75 27.44 3gzj h GLU 222 CO 0.02 0.83 -1.01 0.35 0.05 0.00 0.00 179.01 179.24 3gzj h PHE 223 N 0.96 0.95 -0.61 2.06 3.57 -1.22 -0.22 116.94 122.44 3gzj h PHE 223 Ca 0.22 -0.52 0.01 0.00 3.53 0.00 0.00 57.97 61.21 3gzj h PHE 223 Cb 0.23 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3gzj h PHE 223 CO 0.02 1.35 0.40 1.96 -2.23 0.00 0.00 178.31 179.81 3gzj h GLN 224 N 0.37 0.79 -0.90 1.11 4.20 -1.27 -1.86 115.11 117.55 3gzj h GLN 224 Ca -0.12 -0.05 0.09 0.00 0.06 0.00 0.00 58.65 58.64 3gzj h GLN 224 Cb 1.66 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 29.20 3gzj h GLN 224 CO 0.19 0.52 0.58 0.87 -0.67 0.00 0.00 178.83 180.33 3gzj h LYS 225 N 0.81 0.88 -0.24 1.46 1.57 -0.70 -0.86 116.57 119.49 3gzj h LYS 225 Ca 0.23 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.03 3gzj h LYS 225 Cb -0.07 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.03 3gzj h LYS 225 CO -0.06 0.58 0.17 2.35 -0.57 0.00 0.00 179.45 181.92 3gzj h TRP 226 N 0.90 0.00 0.00 -1.35 7.01 -0.18 -0.11 115.95 122.23 3gzj h TRP 226 Ca 0.41 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 61.22 3gzj h TRP 226 Cb 0.39 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 3gzj h TRP 226 CO -0.00 0.00 -0.87 0.74 -2.79 0.00 0.00 178.44 175.52 3gzj h PHE 227 N 0.00 0.28 -0.09 2.65 0.04 -0.94 -1.85 116.94 117.03 3gzj h PHE 227 Ca 0.11 -0.15 -0.05 0.00 2.80 0.00 0.00 57.97 60.68 3gzj h PHE 227 Cb 0.46 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.58 3gzj h PHE 227 CO 0.00 0.96 -0.14 0.28 -0.60 0.00 0.00 178.31 178.82 3gzj h VAL 228 N 0.11 1.38 0.00 -0.55 2.07 -0.95 -0.63 116.25 117.68 3gzj h VAL 228 Ca -0.04 -1.37 -0.04 0.00 0.82 0.00 0.00 66.70 66.07 3gzj h VAL 228 Cb 1.49 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 33.33 3gzj h VAL 228 CO 0.13 0.39 -0.18 -0.33 0.02 0.00 0.00 177.57 177.60 3gzj h GLU 229 N -0.19 0.00 0.01 1.57 5.08 -1.09 0.35 114.58 120.31 3gzj h GLU 229 Ca 0.01 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.00 3gzj h GLU 229 Cb 0.69 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.88 3gzj h GLU 229 CO 0.03 0.18 -2.33 -1.13 -1.00 0.00 0.00 179.01 174.76 3gzj n SER 230 N -3.25 1.14 -0.08 1.42 3.41 -0.70 -4.67 113.62 110.89 3gzj n SER 230 Ca 0.01 -0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 3gzj n SER 230 Cb 0.47 0.11 -0.13 0.00 -0.26 0.00 0.00 64.21 64.40 3gzj n SER 230 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3gzj n VAL 231 N -3.07 1.16 -0.04 -3.33 0.31 -0.25 -5.08 118.33 108.04 3gzj n VAL 231 Ca -0.37 -0.72 0.00 0.00 -0.01 0.00 0.00 64.34 63.25 3gzj n VAL 231 Cb 1.07 -0.56 -0.00 0.00 -0.91 0.00 0.00 33.84 33.43 3gzj n VAL 231 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gzj n GLY 232 