#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ao5 s VAL 17 N 0.00 4.00 0.00 3.34 1.01 0.30 -4.19 120.40 124.86 1ao5 s VAL 17 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1ao5 s VAL 17 Cb 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.63 1ao5 s VAL 17 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1ao5 n GLY 18 N 3.42 0.50 0.00 4.51 0.00 -1.24 -1.97 105.19 110.41 1ao5 n GLY 18 Ca -0.17 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1ao5 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ao5 n GLY 19 N -2.92 0.79 3.47 -0.02 0.00 -1.26 -4.88 105.19 100.37 1ao5 n GLY 19 Ca 0.00 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 1ao5 n GLY 19 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ao5 s PHE 20 N 1.11 0.54 -0.19 1.61 -0.71 0.28 -4.93 117.98 115.69 1ao5 s PHE 20 Ca 0.00 -0.87 -0.29 0.00 -1.04 0.00 0.00 56.93 54.73 1ao5 s PHE 20 Cb 0.00 -0.00 -0.03 0.00 -1.21 0.00 0.00 43.02 41.78 1ao5 s PHE 20 CO 0.00 -0.88 1.52 -0.80 -1.34 0.00 0.00 175.22 173.72 1ao5 s ASN 21 N -3.04 6.56 0.85 1.98 -0.87 -1.26 -0.35 114.94 118.81 1ao5 s ASN 21 Ca 0.25 1.69 -0.12 0.00 -1.57 0.00 0.00 52.86 53.11 1ao5 s ASN 21 Cb 0.02 -2.53 0.11 0.00 -0.02 0.00 0.00 41.25 38.82 1ao5 s ASN 21 CO 0.08 -1.09 1.19 0.00 -2.57 0.00 0.00 177.10 174.71 1ao5 s GLU 23 N -4.33 3.58 -0.20 0.00 2.02 -1.26 -4.90 118.70 113.62 1ao5 s GLU 23 Ca 0.71 1.46 -0.37 0.00 0.02 0.00 0.00 54.97 56.78 1ao5 s GLU 23 Cb -0.27 -2.05 -0.14 0.00 0.10 0.00 0.00 34.13 31.77 1ao5 s GLU 23 CO 0.53 -0.63 1.83 1.63 0.02 0.00 0.00 175.26 178.64 1ao5 n LYS 24 N -1.18 1.64 -1.59 1.61 5.02 -1.26 -1.65 118.16 120.74 1ao5 n LYS 24 Ca 0.10 0.60 -0.19 0.00 -2.02 0.00 0.00 58.31 56.80 1ao5 n LYS 24 Cb 0.52 -2.37 -0.08 0.00 -0.02 0.00 0.00 35.03 33.08 1ao5 n LYS 24 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ao5 n ASN 25 N 6.13 -5.34 0.17 4.39 4.13 -1.26 -4.87 115.26 118.61 1ao5 n ASN 25 Ca 0.25 0.46 0.03 0.00 1.68 0.00 0.00 54.58 57.00 1ao5 n ASN 25 Cb 0.21 -4.53 0.28 0.00 -1.54 0.00 0.00 39.78 34.19 1ao5 n ASN 25 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1ao5 h SER 26 N 0.00 0.00 -2.51 6.41 4.64 -1.69 -3.33 113.55 117.07 1ao5 h SER 26 Ca -0.40 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.26 1ao5 h SER 26 Cb 1.26 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.97 1ao5 h SER 26 CO 0.58 0.45 -0.21 0.00 -0.87 0.00 0.00 176.83 176.78 1ao5 n GLN 27 N -3.61 3.00 0.28 4.77 1.13 -1.26 -4.91 117.38 116.79 1ao5 n GLN 27 Ca -0.00 -4.62 0.19 0.00 -1.94 0.00 0.00 57.00 50.62 1ao5 n GLN 27 Cb 0.55 -2.34 1.01 0.00 0.11 0.00 0.00 30.24 29.57 1ao5 n GLN 27 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1ao5 h PRO 28 N 4.69 0.00 0.00 -1.09 0.13 -1.80 -1.98 132.00 131.94 1ao5 h PRO 28 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1ao5 h PRO 28 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1ao5 h PRO 28 CO 0.96 0.00 -0.68 -2.67 -0.23 0.00 0.00 178.00 175.37 1ao5 n TRP 29 N -2.85 0.27 -1.88 1.56 2.14 -1.13 -2.72 117.44 112.83 1ao5 n TRP 29 Ca -0.02 0.08 -0.42 0.00 2.07 0.00 0.00 57.50 59.21 1ao5 n TRP 29 Cb 0.08 -0.44 -0.03 0.00 -0.81 0.00 0.00 31.31 30.11 1ao5 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1ao5 s GLN 30 N -3.11 4.19 0.19 -2.67 2.00 -0.75 -0.97 119.66 118.55 1ao5 s GLN 30 Ca 0.07 2.42 0.10 0.00 -2.00 0.00 0.00 55.36 55.95 1ao5 s GLN 30 Cb 0.15 -3.21 -0.04 0.00 0.80 0.00 0.00 33.01 30.71 1ao5 s GLN 30 CO 0.74 -0.66 -0.15 0.08 -0.50 0.00 0.00 175.29 174.80 1ao5 s VAL 31 N 1.41 2.88 -0.24 1.34 1.01 -0.28 -4.40 120.40 122.13 1ao5 s VAL 31 Ca 0.72 -1.83 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1ao5 s VAL 31 Cb -0.45 -2.42 0.04 0.00 0.00 0.00 0.00 36.38 33.55 1ao5 s VAL 31 CO 0.32 -0.14 -0.12 0.00 0.00 0.00 0.00 175.10 175.16 1ao5 s ALA 32 N -1.76 2.54 -0.16 5.51 0.00 -0.75 -2.09 121.76 125.06 1ao5 s ALA 32 Ca 0.24 -1.55 -0.12 0.00 0.00 0.00 0.00 51.96 50.53 1ao5 s ALA 32 Cb -0.08 -1.51 -0.05 0.00 0.00 0.00 0.00 23.12 21.48 1ao5 s ALA 32 CO 0.14 -0.89 0.23 0.08 0.00 0.00 0.00 175.76 175.32 1ao5 s VAL 33 N 1.21 5.35 0.17 0.00 1.01 0.02 -1.00 120.40 127.15 1ao5 s VAL 33 Ca -0.03 0.41 0.10 0.00 0.00 0.00 0.00 61.98 62.46 1ao5 s VAL 33 Cb -0.17 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1ao5 s VAL 33 CO -0.07 0.44 -0.21 -0.31 0.00 0.00 0.00 175.10 174.96 1ao5 s TYR 34 N 0.18 2.00 -0.50 5.22 1.51 -0.02 -0.71 117.35 125.03 1ao5 s TYR 34 Ca 0.14 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.79 1ao5 s TYR 34 Cb -0.12 -1.00 0.13 0.00 -0.11 0.00 0.00 41.96 40.86 1ao5 s TYR 34 CO 0.02 0.39 0.27 -0.47 -1.11 0.00 0.00 175.55 174.65 1ao5 s TYR 35 N -1.83 3.41 0.00 2.71 5.04 -0.24 -1.78 117.35 124.66 1ao5 s TYR 35 Ca 0.17 -2.90 0.00 0.00 -2.44 0.00 0.00 57.07 51.90 1ao5 s TYR 35 Cb -0.07 -3.01 0.00 0.00 0.35 0.00 0.00 41.96 39.23 1ao5 s TYR 35 CO 0.08 -0.84 0.00 1.04 -1.34 0.00 0.00 175.55 174.49 1ao5 n GLN 36 N 3.63 0.00 -0.09 4.97 6.02 -1.26 -2.21 117.38 128.44 1ao5 n GLN 36 Ca 0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.16 1ao5 n GLN 36 Cb 0.37 0.00 0.21 0.00 1.02 0.00 0.00 30.24 31.83 1ao5 n GLN 36 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1ao5 n LYS 38 N 4.31 2.32 -4.10 -1.09 0.00 -1.26 -4.90 118.16 113.44 1ao5 n LYS 38 Ca 0.00 -1.96 -0.35 0.00 -0.00 0.00 0.00 58.31 56.00 1ao5 n LYS 38 Cb 0.00 -1.48 -0.12 0.00 -0.00 0.00 0.00 35.03 33.43 1ao5 n LYS 38 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1ao5 s GLU 39 N -1.75 3.65 0.23 -1.58 2.12 -0.94 -5.08 118.70 115.35 1ao5 s GLU 39 Ca 0.34 -0.51 -0.30 0.00 0.36 0.00 0.00 54.97 54.87 1ao5 s GLU 39 Cb 0.21 -3.08 -0.09 0.00 0.26 0.00 0.00 34.13 31.44 1ao5 s GLU 39 CO 0.31 0.05 1.25 -1.58 -0.54 0.00 0.00 175.26 174.75 1ao5 s HIS 40 N 0.89 3.31 0.00 5.30 5.65 -1.26 -1.08 115.29 128.10 1ao5 s HIS 40 Ca 0.01 1.38 0.00 0.00 0.25 0.00 0.00 55.06 56.70 1ao5 s HIS 40 Cb -0.14 -3.52 0.00 0.00 -1.18 0.00 0.00 32.58 27.73 1ao5 s HIS 40 CO 0.02 -1.50 0.00 0.44 -0.65 0.00 0.00 174.74 173.05 1ao5 n ILE 41 N 2.09 0.00 -3.91 0.89 -5.35 0.11 -4.90 119.36 108.28 1ao5 n ILE 41 Ca 0.04 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.41 1ao5 n ILE 41 Cb 0.43 -0.37 -0.01 0.00 -1.74 0.00 0.00 39.64 37.96 1ao5 n ILE 41 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ao5 s GLY 43 N -3.09 2.11 0.32 0.00 0.00 0.16 -0.80 107.32 106.02 1ao5 s GLY 43 Ca 0.20 -1.82 -0.18 0.00 0.00 0.00 0.00 44.72 42.92 1ao5 s GLY 43 CO 0.13 -1.70 0.84 -0.32 0.00 0.00 0.00 173.10 172.05 1ao5 s GLY 44 N -4.21 0.24 -0.04 0.20 0.00 -0.89 -3.79 107.32 98.83 1ao5 s GLY 44 Ca 0.49 -0.58 0.01 0.00 0.00 0.00 0.00 44.72 44.64 1ao5 s GLY 44 CO 0.29 0.25 -0.03 0.14 0.00 0.00 0.00 173.10 173.74 1ao5 s VAL 45 N -2.52 0.43 -0.28 1.40 1.01 0.10 -1.12 120.40 119.42 1ao5 s VAL 45 Ca 0.16 -0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.83 1ao5 s VAL 45 Cb -0.05 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.86 1ao5 s VAL 45 CO 0.09 0.20 0.88 -0.22 0.00 0.00 0.00 175.10 176.06 1ao5 s LEU 46 N 0.97 4.06 -0.21 3.92 2.96 -0.14 0.09 118.68 130.32 1ao5 s LEU 46 Ca -0.10 0.94 0.08 0.00 -0.22 0.00 0.00 54.13 54.83 1ao5 s LEU 46 Cb -0.14 -3.25 -0.19 0.00 0.50 0.00 0.00 46.19 43.11 1ao5 s LEU 46 CO -0.00 -0.64 -0.09 0.18 -1.32 0.00 0.00 176.35 174.48 1ao5 n LEU 47 N 6.28 1.64 -3.89 -0.68 4.77 -0.53 -1.45 117.00 123.15 1ao5 n LEU 47 Ca 0.07 -0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 1ao5 n LEU 47 Cb 0.47 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1ao5 n LEU 47 CO 0.51 0.70 0.15 -0.62 -1.33 0.00 0.00 177.39 176.79 1ao5 s ASP 48 N -5.82 -0.11 0.45 -1.43 2.15 -0.97 -4.45 116.67 106.49 1ao5 s ASP 48 Ca -0.21 -0.74 0.26 0.00 0.43 0.00 0.00 52.55 52.29 1ao5 s ASP 48 Cb 0.07 0.53 1.30 0.00 -0.30 0.00 0.00 42.92 44.52 1ao5 s ASP 48 CO 0.64 -1.02 1.76 0.03 -0.17 0.00 0.00 175.17 176.40 1ao5 h ARG 49 N 2.33 0.22 -0.11 4.34 3.08 -1.97 -1.89 114.38 120.38 1ao5 h ARG 49 Ca -0.29 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1ao5 h ARG 49 Cb 1.25 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1ao5 h ARG 49 CO 0.41 0.14 0.00 0.09 -1.07 0.00 0.00 179.97 179.54 1ao5 n ASN 50 N -4.49 2.07 -3.95 7.04 3.02 -1.26 -1.66 115.26 116.03 1ao5 n ASN 50 Ca 0.27 -1.66 -0.24 0.00 -0.03 0.00 0.00 54.58 52.92 1ao5 n ASN 50 Cb 1.09 -0.07 -0.17 0.00 -0.61 0.00 0.00 39.78 40.02 1ao5 n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1ao5 s TRP 51 N -0.78 1.25 0.07 3.10 0.52 -0.71 -1.17 118.94 121.21 1ao5 s TRP 51 Ca 0.11 -0.49 0.10 0.00 0.02 0.00 0.00 56.10 55.83 1ao5 s TRP 51 Cb 0.06 -1.00 -0.03 0.00 -1.15 0.00 0.00 33.47 31.35 1ao5 s TRP 51 CO 0.08 -0.32 -0.26 0.08 0.02 0.00 0.00 176.95 176.55 1ao5 s VAL 52 N 1.07 2.13 -0.10 4.03 1.01 -0.71 -1.45 120.40 126.39 1ao5 s VAL 52 Ca -0.08 -1.49 0.02 0.00 0.00 0.00 0.00 61.98 60.43 1ao5 s VAL 52 Cb -0.14 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 1ao5 s VAL 52 CO -0.01 0.26 -0.15 -0.22 0.00 0.00 0.00 175.10 174.99 1ao5 s LEU 53 N -1.50 2.65 0.00 3.92 2.96 0.11 -1.30 118.68 125.53 1ao5 s LEU 53 Ca 0.12 -0.31 -0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1ao5 s LEU 53 Cb -0.10 -1.57 0.01 0.00 0.50 0.00 0.00 46.19 45.03 1ao5 s LEU 53 CO 0.03 0.23 0.31 1.07 -1.32 0.00 0.00 176.35 176.68 1ao5 n THR 54 N 3.08 0.00 -2.78 3.68 5.66 -0.78 0.00 114.28 123.14 1ao5 n THR 54 Ca -0.18 -1.07 -0.38 0.00 -3.05 0.00 0.00 64.05 59.37 1ao5 n THR 54 Cb 0.52 0.67 -0.06 0.00 -1.55 0.00 0.00 70.33 69.92 1ao5 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ao5 s ALA 55 N -2.28 3.29 0.30 1.79 0.00 -1.26 -1.26 121.76 122.34 1ao5 s ALA 55 Ca 0.17 0.55 0.32 0.00 0.00 0.00 0.00 51.96 53.01 1ao5 s ALA 55 Cb -0.01 -3.18 1.50 0.00 0.00 0.00 0.00 23.12 21.44 1ao5 s ALA 55 CO 0.13 0.20 2.05 0.00 0.00 0.00 0.00 175.76 178.14 1ao5 h ALA 56 N 3.68 1.09 0.00 0.00 0.00 -1.61 -2.67 119.26 119.75 1ao5 h ALA 56 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1ao5 h ALA 56 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ao5 h ALA 56 CO 0.66 0.09 0.00 -2.39 0.00 0.00 0.00 179.25 177.62 1ao5 n HIS 57 N -3.31 0.00 -2.82 0.00 1.44 -1.26 -4.28 115.22 105.00 1ao5 n HIS 57 Ca -0.01 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 55.27 1ao5 n HIS 57 Cb 0.27 -0.10 -0.00 0.00 0.12 0.00 0.00 29.99 30.28 1ao5 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ao5 s TYR 59 N 2.54 3.23 0.21 0.00 5.04 -1.26 -5.02 117.35 122.09 1ao5 s TYR 59 Ca 0.47 -0.38 -0.06 0.00 -2.44 0.00 0.00 57.07 54.66 1ao5 s TYR 59 Cb -0.00 -2.60 -0.03 0.00 0.35 0.00 0.00 41.96 39.68 1ao5 s TYR 59 CO 0.03 -0.51 0.26 0.14 -1.34 0.00 0.00 175.55 174.13 1ao5 s VAL 60 N 1.78 0.00 0.14 3.14 -7.23 -1.26 -5.08 120.40 111.89 1ao5 s VAL 60 Ca 0.07 -1.76 -0.08 0.00 -1.81 0.00 0.00 61.98 58.40 1ao5 s VAL 60 Cb -0.18 -2.36 -0.11 0.00 0.56 0.00 0.00 36.38 34.29 1ao5 s VAL 60 CO 0.11 -0.02 1.39 0.44 -0.31 0.00 0.00 175.10 176.71 1ao5 h ASP 61 N 2.49 0.77 -4.62 4.85 5.19 -2.00 -3.45 116.42 119.64 1ao5 h ASP 61 Ca -0.32 -0.47 -0.29 0.00 -0.62 0.00 0.00 57.03 55.32 1ao5 h ASP 61 Cb 1.25 -0.23 -0.22 0.00 0.18 0.00 0.00 39.33 40.31 1ao5 h ASP 61 CO 0.47 1.24 -0.74 -1.10 -3.12 0.00 0.00 179.24 175.99 1ao5 s GLN 63 N -3.82 0.53 0.06 3.56 -0.21 -1.26 -5.14 119.66 113.39 1ao5 s GLN 63 Ca -0.09 -0.69 0.08 0.00 0.02 0.00 0.00 55.36 54.69 1ao5 s GLN 63 Cb 0.10 -0.35 -0.03 0.00 1.00 0.00 0.00 33.01 33.73 1ao5 s GLN 63 CO 0.87 0.07 -0.23 0.71 -2.12 0.00 0.00 175.29 174.59 1ao5 s TYR 64 N -1.19 2.01 0.04 0.91 2.02 -1.26 -4.55 117.35 115.32 1ao5 s TYR 64 Ca -0.08 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 1ao5 s TYR 64 Cb -0.09 -1.17 -0.02 0.00 -0.40 0.00 0.00 41.96 40.28 1ao5 s TYR 64 CO 0.00 0.15 -0.05 -1.21 -1.57 0.00 0.00 175.55 172.87 1ao5 s GLU 65 N -1.40 0.45 0.04 -0.62 2.02 -0.73 -2.75 118.70 115.70 1ao5 s GLU 65 Ca 0.09 -0.74 0.02 0.00 0.02 0.00 0.00 54.97 54.36 1ao5 s GLU 65 Cb -0.09 -0.09 -0.02 0.00 0.10 0.00 0.00 34.13 34.02 1ao5 s GLU 65 CO 0.03 -0.00 -0.07 0.14 0.02 0.00 0.00 175.26 175.37 1ao5 s VAL 66 N -1.63 0.46 -0.10 2.63 -7.23 -0.63 -0.84 120.40 113.06 1ao5 s VAL 66 Ca -0.11 -1.05 0.03 