N 1.96 -2.73 3.16 2.92 0.00 0.12 -5.03 105.19 105.60 3gzj n GLY 232 Ca -0.28 -1.37 -0.12 0.00 0.00 0.00 0.00 46.02 44.25 3gzj n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gzj s ALA 233 N -3.52 -0.54 0.14 4.61 0.00 -1.26 -4.91 121.76 116.28 3gzj s ALA 233 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.13 3gzj s ALA 233 Cb 0.00 0.06 -0.13 0.00 0.00 0.00 0.00 23.12 23.06 3gzj s ALA 233 CO 0.00 -0.22 1.32 -0.44 0.00 0.00 0.00 175.76 176.41 3gzj h ASP 234 N 4.19 0.06 -3.81 0.00 3.32 -1.52 -3.44 116.42 115.23 3gzj h ASP 234 Ca -0.30 -0.06 -0.34 0.00 0.02 0.00 0.00 57.03 56.35 3gzj h ASP 234 Cb 1.19 -0.02 -0.30 0.00 0.22 0.00 0.00 39.33 40.42 3gzj h ASP 234 CO 0.40 0.99 -0.76 -0.75 -1.72 0.00 0.00 179.24 177.40 3gzj s LYS 235 N -2.87 0.48 -0.03 3.56 2.20 -1.19 -5.05 119.74 116.85 3gzj s LYS 235 Ca -0.00 -0.15 0.04 0.00 -0.36 0.00 0.00 55.97 55.50 3gzj s LYS 235 Cb 0.10 -0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 35.93 3gzj s LYS 235 CO 0.82 0.06 -0.16 0.14 -0.36 0.00 0.00 175.35 175.85 3gzj s VAL 236 N 0.13 1.31 0.24 4.02 -7.23 -1.26 -0.66 120.40 116.95 3gzj s VAL 236 Ca -0.01 -0.68 0.06 0.00 -1.81 0.00 0.00 61.98 59.54 3gzj s VAL 236 Cb -0.05 -1.11 -0.05 0.00 0.56 0.00 0.00 36.38 35.73 3gzj s VAL 236 CO -0.00 0.38 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.55 3gzj s LYS 237 N -0.15 1.42 -0.03 4.82 -0.14 0.60 -4.96 119.74 121.30 3gzj s LYS 237 Ca 0.01 -1.69 0.03 0.00 -1.36 0.00 0.00 55.97 52.96 3gzj s LYS 237 Cb -0.09 -1.02 0.00 0.00 -1.68 0.00 0.00 37.83 35.04 3gzj s LYS 237 CO 0.01 0.06 -0.10 -1.83 -0.76 0.00 0.00 175.35 172.73 3gzj s GLU 238 N -3.73 1.05 -0.33 1.68 -1.05 -1.26 -0.90 118.70 114.16 3gzj s GLU 238 Ca 0.26 -0.35 -0.09 0.00 -0.15 0.00 0.00 54.97 54.64 3gzj s GLU 238 Cb 0.03 -0.97 0.01 0.00 -0.44 0.00 0.00 34.13 32.76 3gzj s GLU 238 CO 0.09 0.15 0.15 0.42 0.95 0.00 0.00 175.26 177.02 3gzj s ILE 239 N 0.11 4.43 0.17 1.83 1.01 0.11 -4.92 121.20 123.94 3gzj s ILE 239 Ca -0.02 -0.64 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 3gzj s ILE 239 Cb -0.08 -3.34 0.03 0.00 0.01 0.00 0.00 42.46 39.08 3gzj s ILE 239 CO 0.01 -0.03 1.59 0.11 0.00 0.00 0.00 174.94 176.61 3gzj h LYS 240 N 8.35 1.03 -0.29 2.79 1.57 -1.98 -2.08 116.57 125.96 3gzj h LYS 240 Ca -0.30 -0.39 -0.07 0.00 -1.87 0.00 0.00 60.65 58.02 3gzj h LYS 240 Cb 1.13 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 3gzj h LYS 240 CO 0.63 1.08 -0.02 0.39 -0.57 0.00 0.00 179.45 180.96 3gzj n GLU 241 N -4.14 2.40 -3.06 3.15 1.02 -1.26 -4.26 120.64 114.49 3gzj n GLU 241 Ca 0.01 -2.95 -0.40 0.00 -0.02 0.00 0.00 57.16 53.80 3gzj n GLU 241 Cb 0.42 -1.82 -0.05 0.00 -0.02 0.00 0.00 31.44 29.97 3gzj n GLU 241 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gzj