0.00 -1.81 0.00 0.00 61.98 59.04 1ao5 s VAL 66 Cb -0.09 -0.55 0.00 0.00 0.56 0.00 0.00 36.38 36.31 1ao5 s VAL 66 CO -0.01 -0.41 -0.22 0.26 -0.31 0.00 0.00 175.10 174.42 1ao5 s TRP 67 N -1.41 2.38 0.13 2.82 0.52 -0.17 -1.79 118.94 121.43 1ao5 s TRP 67 Ca -0.11 -1.01 0.09 0.00 0.02 0.00 0.00 56.10 55.09 1ao5 s TRP 67 Cb -0.10 -1.61 -0.04 0.00 -1.15 0.00 0.00 33.47 30.57 1ao5 s TRP 67 CO 0.00 -0.43 -0.15 -0.51 0.02 0.00 0.00 176.95 175.88 1ao5 s LEU 68 N 0.49 2.79 -0.59 2.99 1.43 0.21 -1.80 118.68 124.19 1ao5 s LEU 68 Ca -0.16 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 1ao5 s LEU 68 Cb -0.17 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.46 1ao5 s LEU 68 CO 0.06 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.41 1ao5 n GLY 69 N 0.58 0.79 3.84 -3.19 0.00 -1.26 -0.36 105.19 105.58 1ao5 n GLY 69 Ca -0.14 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 1ao5 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ao5 s LYS 70 N -2.10 4.09 0.00 1.61 -0.14 -1.26 -4.40 119.74 117.54 1ao5 s LYS 70 Ca 0.00 0.82 0.00 0.00 -1.36 0.00 0.00 55.97 55.43 1ao5 s LYS 70 Cb 0.00 -2.41 0.00 0.00 -1.68 0.00 0.00 37.83 33.74 1ao5 s LYS 70 CO 0.00 0.13 0.00 0.09 -0.76 0.00 0.00 175.35 174.81 1ao5 n ASN 71 N -0.33 1.48 -4.47 2.83 3.02 -1.26 -4.93 115.26 111.60 1ao5 n ASN 71 Ca 0.04 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.22 1ao5 n ASN 71 Cb 0.53 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.58 1ao5 n ASN 71 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ao5 s LYS 72 N -1.50 3.63 0.28 3.52 -0.14 -1.26 -0.84 119.74 123.42 1ao5 s LYS 72 Ca 0.00 -0.51 0.09 0.00 -1.36 0.00 0.00 55.97 54.19 1ao5 s LYS 72 Cb 0.00 -3.43 0.39 0.00 -1.68 0.00 0.00 37.83 33.11 1ao5 s LYS 72 CO 0.00 -0.24 1.63 1.25 -0.76 0.00 0.00 175.35 177.24 1ao5 h LEU 73 N 8.28 0.08 -2.17 3.17 5.85 -0.95 -3.28 115.31 126.29 1ao5 h LEU 73 Ca -0.36 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.31 1ao5 h LEU 73 Cb 1.17 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.18 1ao5 h LEU 73 CO 0.58 0.63 0.00 0.49 -0.34 0.00 0.00 178.44 179.80 1ao5 n PHE 74 N -3.87 0.32 -5.24 1.25 3.72 -1.26 -4.94 117.46 107.43 1ao5 n PHE 74 Ca -0.02 -0.21 -0.30 0.00 -0.05 0.00 0.00 57.45 56.87 1ao5 n PHE 74 Cb 0.58 -0.01 -0.16 0.00 -0.94 0.00 0.00 39.48 38.95 1ao5 n PHE 74 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ao5 s GLN 75 N -1.28 2.09 -0.37 -1.08 -0.21 -1.24 -5.09 119.66 112.48 1ao5 s GLN 75 Ca 0.28 -0.88 -0.28 0.00 0.02 0.00 0.00 55.36 54.49 1ao5 s GLN 75 Cb 0.17 -1.97 0.02 0.00 1.00 0.00 0.00 33.01 32.23 1ao5 s GLN 75 CO 0.24 0.50 1.05 -1.21 -2.12 0.00 0.00 175.29 173.75 1ao5 s GLU 76 N -0.50 3.92 -0.22 2.91 0.41 -1.26 -4.71 118.70 119.25 1ao5 s GLU 76 Ca 0.07 0.81 -0.11 0.00 -0.41 0.00 0.00 54.97 55.33 1ao5 s GLU 76 Cb -0.10 -3.80 -0.05 0.00 -1.78 0.00 0.00 34.13 28.40 1ao5 s GLU 76 CO -0.00 -1.03 0.20 -1.21 -0.49 0.00 0.00 175.26 172.73 1ao5 s GLU 77 N 3.80 4.12 0.61 1.61 2.02 -1.26 -4.99 118.70 124.62 1ao5 s GLU 77 Ca 0.44 -0.16 0.34 0.00 0.02 0.00 0.00 54.97 55.61 1ao5 s GLU 77 Cb -0.11 -3.51 1.96 0.00 0.10 0.00 0.00 34.13 32.58 1ao5 s GLU 77 CO 0.20 0.11 2.28 -1.35 0.02 0.00 0.00 175.26 176.52 1ao5 h PRO 78 N 7.26 0.00 -0.39 0.39 0.11 -1.98 -2.15 132.00 135.24 1ao5 h PRO 78 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1ao5 h PRO 78 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ao5 h PRO 78 CO 0.69 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 177.36 1ao5 n SER 79 N -3.63 2.09 -4.75 -2.05 3.41 -1.26 -4.90 113.62 102.54 1ao5 n SER 79 Ca -0.03 -2.00 -0.24 0.00 -0.26 0.00 0.00 58.87 56.35 1ao5 n SER 79 Cb 0.09 -0.26 0.09 0.00 -0.26 0.00 0.00 64.21 63.87 1ao5 n SER 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ao5 s ALA 80 N -1.48 3.48 -0.02 7.33 0.00 -0.81 -4.80 121.76 125.45 1ao5 s ALA 80 Ca 0.26 -1.40 -0.00 0.00 0.00 0.00 0.00 51.96 50.82 1ao5 s ALA 80 Cb 0.14 -2.23 0.03 0.00 0.00 0.00 0.00 23.12 21.05 1ao5 s ALA 80 CO 0.18 -1.35 0.04 -0.65 0.00 0.00 0.00 175.76 173.98 1ao5 s GLN 81 N -5.15 -0.02 -0.02 0.00 -0.21 0.52 -4.98 119.66 109.80 1ao5 s GLN 81 Ca 0.63 0.20 -0.01 0.00 0.02 0.00 0.00 55.36 56.21 1ao5 s GLN 81 Cb -0.08 -0.23 -0.04 0.00 1.00 0.00 0.00 33.01 33.67 1ao5 s GLN 81 CO 0.44 -0.16 0.06 -1.58 -2.12 0.00 0.00 175.29 171.93 1ao5 s HIS 82 N 1.04 3.25 -0.01 0.91 5.65 -1.26 -0.62 115.29 124.25 1ao5 s HIS 82 Ca -0.09 0.21 -0.19 0.00 0.25 0.00 0.00 55.06 55.24 1ao5 s HIS 82 Cb -0.12 -1.75 0.04 0.00 -1.18 0.00 0.00 32.58 29.57 1ao5 s HIS 82 CO -0.03 0.54 0.42 0.50 -0.65 0.00 0.00 174.74 175.51 1ao5 s ARG 83 N -1.53 0.82 0.18 2.88 6.06 -0.74 -5.02 118.95 121.60 1ao5 s ARG 83 Ca 0.20 -0.13 0.04 0.00 -2.50 0.00 0.00 55.73 53.34 1ao5 s ARG 83 Cb -0.12 0.37 -0.03 0.00 0.06 0.00 0.00 34.95 35.23 1ao5 s ARG 83 CO 0.11 -0.25 0.28 -0.51 -2.50 0.00 0.00 175.30 172.43 1ao5 s LEU 84 N -1.46 4.23 -0.21 -0.88 1.43 -1.26 -1.61 118.68 118.92 1ao5 s LEU 84 Ca -0.11 0.08 -0.06 0.00 -1.03 0.00 0.00 54.13 53.01 1ao5 s LEU 84 Cb -0.03 -2.79 -0.03 0.00 0.03 0.00 0.00 46.19 43.37 1ao5 s LEU 84 CO 0.04 0.02 0.02 -0.69 0.23 0.00 0.00 176.35 175.97 1ao5 s VAL 85 N -1.83 4.13 -0.05 -1.59 1.01 -1.11 -0.94 120.40 120.03 1ao5 s VAL 85 Ca 0.34 -0.25 0.12 0.00 0.00 0.00 0.00 61.98 62.19 1ao5 s VAL 85 Cb -0.10 -2.88 -0.08 0.00 0.00 0.00 0.00 36.38 33.32 1ao5 s VAL 85 CO 0.28 0.41 1.26 0.77 0.00 0.00 0.00 175.10 177.82 1ao5 h SER 86 N 7.58 0.00 -4.05 3.32 4.64 -0.85 -3.44 113.55 120.75 1ao5 h SER 86 Ca -0.37 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.99 1ao5 h SER 86 Cb 1.18 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.04 1ao5 h SER 86 CO 0.61 0.72 0.42 -0.75 -0.87 0.00 0.00 176.83 176.97 1ao5 s LYS 87 N -2.84 0.68 -0.05 4.77 2.20 -1.21 -5.01 119.74 118.29 1ao5 s LYS 87 Ca 0.02 0.35 0.05 0.00 -0.36 0.00 0.00 55.97 56.03 1ao5 s LYS 87 Cb 0.09 0.32 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 1ao5 s LYS 87 CO 0.79 -0.18 -0.20 -1.54 -0.36 0.00 0.00 175.35 173.86 1ao5 s SER 88 N -0.67 3.49 -0.52 1.43 1.04 -1.26 -1.16 113.70 116.05 1ao5 s SER 88 Ca -0.02 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.08 1ao5 s SER 88 Cb -0.02 -0.74 0.14 0.00 0.10 0.00 0.00 66.02 65.50 1ao5 s SER 88 CO 0.01 0.30 0.28 -0.36 0.98 0.00 0.00 173.24 174.46 1ao5 s PHE 89 N -0.49 2.88 0.35 5.02 0.40 0.14 -4.95 117.98 121.33 1ao5 s PHE 89 Ca 0.06 -2.99 -0.27 0.00 -0.60 0.00 0.00 56.93 53.13 1ao5 s PHE 89 Cb -0.11 -2.53 -0.09 0.00 0.51 0.00 0.00 43.02 40.79 1ao5 s PHE 89 CO 0.01 -0.73 1.13 -1.25 0.70 0.00 0.00 175.22 175.08 1ao5 s PRO 90 N -0.26 4.34 0.25 0.24 0.04 -1.26 -1.03 135.00 137.31 1ao5 s PRO 90 Ca 0.18 1.79 -0.31 0.00 0.04 0.00 0.00 61.00 62.71 1ao5 s PRO 90 Cb -0.22 -2.89 -0.13 0.00 0.04 0.00 0.00 34.50 31.30 1ao5 s PRO 90 CO -0.02 -0.06 1.51 1.58 0.04 0.00 0.00 177.00 180.04 1ao5 n HIS 91 N 0.55 2.46 0.44 0.56 -0.00 -0.50 -4.83 115.22 113.90 1ao5 n HIS 91 Ca 0.02 0.33 0.05 0.00 0.46 0.00 0.00 57.72 58.58 1ao5 n HIS 91 Cb 0.46 -2.53 0.24 0.00 -0.12 0.00 0.00 29.99 28.04 1ao5 n HIS 91 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1ao5 n PRO 92 N 2.28 0.12 0.03 1.57 -0.04 -1.26 -2.65 135.00 135.05 1ao5 n PRO 92 Ca 0.11 0.22 0.11 0.00 -0.04 0.00 0.00 63.50 63.90 1ao5 n PRO 92 Cb 0.33 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.28 1ao5 n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ao5 n GLY 93 N -0.46 -1.19 3.71 0.55 0.00 -1.26 -4.91 105.19 101.63 1ao5 n GLY 93 Ca 0.04 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1ao5 n GLY 93 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ao5 s PHE 94 N -3.24 3.26 -0.89 1.61 5.36 -1.08 -4.81 117.98 118.19 1ao5 s PHE 94 Ca 0.02 1.03 -0.24 0.00 -0.96 0.00 0.00 56.93 56.78 1ao5 s PHE 94 Cb 0.14 -3.61 0.05 0.00 -0.34 0.00 0.00 43.02 39.26 1ao5 s PHE 94 CO 0.82 -2.09 1.34 1.21 -1.46 0.00 0.00 175.22 175.04 1ao5 s ASN 95 N 1.16 6.35 0.45 6.13 2.47 -1.26 -4.85 114.94 125.39 1ao5 s ASN 95 Ca 0.63 -1.05 0.10 0.00 0.42 0.00 0.00 52.86 52.96 1ao5 s ASN 95 Cb -0.34 -2.55 0.99 0.00 -1.45 0.00 0.00 41.25 37.90 1ao5 s ASN 95 CO 0.30 -1.62 2.08 0.24 -3.72 0.00 0.00 177.10 174.38 1ao5 h MET 95 N 9.83 0.34 -2.66 0.43 2.86 -1.97 -3.39 114.93 120.38 1ao5 h MET 95 Ca -0.02 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1ao5 h MET 95 Cb 1.03 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1ao5 h MET 95 CO 1.34 0.24 0.23 0.43 1.06 0.00 0.00 176.91 180.21 1ao5 n SER 95 N -4.49 0.00 0.00 1.22 7.64 -1.26 -4.27 113.62 112.46 1ao5 n SER 95 Ca 0.01 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.96 1ao5 n SER 95 Cb 0.08 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1ao5 n SER 95 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ao5 n LEU 95 N 2.26 0.00 0.11 -3.43 4.77 -1.26 -4.10 117.00 115.34 1ao5 n LEU 95 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1ao5 n LEU 95 Cb 0.00 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.55 1ao5 n LEU 95 CO 0.11 0.00 0.85 0.23 -1.33 0.00 0.00 177.39 177.25 1ao5 n MET 95 N 0.00 0.18 -2.67 3.23 2.81 -1.26 -4.76 117.12 114.65 1ao5 n MET 95 Ca 0.00 0.36 -0.42 0.00 -1.81 0.00 0.00 57.70 55.83 1ao5 n MET 95 Cb 0.00 -1.81 -0.03 0.00 -0.71 0.00 0.00 33.22 30.67 1ao5 n MET 95 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1ao5 s LEU 95 N -4.27 4.31 0.40 4.03 1.43 -1.26 -4.94 118.68 118.38 1ao5 s LEU 95 Ca 0.06 1.64 0.21 0.00 -1.03 0.00 0.00 54.13 55.00 1ao5 s LEU 95 Cb 0.10 -3.56 0.77 0.00 0.03 0.00 0.00 46.19 43.52 1ao5 s LEU 95 CO 0.41 -0.38 1.77 1.56 0.23 0.00 0.00 176.35 179.94 1ao5 h GLN 95 N 6.98 0.00 -4.43 1.70 1.08 -1.99 -3.43 115.11 115.02 1ao5 h GLN 95 Ca -0.36 0.00 -0.32 0.00 -1.45 0.00 0.00 58.65 56.52 1ao5 h GLN 95 Cb 1.18 0.00 -0.26 0.00 -0.05 0.00 0.00 27.48 28.35 1ao5 h GLN 95 CO 0.81 0.31 -0.75 0.99 -0.95 0.00 0.00 178.83 179.24 1ao5 s THR 95 N -3.62 0.48 0.00 -0.54 2.01 -1.26 -5.24 115.64 107.48 1ao5 s THR 95 Ca 0.00 -0.48 0.00 0.00 0.31 0.00 0.00 61.69 61.53 1ao5 s THR 95 Cb 0.11 -0.45 0.00 0.00 0.01 0.00 0.00 72.50 72.16 1ao5 s THR 95 CO 0.67 -0.01 0.00 -0.38 -0.69 0.00 0.00 174.62 174.21 1ao5 n ILE 95 N 2.53 0.00 -4.08 1.82 5.41 -1.26 -5.15 119.36 118.63 1ao5 n ILE 95 Ca -0.16 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.24 1ao5 n ILE 95 Cb 0.57 -0.66 -0.09 0.00 -0.71 0.00 0.00 39.64 38.76 1ao5 n ILE 95 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1ao5 s PRO 95 N 0.00 3.55 0.00 0.38 0.02 -1.26 -4.98 135.00 132.70 1ao5 s PRO 95 Ca 0.00 -0.31 0.00 0.00 0.02 0.00 0.00 61.00 60.71 1ao5 s PRO 95 Cb 0.00 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.44 1ao5 s PRO 95 CO 0.00 0.53 0.00 0.41 -0.33 0.00 0.00 177.00 177.61 1ao5 n GLY 96 N 2.72 0.77 3.77 0.52 0.00 0.11 -4.98 105.19 108.10 1ao5 n GLY 96 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1ao5 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ao5 s ALA 97 N -2.85 3.58 -0.30 4.61 0.00 -1.26 -4.13 121.76 121.41 1ao5 s ALA 97 Ca 0.00 1.43 -0.09 0.00 0.00 0.00 0.00 51.96 53.30 1ao5 s ALA 97 Cb 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 1ao5 s ALA 97 CO 0.00 -0.86 0.13 0.34 0.00 0.00 0.00 175.76 175.37 1ao5 s ASP 98 N -0.10 5.45 -0.42 0.00 -1.08 -1.26 -0.76 116.67 118.50 1ao5 s ASP 98 Ca 0.54 -0.47 0.05 0.00 -0.52 0.00 0.00 52.55 52.14 1ao5 s ASP 98 Cb -0.44 -1.98 0.51 0.00 -1.46 0.00 0.00 42.92 39.55 1ao5 s ASP 98 CO 0.55 -0.16 1.63 0.49 0.52 0.00 0.00 175.17 178.20 1ao5 n PHE 99 N 4.96 2.32 -1.52 -5.34 3.72 -1.26 -4.70 117.46 115.65 1ao5 n PHE 99 Ca -0.14 -2.15 -0.31 0.00 -0.05 0.00 0.00 57.45 54.79 1ao5 n PHE 99 Cb 0.49 -0.79 0.06 0.00 -0.94 0.00 0.00 39.48 38.31 1ao5 n PHE 99 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1ao5 s SER 100 N -2.37 5.03 -0.75 4.37 0.01 -1.26 -4.05 113.70 114.68 1ao5 s SER 100 Ca 0.53 1.77 -0.03 0.00 1.31 0.00 0.00 55.95 59.53 1ao5 s SER 100 Cb 0.45 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 64.16 1ao5 s SER 100 CO 0.02 -1.68 0.40 0.47 0.41 0.00 0.00 173.24 172.86 1ao5 n ASP 101 N -3.09 -3.95 -3.29 2.44 8.00 -1.26 -4.24 116.55 111.16 1ao5 n ASP 101 Ca 0.09 -0.18 -0.38 0.00 