s ALA 242 N -3.00 3.37 0.50 0.62 0.00 -1.16 -4.88 121.76 117.22 3gzj s ALA 242 Ca 0.43 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.53 3gzj s ALA 242 Cb 0.36 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.56 3gzj s ALA 242 CO 0.05 -0.02 0.00 -0.40 0.00 0.00 0.00 175.76 175.39 3gzj n ASP 243 N 3.38 0.00 0.25 0.00 5.68 -1.26 -1.51 116.55 123.10 3gzj n ASP 243 Ca -0.03 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.40 3gzj n ASP 243 Cb 0.51 0.00 0.63 0.00 -1.14 0.00 0.00 41.12 41.12 3gzj n ASP 243 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3gzj h ALA 244 N -1.50 1.08 -1.44 2.12 0.00 -1.77 -3.14 119.26 114.61 3gzj h ALA 244 Ca 0.00 -0.12 -0.71 0.00 0.00 0.00 0.00 54.91 54.08 3gzj h ALA 244 Cb 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 17.79 17.44 3gzj h ALA 244 CO 0.00 0.16 0.35 -1.33 0.00 0.00 0.00 179.25 178.43 3gzj n MET 245 N -3.37 3.80 -0.36 0.00 2.81 -1.17 -4.85 117.12 113.99 3gzj n MET 245 Ca -0.00 -4.34 0.36 0.00 -1.81 0.00 0.00 57.70 51.91 3gzj n MET 245 Cb 0.33 -2.32 0.74 0.00 -0.71 0.00 0.00 33.22 31.26 3gzj n MET 245 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3gzj h GLY 246 N 3.27 0.11 1.81 3.03 0.00 -1.89 -0.32 103.07 109.09 3gzj h GLY 246 Ca 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.73 3gzj h GLY 246 CO 1.12 -0.02 0.00 1.15 0.00 0.00 0.00 176.54 178.79 3gzj n MET 247 N -4.20 0.14 -0.01 4.80 0.00 -1.26 -0.10 117.12 116.49 3gzj n MET 247 Ca 0.27 0.10 -0.02 0.00 0.00 0.00 0.00 57.70 58.05 3gzj n MET 247 Cb 1.29 -1.50 -0.01 0.00 0.00 0.00 0.00 33.22 33.00 3gzj n MET 247 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3gzj n LEU 248 N -1.40 1.19 0.11 3.17 4.77 -0.22 -4.10 117.00 120.51 3gzj n LEU 248 Ca 0.08 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 3gzj n LEU 248 Cb 0.22 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 3gzj n LEU 248 CO 0.19 0.23 0.29 0.77 -1.33 0.00 0.00 177.39 177.54 3gzj h SER 249 N -0.06 0.00 -0.88 -1.43 4.64 -1.34 -3.40 113.55 111.07 3gzj h SER 249 Ca -0.06 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.90 3gzj h SER 249 Cb 1.07 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.76 3gzj h SER 249 CO -0.03 0.62 -1.11 0.00 -0.87 0.00 0.00 176.83 175.44 3gzj n GLN 250 N -3.21 1.64 -0.33 4.77 1.13 0.86 -4.94 117.38 117.30 3gzj n GLN 250 Ca -0.00 -3.49 0.08 0.00 -1.94 0.00 0.00 57.00 51.65 3gzj n GLN 250 Cb 0.80 -1.49 0.27 0.00 0.11 0.00 0.00 30.24 29.93 3gzj n GLN 250 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3gzj h PRO 251 N 2.81 0.91 -0.30 -1.09 0.13 -1.69 -0.76 132.00 132.01 3gzj h PRO 251 Ca -0.05 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.00 3gzj h PRO 251 Cb 1.20 