0.71 0.00 0.00 54.79 55.02 1ao5 n ASP 101 Cb 0.53 -2.74 -0.03 0.00 -0.02 0.00 0.00 41.12 38.86 1ao5 n ASP 101 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ao5 n ASP 102 N -0.50 8.62 -4.39 -2.24 2.03 -1.26 -4.01 116.55 114.81 1ao5 n ASP 102 Ca -0.04 -2.62 -0.20 0.00 0.52 0.00 0.00 54.79 52.44 1ao5 n ASP 102 Cb 0.55 -1.54 -0.10 0.00 -0.72 0.00 0.00 41.12 39.31 1ao5 n ASP 102 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ao5 s LEU 103 N -0.06 2.57 -0.28 -2.67 1.43 -1.26 -3.08 118.68 115.32 1ao5 s LEU 103 Ca 0.68 -1.02 -0.22 0.00 -1.03 0.00 0.00 54.13 52.54 1ao5 s LEU 103 Cb 0.18 -0.82 0.10 0.00 0.03 0.00 0.00 46.19 45.69 1ao5 s LEU 103 CO -0.06 -0.10 0.88 -0.32 0.23 0.00 0.00 176.35 176.98 1ao5 s MET 104 N -3.59 0.61 -0.06 1.70 1.75 -0.39 -1.41 119.30 117.92 1ao5 s MET 104 Ca 0.25 0.82 -0.01 0.00 -1.25 0.00 0.00 55.69 55.50 1ao5 s MET 104 Cb -0.02 0.24 -0.04 0.00 2.84 0.00 0.00 34.83 37.86 1ao5 s MET 104 CO 0.10 -0.09 0.03 -0.51 -0.65 0.00 0.00 175.02 173.90 1ao5 s LEU 105 N 0.69 3.69 -0.14 4.11 1.43 -0.20 -1.86 118.68 126.39 1ao5 s LEU 105 Ca -0.02 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1ao5 s LEU 105 Cb -0.05 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.23 1ao5 s LEU 105 CO -0.08 0.34 -0.15 -0.76 0.23 0.00 0.00 176.35 175.93 1ao5 s LEU 106 N -1.19 1.72 -0.35 1.79 1.43 -0.42 0.24 118.68 121.90 1ao5 s LEU 106 Ca 0.16 -0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 52.61 1ao5 s LEU 106 Cb -0.12 -1.18 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 1ao5 s LEU 106 CO 0.06 -0.03 0.48 -0.60 0.23 0.00 0.00 176.35 176.49 1ao5 s ARG 107 N 1.34 3.58 0.37 1.70 3.52 -0.31 -1.73 118.95 127.42 1ao5 s ARG 107 Ca 0.02 -0.24 -0.27 0.00 -0.13 0.00 0.00 55.73 55.11 1ao5 s ARG 107 Cb -0.13 -3.82 -0.09 0.00 -1.56 0.00 0.00 34.95 29.34 1ao5 s ARG 107 CO -0.08 -0.63 1.31 -0.51 -0.81 0.00 0.00 175.30 174.57 1ao5 s LEU 108 N 2.31 4.31 0.18 -0.88 1.43 -0.32 -0.21 118.68 125.50 1ao5 s LEU 108 Ca 0.17 2.67 -0.09 0.00 -1.03 0.00 0.00 54.13 55.86 1ao5 s LEU 108 Cb -0.16 -3.79 0.07 0.00 0.03 0.00 0.00 46.19 42.34 1ao5 s LEU 108 CO 0.13 -0.71 1.60 0.28 0.23 0.00 0.00 176.35 177.88 1ao5 h SER 109 N 2.99 1.00 -3.22 2.29 0.02 -1.35 -3.42 113.55 111.84 1ao5 h SER 109 Ca -0.49 -0.34 -0.62 0.00 -0.84 0.00 0.00 61.79 59.50 1ao5 h SER 109 Cb 1.24 -0.27 -0.35 0.00 0.14 0.00 0.00 62.40 63.16 1ao5 h SER 109 CO 0.64 1.12 -0.85 -0.75 -1.14 0.00 0.00 176.83 175.85 1ao5 s LYS 110 N -4.79 2.53 0.65 3.45 2.20 -1.26 -5.00 119.74 117.52 1ao5 s LYS 110 Ca -0.11 -0.67 -0.17 0.00 -0.36 0.00 0.00 55.97 54.66 1ao5 s LYS 110 Cb 0.13 -2.12 -0.07 0.00 -1.51 0.00 0.00 37.83 34.25 1ao5 s LYS 110 CO 0.86 -0.07 0.40 -2.30 -0.36 0.00 0.00 175.35 173.88 1ao5 n PRO 111 N 4.23 0.33 -3.66 4.03 -0.02 -1.26 -4.91 135.00 133.75 1ao5 n PRO 111 Ca -0.19 0.14 -0.30 0.00 -2.02 0.00 0.00 63.50 61.13 1ao5 n PRO 111 Cb 0.51 -1.65 -0.04 0.00 -0.02 0.00 0.00 33.50 32.29 1ao5 n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ao5 s ALA 112 N -1.85 3.79 -0.49 3.55 0.00 -0.66 -5.03 121.76 121.06 1ao5 s ALA 112 Ca 0.65 -0.62 -0.19 0.00 0.00 0.00 0.00 51.96 51.79 1ao5 s ALA 112 Cb -0.39 -2.11 0.05 0.00 0.00 0.00 0.00 23.12 20.67 1ao5 s ALA 112 CO 0.59 0.59 0.63 -0.51 0.00 0.00 0.00 175.76 177.06 1ao5 s ASP 113 N -2.64 6.24 0.03 0.00 1.01 -1.26 -4.85 116.67 115.20 1ao5 s ASP 113 Ca 0.41 -0.79 -0.30 0.00 0.71 0.00 0.00 52.55 52.57 1ao5 s ASP 113 Cb -0.12 -2.29 -0.07 0.00 1.01 0.00 0.00 42.92 41.44 1ao5 s ASP 113 CO 0.26 -0.87 1.65 -0.63 0.21 0.00 0.00 175.17 175.80 1ao5 s ILE 114 N 2.67 3.25 0.00 0.77 1.01 -1.26 -4.70 121.20 122.93 1ao5 s ILE 114 Ca 0.17 0.57 0.00 0.00 0.00 0.00 0.00 60.65 61.39 1ao5 s ILE 114 Cb -0.18 -3.37 0.00 0.00 0.01 0.00 0.00 42.46 38.92 1ao5 s ILE 114 CO 0.13 -0.02 0.00 0.35 0.00 0.00 0.00 174.94 175.40 1ao5 n THR 115 N 4.99 0.00 0.04 2.92 -2.24 -0.33 -4.97 114.28 114.69 1ao5 n THR 115 Ca 0.16 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.80 1ao5 n THR 115 Cb 0.41 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.51 1ao5 n THR 115 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ao5 h ASP 116 N 0.00 0.26 0.83 3.42 3.32 -1.99 -3.36 116.42 118.90 1ao5 h ASP 116 Ca 0.00 -0.40 -0.23 0.00 0.02 0.00 0.00 57.03 56.42 1ao5 h ASP 116 Cb 0.00 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1ao5 h ASP 116 CO 0.00 1.34 -1.06 0.58 -1.72 0.00 0.00 179.24 178.38 1ao5 h VAL 117 N 0.05 1.62 -3.23 -1.35 2.07 -1.93 -3.45 116.25 110.02 1ao5 h VAL 117 Ca -0.24 -3.20 -0.63 0.00 0.82 0.00 0.00 66.70 63.44 1ao5 h VAL 117 Cb 1.99 2.83 -0.34 0.00 -1.52 0.00 0.00 31.29 34.25 1ao5 h VAL 117 CO 0.13 0.92 -0.85 -0.69 0.02 0.00 0.00 177.57 177.10 1ao5 s VAL 118 N -2.76 1.79 -0.17 2.57 1.01 -1.26 -4.42 120.40 117.17 1ao5 s VAL 118 Ca -0.01 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 1ao5 s VAL 118 Cb 0.09 -1.61 0.05 0.00 0.00 0.00 0.00 36.38 34.92 1ao5 s VAL 118 CO 0.84 0.50 0.42 -0.54 0.00 0.00 0.00 175.10 176.32 1ao5 s LYS 119 N 0.90 0.43 0.98 2.72 1.02 -1.10 -1.18 119.74 123.51 1ao5 s LYS 119 Ca -0.07 0.74 -0.15 0.00 0.02 0.00 0.00 55.97 56.52 1ao5 s LYS 119 Cb -0.15 0.06 0.18 0.00 -0.52 0.00 0.00 37.83 37.40 1ao5 s LYS 119 CO -0.02 -0.13 1.18 -1.25 -0.92 0.00 0.00 175.35 174.21 1ao5 s PRO 120 N 1.07 0.57 0.05 -1.68 0.04 -1.26 -2.85 135.00 130.93 1ao5 s PRO 120 Ca -0.07 0.05 0.06 0.00 0.04 0.00 0.00 61.00 61.08 1ao5 s PRO 120 Cb -0.07 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.65 1ao5 s PRO 120 CO -0.09 -2.54 -0.16 -1.50 0.04 0.00 0.00 177.00 172.75 1ao5 s ILE 121 N -3.37 1.27 0.40 0.56 2.07 -0.53 -4.85 121.20 116.74 1ao5 s ILE 121 Ca 0.67 -1.11 -0.23 0.00 -1.41 0.00 0.00 60.65 58.57 1ao5 s ILE 121 Cb -0.11 -1.14 -0.10 0.00 0.13 0.00 0.00 42.46 41.23 1ao5 s ILE 121 CO 0.54 0.02 0.96 0.00 -1.91 0.00 0.00 174.94 174.54 1ao5 s ALA 122 N -0.91 3.09 0.75 1.50 0.00 -1.26 -4.61 121.76 120.32 1ao5 s ALA 122 Ca 0.03 0.48 -0.14 0.00 0.00 0.00 0.00 51.96 52.32 1ao5 s ALA 122 Cb -0.08 -3.18 0.05 0.00 0.00 0.00 0.00 23.12 19.91 1ao5 s ALA 122 CO 0.02 0.09 1.19 -0.51 0.00 0.00 0.00 175.76 176.55 1ao5 s LEU 123 N -2.78 3.26 0.59 0.00 1.43 -1.26 -4.49 118.68 115.44 1ao5 s LEU 123 Ca 0.58 2.31 -0.15 0.00 -1.03 0.00 0.00 54.13 55.84 1ao5 s LEU 123 Cb -0.14 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.46 1ao5 s LEU 123 CO 0.18 -2.31 1.04 -2.16 0.23 0.00 0.00 176.35 173.33 1ao5 s PRO 124 N -4.02 3.43 -0.04 1.29 0.04 -1.24 -4.93 135.00 129.53 1ao5 s PRO 124 Ca 0.73 1.08 0.02 0.00 0.04 0.00 0.00 61.00 62.86 1ao5 s PRO 124 Cb -0.28 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.17 1ao5 s PRO 124 CO 0.47 -0.71 -0.01 0.25 0.04 0.00 0.00 177.00 177.03 1ao5 n THR 125 N -2.13 0.24 -2.76 1.26 -2.24 -1.26 -4.89 114.28 102.49 1ao5 n THR 125 Ca 0.08 -0.12 -0.23 0.00 -2.27 0.00 0.00 64.05 61.51 1ao5 n THR 125 Cb 0.53 -0.77 0.02 0.00 -2.10 0.00 0.00 70.33 68.01 1ao5 n THR 125 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ao5 s LYS 128 N -2.08 2.82 0.08 -0.78 1.02 -1.26 -5.09 119.74 114.45 1ao5 s LYS 128 Ca -0.04 -0.53 -0.12 0.00 0.02 0.00 0.00 55.97 55.30 1ao5 s LYS 128 Cb 0.01 -2.49 -0.06 0.00 -0.52 0.00 0.00 37.83 34.78 1ao5 s LYS 128 CO 0.12 -0.52 0.44 -1.21 -0.92 0.00 0.00 175.35 173.26 1ao5 s GLU 129 N -4.71 3.84 0.23 1.68 2.02 -1.26 -4.90 118.70 115.60 1ao5 s GLU 129 Ca 0.53 0.29 -0.31 0.00 0.02 0.00 0.00 54.97 55.50 1ao5 s GLU 129 Cb -0.10 -3.02 -0.11 0.00 0.10 0.00 0.00 34.13 31.00 1ao5 s GLU 129 CO 0.39 0.56 1.63 -1.25 0.02 0.00 0.00 175.26 176.61 1ao5 s PRO 130 N -1.79 4.15 -0.23 0.39 0.04 -1.26 -4.99 135.00 131.30 1ao5 s PRO 130 Ca 0.33 2.52 -0.06 0.00 0.04 0.00 0.00 61.00 63.83 1ao5 s PRO 130 Cb -0.15 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 1ao5 s PRO 130 CO 0.18 -0.66 0.03 0.15 0.04 0.00 0.00 177.00 176.73 1ao5 s LYS 131 N 0.53 3.57 0.76 4.56 1.02 -1.26 -5.09 119.74 123.82 1ao5 s LYS 131 Ca 0.69 -0.53 -0.16 0.00 0.02 0.00 0.00 55.97 56.00 1ao5 s LYS 131 Cb -0.47 -3.19 -0.02 0.00 -0.52 0.00 0.00 37.83 33.62 1ao5 s LYS 131 CO 0.38 -0.16 0.55 -2.30 -0.92 0.00 0.00 175.35 172.90 1ao5 n PRO 132 N 4.78 0.23 0.00 -1.68 -0.02 -1.26 -2.48 135.00 134.57 1ao5 n PRO 132 Ca -0.17 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1ao5 n PRO 132 Cb 0.51 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1ao5 n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ao5 n GLY 133 N 1.57 2.93 3.70 -1.23 0.00 0.83 -4.99 105.19 108.00 1ao5 n GLY 133 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1ao5 n GLY 133 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ao5 n SER 134 N 0.00 2.23 -4.63 1.61 7.64 -1.03 -4.63 113.62 114.80 1ao5 n SER 134 Ca 0.00 1.01 -0.40 0.00 1.01 0.00 0.00 58.87 60.48 1ao5 n SER 134 Cb 0.00 -1.50 -0.07 0.00 -1.01 0.00 0.00 64.21 61.63 1ao5 n SER 134 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1ao5 s LYS 135 N -2.52 4.12 0.12 1.43 2.20 -1.26 -0.83 119.74 122.99 1ao5 s LYS 135 Ca 0.67 0.51 0.10 0.00 -0.36 0.00 0.00 55.97 56.89 1ao5 s LYS 135 Cb -0.46 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.18 1ao5 s LYS 135 CO 0.53 -0.36 -0.25 0.00 -0.36 0.00 0.00 175.35 174.91 1ao5 s LEU 137 N -2.02 3.12 0.06 0.00 2.96 0.19 -0.35 118.68 122.64 1ao5 s LEU 137 Ca 0.12 -0.14 0.09 0.00 -0.22 0.00 0.00 54.13 53.98 1ao5 s LEU 137 Cb -0.10 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 1ao5 s LEU 137 CO 0.05 0.22 -0.24 0.00 -1.32 0.00 0.00 176.35 175.07 1ao5 s ALA 138 N 0.04 2.39 0.03 5.97 0.00 -0.49 -1.18 121.76 128.51 1ao5 s ALA 138 Ca -0.01 -1.28 -0.06 0.00 0.00 0.00 0.00 51.96 50.61 1ao5 s ALA 138 Cb -0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 1ao5 s ALA 138 CO 0.03 0.55 0.11 -1.54 0.00 0.00 0.00 175.76 174.91 1ao5 s SER 139 N -1.45 0.12 0.00 0.00 1.04 -1.24 -1.12 113.70 111.05 1ao5 s SER 139 Ca 0.13 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1ao5 s SER 139 Cb -0.10 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1ao5 s SER 139 CO 0.04 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.41 1ao5 n GLY 140 N 1.02 -0.85 1.04 7.32 0.00 -0.15 -4.51 105.19 109.06 1ao5 n GLY 140 Ca -0.20 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1ao5 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ao5 n TRP 141 N -0.65 1.03 -1.10 1.61 8.01 -1.26 -1.10 117.44 123.98 1ao5 n TRP 141 Ca 0.00 -1.33 -0.29 0.00 -1.31 0.00 0.00 57.50 54.57 1ao5 n TRP 141 Cb 0.00 -0.43 0.20 0.00 -2.01 0.00 0.00 31.31 29.07 1ao5 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1ao5 s GLY 142 N -2.32 1.56 0.47 6.99 0.00 -1.26 -4.38 107.32 108.39 1ao5 s GLY 142 Ca 0.43 -0.51 -0.22 0.00 0.00 0.00 0.00 44.72 44.43 1ao5 s GLY 142 CO 0.03 0.19 0.80 -1.26 0.00 0.00 0.00 173.10 172.86 1ao5 n SER 143 N -4.39 0.25 -0.27 1.64 2.88 0.17 -2.31 113.62 111.59 1ao5 n SER 143 Ca 0.07 0.92 0.10 0.00 -1.33 0.00 0.00 58.87 58.63 1ao5 n SER 143 Cb 0.58 -1.26 -0.05 0.00 -0.75 0.00 0.00 64.21 62.72 1ao5 n SER 143 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1ao5 n ILE 144 N -0.94 0.00 -4.60 2.46 -5.35 -0.14 -1.62 119.36 109.18 1ao5 n ILE 144 Ca 0.11 -0.18 -0.34 0.00 -0.27 0.00 0.00 62.75 62.07 1ao5 n ILE 144 Cb 0.42 1.14 -0.12 0.00 -1.74 0.00 0.00 39.64 39.34 1ao5 n ILE 144 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1ao5 s THR 145 N -2.55 3.67 0.67 7.28 -4.23 -1.26 -4.67 115.64 114.54 1ao5 s THR 145 Ca 0.13 -0.48 0.40 0.00 -1.18 0.00 0.00 61.69 60.57 1ao5 s THR 145 Cb 0.16 -2.53 0.40 0.00 1.34 0.00 0.00 72.50 71.88 1ao5 s THR 145 CO 0.65 0.57 2.24 1.55 -0.54 0.00 0.00 174.62 179.08 1ao5 h PRO 146 N 5.72 0.00 -2.04 3.99 0.13 -1.90 -3.43 132.00 134.46 1ao5 h PRO 146 Ca -0.42 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.16 1ao5 h PRO 146 Cb 1.18 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.94 1ao5 h PRO 146 CO 0.55 0.00 -1.01 0.25 -0.23 0.00 0.00 178.00 177.56 1ao5 n THR 147 N -3.04 -0.88 -4.12 1.56 -2.24 -1.26 -2.95 114.28 101.36 1ao5 n THR 147 Ca -0.03 -3.55 -0.15 0.00 -2.27 0.00 0.00 64.05 58.05 1ao5 n THR 147 Cb 0.17 -1.59 -0.14 0.00 -2.10 0.00 0.00 70.33 66.67 1ao5 n THR 147 