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 3gzj h PRO 251 CO 0.46 0.60 0.11 0.00 -0.23 0.00 0.00 178.00 178.94 3gzj h ARG 252 N 0.94 0.46 0.27 0.86 3.08 -1.92 0.60 114.38 118.67 3gzj h ARG 252 Ca 0.47 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.43 3gzj h ARG 252 Cb 0.49 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3gzj h ARG 252 CO -0.23 0.49 -0.30 0.93 -1.07 0.00 0.00 179.97 179.79 3gzj h GLU 253 N 0.33 -0.59 -0.86 0.04 4.39 -1.65 0.05 114.58 116.28 3gzj h GLU 253 Ca 0.10 0.04 0.18 0.00 0.34 0.00 0.00 59.36 60.02 3gzj h GLU 253 Cb 0.21 0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 28.89 3gzj h GLU 253 CO -0.01 -0.40 0.41 0.28 -1.16 0.00 0.00 179.01 178.14 3gzj h VAL 254 N -0.62 0.61 -0.60 3.13 2.07 -1.02 0.10 116.25 119.91 3gzj h VAL 254 Ca -0.01 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 3gzj h VAL 254 Cb 0.58 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3gzj h VAL 254 CO -0.08 0.09 0.08 0.00 0.02 0.00 0.00 177.57 177.68 3gzj h LYS 256 N 0.91 -0.66 -0.58 0.00 1.79 0.96 -1.45 116.57 117.54 3gzj h LYS 256 Ca 0.18 0.05 0.11 0.00 -2.18 0.00 0.00 60.65 58.81 3gzj h LYS 256 Cb 0.45 0.15 -0.09 0.00 -1.58 0.00 0.00 32.23 31.16 3gzj h LYS 256 CO 0.02 -0.38 0.07 0.00 -1.08 0.00 0.00 179.45 178.07 3gzj h LEU 258 N 0.19 0.73 -0.42 0.00 5.85 -0.99 -0.92 115.31 119.77 3gzj h LEU 258 Ca 0.30 -0.07 -0.18 0.00 0.84 0.00 0.00 57.88 58.77 3gzj h LEU 258 Cb 0.46 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3gzj h LEU 258 CO -0.43 0.62 -0.77 -0.07 -0.34 0.00 0.00 178.44 177.46 3gzj h LEU 259 N 0.82 0.31 0.03 2.25 3.38 -0.26 -2.78 115.31 119.05 3gzj h LEU 259 Ca 0.20 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3gzj h LEU 259 Cb 0.08 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3gzj h LEU 259 CO -0.03 0.96 -0.01 0.44 0.09 0.00 0.00 178.44 179.89 3gzj h ASP 260 N 0.16 -0.03 0.10 -0.43 3.32 -0.63 -1.22 116.42 117.69 3gzj h ASP 260 Ca -0.03 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3gzj h ASP 260 Cb 1.35 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.89 3gzj h ASP 260 CO 0.12 0.01 -0.16 0.40 -1.72 0.00 0.00 179.24 177.89 3gzj h ILE 261 N -0.07 1.17 0.01 0.35 2.04 -1.17 -3.09 117.51 116.76 3gzj h ILE 261 Ca -0.00 -0.76 -0.34 0.00 1.00 0.00 0.00 64.86 64.76 3gzj h ILE 261 Cb 0.06 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 3gzj h ILE 261 CO 0.01 0.23 -2.09 -1.54 0.00 0.00 0.00 178.15 174.76 3gzj n SER 262 N -4.28 0.77 -0.11 1.72 3.41 -1.05 -5.06 113.62 109.02 3gzj n SER 262 Ca -0.01 0.17 0.16 0.00 -0.26 0.00 0.00 58.87 58.92 3gzj n SER 262 Cb 0.27 0.24 0.85 0.00 -0.26 0.00 0.00 64.21 65.31 3gzj n SER 262 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35