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1ao5 s TRP 149 N -0.50 0.41 -0.28 4.78 0.23 -1.26 -5.16 118.94 117.15 1ao5 s TRP 149 Ca 0.34 -0.09 0.01 0.00 -2.03 0.00 0.00 56.10 54.33 1ao5 s TRP 149 Cb 0.11 -0.26 0.17 0.00 0.03 0.00 0.00 33.47 33.52 1ao5 s TRP 149 CO -0.15 -0.01 0.51 -1.14 0.96 0.00 0.00 176.95 177.12 1ao5 s GLN 150 N -0.16 0.49 0.57 4.98 2.00 -1.26 -4.99 119.66 121.29 1ao5 s GLN 150 Ca 0.01 0.58 -0.14 0.00 -2.00 0.00 0.00 55.36 53.82 1ao5 s GLN 150 Cb -0.02 0.06 -0.06 0.00 0.80 0.00 0.00 33.01 33.79 1ao5 s GLN 150 CO -0.00 -0.84 1.01 0.15 -0.50 0.00 0.00 175.29 175.11 1ao5 s LYS 151 N 2.71 3.76 0.34 1.67 1.02 -1.26 -0.96 119.74 127.03 1ao5 s LYS 151 Ca 0.14 0.85 0.07 0.00 0.02 0.00 0.00 55.97 57.05 1ao5 s LYS 151 Cb -0.13 -2.11 -0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1ao5 s LYS 151 CO -0.23 -0.43 0.43 -1.25 -0.92 0.00 0.00 175.35 172.94 1ao5 s PRO 152 N -4.64 2.98 -0.09 -1.68 0.04 -1.26 -4.89 135.00 125.47 1ao5 s PRO 152 Ca 0.57 -1.11 -0.02 0.00 0.04 0.00 0.00 61.00 60.48 1ao5 s PRO 152 Cb -0.11 -2.72 -0.01 0.00 0.04 0.00 0.00 34.50 31.71 1ao5 s PRO 152 CO 0.43 0.04 -0.04 0.22 0.04 0.00 0.00 177.00 177.70 1ao5 h ASP 153 N 0.97 0.00 -3.87 6.66 3.58 -1.96 -3.43 116.42 118.37 1ao5 h ASP 153 Ca -0.45 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.48 1ao5 h ASP 153 Cb 1.26 0.00 0.06 0.00 1.72 0.00 0.00 39.33 42.36 1ao5 h ASP 153 CO 0.54 0.44 0.60 -1.81 -2.88 0.00 0.00 179.24 176.12 1ao5 s ASP 154 N -5.04 6.83 0.31 2.28 1.01 -1.26 -0.34 116.67 120.46 1ao5 s ASP 154 Ca -0.03 2.59 -0.30 0.00 0.71 0.00 0.00 52.55 55.52 1ao5 s ASP 154 Cb 0.00 -2.64 -0.11 0.00 1.01 0.00 0.00 42.92 41.18 1ao5 s ASP 154 CO 0.05 -0.48 1.59 -0.22 0.21 0.00 0.00 175.17 176.31 1ao5 s LEU 155 N -1.80 4.34 0.04 1.23 2.96 -0.02 -4.89 118.68 120.53 1ao5 s LEU 155 Ca 0.49 2.98 0.02 0.00 -0.22 0.00 0.00 54.13 57.40 1ao5 s LEU 155 Cb -0.38 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.63 1ao5 s LEU 155 CO 0.50 -0.92 0.07 -1.10 -1.32 0.00 0.00 176.35 173.58 1ao5 s GLN 156 N -0.70 2.94 0.02 1.98 -1.52 -0.26 -2.37 119.66 119.74 1ao5 s GLN 156 Ca 0.62 -0.61 0.05 0.00 -1.95 0.00 0.00 55.36 53.47 1ao5 s GLN 156 Cb -0.48 -2.77 -0.02 0.00 -0.22 0.00 0.00 33.01 29.53 1ao5 s GLN 156 CO 0.50 0.60 -0.16 0.00 -0.25 0.00 0.00 175.29 175.98 1ao5 s VAL 158 N -0.60 0.13 -0.12 0.00 0.11 -0.28 -0.55 120.40 119.09 1ao5 s VAL 158 Ca 0.05 -1.06 -0.01 0.00 -2.93 0.00 0.00 61.98 58.03 1ao5 s VAL 158 Cb -0.07 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.12 1ao5 s VAL 158 CO 0.00 -0.58 -0.08 -0.36 -3.33 0.00 0.00 175.10 170.75 1ao5 s PHE 159 N -2.11 2.91 0.24 1.54 0.08 -1.26 -1.39 117.98 117.99 1ao5 s PHE 159 Ca -0.10 -0.32 0.01 0.00 0.12 0.00 0.00 56.93 56.64 1ao5 s PHE 159 Cb -0.05 -1.84 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1ao5 s PHE 159 CO -0.03 0.01 0.16 0.96 -0.10 0.00 0.00 175.22 176.23 1ao5 s ILE 160 N -0.00 0.03 -0.08 0.64 -4.36 0.52 -4.96 121.20 112.98 1ao5 s ILE 160 Ca -0.01 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.37 1ao5 s ILE 160 Cb -0.14 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.04 1ao5 s ILE 160 CO 0.03 0.00 -0.04 -0.89 0.24 0.00 0.00 174.94 174.28 1ao5 s THR 161 N -3.96 3.95 -0.17 8.37 2.01 -0.73 -0.24 115.64 124.87 1ao5 s THR 161 Ca 0.39 -0.38 -0.28 0.00 0.31 0.00 0.00 61.69 61.73 1ao5 s THR 161 Cb 0.06 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 1ao5 s THR 161 CO 0.16 0.60 0.95 -0.22 -0.69 0.00 0.00 174.62 175.42 1ao5 s LEU 162 N -0.77 4.17 0.25 4.42 2.96 -0.01 -1.45 118.68 128.25 1ao5 s LEU 162 Ca 0.12 1.34 0.11 0.00 -0.22 0.00 0.00 54.13 55.48 1ao5 s LEU 162 Cb -0.11 -3.43 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 1ao5 s LEU 162 CO 0.02 -0.50 -0.12 -0.76 -1.32 0.00 0.00 176.35 173.66 1ao5 s LEU 163 N 2.46 2.84 0.48 -0.68 1.43 -0.17 -0.12 118.68 124.92 1ao5 s LEU 163 Ca 0.43 -0.81 -0.24 0.00 -1.03 0.00 0.00 54.13 52.48 1ao5 s LEU 163 Cb -0.17 -1.40 -0.07 0.00 0.03 0.00 0.00 46.19 44.58 1ao5 s LEU 163 CO 0.12 0.05 1.35 -2.84 0.23 0.00 0.00 176.35 175.25 1ao5 s PRO 164 N -3.37 3.53 0.44 1.29 0.02 -1.26 -4.09 135.00 131.56 1ao5 s PRO 164 Ca 0.29 2.23 0.20 0.00 0.02 0.00 0.00 61.00 63.73 1ao5 s PRO 164 Cb -0.06 -2.49 1.15 0.00 0.02 0.00 0.00 34.50 33.11 1ao5 s PRO 164 CO 0.16 -0.88 1.87 -0.91 -0.33 0.00 0.00 177.00 176.91 1ao5 h ASN 165 N 2.01 0.34 -0.78 2.53 4.21 -1.95 -1.06 115.58 120.89 1ao5 h ASN 165 Ca -0.50 0.04 0.18 0.00 1.21 0.00 0.00 56.30 57.22 1ao5 h ASN 165 Cb 1.27 -0.03 -0.12 0.00 -1.12 0.00 0.00 38.32 38.33 1ao5 h ASN 165 CO 0.60 0.14 0.18 -0.33 -1.29 0.00 0.00 177.43 176.72 1ao5 h GLU 166 N 0.34 0.24 -0.81 0.81 5.08 -1.98 0.34 114.58 118.59 1ao5 h GLU 166 Ca 0.45 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.92 1ao5 h GLU 166 Cb 1.23 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.34 1ao5 h GLU 166 CO -0.15 0.16 0.43 -0.91 -1.00 0.00 0.00 179.01 177.54 1ao5 h ASN 167 N 0.25 0.56 0.03 1.42 4.21 -1.54 -0.60 115.58 119.89 1ao5 h ASN 167 Ca 0.45 0.07 -0.14 0.00 1.21 0.00 0.00 56.30 57.89 1ao5 h ASN 167 Cb 0.80 -0.02 0.01 0.00 -1.12 0.00 0.00 38.32 37.99 1ao5 h ASN 167 CO -0.56 0.28 -0.57 0.00 -1.29 0.00 0.00 177.43 175.30 1ao5 h ALA 169 N 0.26 1.67 -0.45 0.00 0.00 -0.64 -1.74 119.26 118.35 1ao5 h ALA 169 Ca -0.08 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ao5 h ALA 169 Cb 1.32 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1ao5 h ALA 169 CO 0.11 0.02 -0.10 -0.22 0.00 0.00 0.00 179.25 179.06 1ao5 h LYS 170 N 0.00 0.86 -0.01 0.00 3.64 -1.18 -3.33 116.57 116.55 1ao5 h LYS 170 Ca -0.00 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1ao5 h LYS 170 Cb 0.03 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1ao5 h LYS 170 CO 0.00 0.96 -0.64 1.33 -2.27 0.00 0.00 179.45 178.83 1ao5 n VAL 171 N -4.28 0.00 -4.07 2.00 0.24 -0.73 -4.97 118.33 106.53 1ao5 n VAL 171 Ca -0.00 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.34 61.92 1ao5 n VAL 171 Cb 0.38 0.92 -0.05 0.00 -1.47 0.00 0.00 33.84 33.61 1ao5 n VAL 171 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1ao5 s TYR 172 N -2.74 3.18 -0.36 6.34 2.02 -0.76 -5.00 117.35 120.02 1ao5 s TYR 172 Ca 0.14 0.00 0.23 0.00 -0.37 0.00 0.00 57.07 57.08 1ao5 s TYR 172 Cb 0.17 -1.53 0.02 0.00 -0.40 0.00 0.00 41.96 40.22 1ao5 s TYR 172 CO 0.69 0.52 1.01 1.28 -1.57 0.00 0.00 175.55 177.48 1ao5 n LEU 173 N -0.30 0.67 -4.89 -1.29 4.77 -1.26 -4.90 117.00 109.81 1ao5 n LEU 173 Ca -0.08 0.19 -0.29 0.00 -0.03 0.00 0.00 56.01 55.79 1ao5 n LEU 173 Cb 0.54 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1ao5 n LEU 173 CO 0.44 -0.09 0.66 -1.10 -1.33 0.00 0.00 177.39 175.97 1ao5 s GLN 174 N -3.31 3.24 0.07 3.23 1.11 -1.26 0.07 119.66 122.81 1ao5 s GLN 174 Ca 0.01 0.45 -0.30 0.00 0.01 0.00 0.00 55.36 55.53 1ao5 s GLN 174 Cb 0.12 -2.14 -0.06 0.00 -1.01 0.00 0.00 33.01 29.93 1ao5 s GLN 174 CO 0.80 -0.69 1.18 0.15 0.01 0.00 0.00 175.29 176.74 1ao5 s LYS 175 N -5.14 4.45 -0.34 2.91 1.02 0.06 -4.80 119.74 117.90 1ao5 s LYS 175 Ca 0.55 1.76 -0.10 0.00 0.02 0.00 0.00 55.97 58.20 1ao5 s LYS 175 Cb -0.11 -3.34 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1ao5 s LYS 175 CO 0.51 -0.22 0.17 0.08 -0.92 0.00 0.00 175.35 174.96 1ao5 s VAL 176 N 0.92 4.44 0.56 3.17 1.01 -1.26 -4.53 120.40 124.70 1ao5 s VAL 176 Ca 0.58 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.89 1ao5 s VAL 176 Cb -0.29 -3.39 0.05 0.00 0.00 0.00 0.00 36.38 32.75 1ao5 s VAL 176 CO 0.30 -0.10 0.51 0.42 0.00 0.00 0.00 175.10 176.23 1ao5 s THR 177 N 1.55 1.76 0.48 3.92 -4.23 -1.26 -4.98 115.64 112.88 1ao5 s THR 177 Ca 0.03 -1.36 0.17 0.00 -1.18 0.00 0.00 61.69 59.35 1ao5 s THR 177 Cb -0.18 -2.12 0.23 0.00 1.34 0.00 0.00 72.50 71.77 1ao5 s THR 177 CO 0.06 0.00 2.07 0.44 -0.54 0.00 0.00 174.62 176.65 1ao5 h ASP 178 N 0.59 0.00 -0.21 3.99 3.32 -2.03 -2.31 116.42 119.77 1ao5 h ASP 178 Ca -0.35 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.69 1ao5 h ASP 178 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 1ao5 h ASP 178 CO 0.53 0.11 0.02 1.33 -1.72 0.00 0.00 179.24 179.50 1ao5 n VAL 179 N -4.29 1.04 -4.44 -1.35 0.24 -1.26 -4.83 118.33 103.44 1ao5 n VAL 179 Ca -0.03 -0.51 -0.22 0.00 -2.04 0.00 0.00 64.34 61.55 1ao5 n VAL 179 Cb 0.18 -0.45 -0.10 0.00 -1.47 0.00 0.00 33.84 32.00 1ao5 n VAL 179 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1ao5 s MET 180 N -1.58 1.58 0.13 7.34 -1.94 -0.87 -1.84 119.30 122.11 1ao5 s MET 180 Ca 0.19 -1.79 0.04 0.00 -1.71 0.00 0.00 55.69 52.42 1ao5 s MET 180 Cb 0.15 -1.28 -0.04 0.00 2.01 0.00 0.00 34.83 35.67 1ao5 s MET 180 CO 0.05 0.09 -0.10 -0.51 -0.01 0.00 0.00 175.02 174.54 1ao5 s LEU 181 N -3.46 2.48 -0.09 -0.03 1.43 0.28 -4.45 118.68 114.85 1ao5 s LEU 181 Ca 0.29 -0.94 0.03 0.00 -1.03 0.00 0.00 54.13 52.48 1ao5 s LEU 181 Cb 0.03 -0.32 0.01 0.00 0.03 0.00 0.00 46.19 45.93 1ao5 s LEU 181 CO 0.12 -0.31 -0.18 0.00 0.23 0.00 0.00 176.35 176.22 1ao5 s ALA 183 N 0.59 -1.60 0.00 0.00 0.00 -0.77 -1.00 121.76 118.99 1ao5 s ALA 183 Ca -0.15 1.07 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1ao5 s ALA 183 Cb -0.17 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1ao5 s ALA 183 CO 0.05 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.82 1ao5 n GLY 184 N 0.80 -0.50 3.02 0.00 0.00 -0.53 -0.91 105.19 107.08 1ao5 n GLY 184 Ca -0.19 -0.98 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 1ao5 n GLY 184 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ao5 s GLU 185 N -1.85 1.93 0.43 1.61 0.41 -1.26 -1.78 118.70 118.18 1ao5 s GLU 185 Ca 0.00 -0.46 0.14 0.00 -0.41 0.00 0.00 54.97 54.24 1ao5 s GLU 185 Cb 0.00 -1.67 0.94 0.00 -1.78 0.00 0.00 34.13 31.63 1ao5 s GLU 185 CO 0.00 -0.06 1.95 0.52 -0.49 0.00 0.00 175.26 177.18 1ao5 h MET 185 N 7.37 0.00 0.00 1.61 2.86 -1.95 -0.59 114.93 124.23 1ao5 h MET 185 Ca -0.31 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1ao5 h MET 185 Cb 1.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.83 1ao5 h MET 185 CO 0.47 0.23 0.00 0.41 1.06 0.00 0.00 176.91 179.08 1ao5 n GLY 185 N -0.86 -0.94 1.03 8.32 0.00 -1.26 -1.43 105.19 110.04 1ao5 n GLY 185 Ca -0.02 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.08 1ao5 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ao5 n GLY 186 N 0.02 -1.87 0.91 -0.02 0.00 -0.23 -4.71 105.19 99.28 1ao5 n GLY 186 Ca 0.05 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1ao5 n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ao5 n GLY 187 N -3.41 3.18 3.08 -0.02 0.00 0.35 -4.93 105.19 103.44 1ao5 n GLY 187 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ao5 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ao5 s LYS 188 N -0.46 2.34 -0.11 1.61 1.02 -1.25 -3.65 119.74 119.25 1ao5 s LYS 188 Ca 0.00 -0.61 -0.33 0.00 0.02 0.00 0.00 55.97 55.05 1ao5 s LYS 188 Cb 0.00 -1.95 0.13 0.00 -0.52 0.00 0.00 37.83 35.49 1ao5 s LYS 188 CO 0.00 -0.03 1.27 0.34 -0.92 0.00 0.00 175.35 176.01 1ao5 s ASP 189 N 0.90 -0.08 0.78 2.83 2.15 -0.83 -4.22 116.67 118.20 1ao5 s ASP 189 Ca -0.08 -0.07 -0.09 0.00 0.43 0.00 0.00 52.55 52.75 1ao5 s ASP 189 Cb -0.15 0.14 0.10 0.00 -0.30 0.00 0.00 42.92 42.71 1ao5 s ASP 189 CO -0.01 -0.24 1.11 0.42 -0.17 0.00 0.00 175.17 176.28 1ao5 s THR 190 N -2.38 2.15 0.11 1.71 -4.23 -1.26 -0.54 115.64 111.20 1ao5 s THR 190 Ca 0.12 -0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 60.41 1ao5 s THR 190 Cb 0.02 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.93 1ao5 s THR 190 CO -0.04 0.00 0.17 0.00 -0.54 0.00 0.00 174.62 174.21 1ao5 n ARG 192 N -0.16 1.05 -0.83 0.00 0.63 -1.26 -1.23 116.66 114.85 1ao5 n ARG 192 Ca -0.01 0.38 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 1ao5 n ARG 192 Cb 0.17 -2.04 0.00 0.00 0.45 0.00 0.00 32.46 31.04 1ao5 n ARG 192 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1ao5 n ASP 193 N 4.94 -2.48 0.04 6.15 8.00 -1.26 -0.66 116.55 131.28 1ao5 n ASP 193 Ca 0.26 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.88 1ao5 n ASP 193 Cb 0.12 -0.41 0.15 0.00 -0.02 0.00 0.00 41.12 40.96 1ao5 n ASP 193 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ao5 n ASP 194 N 0.83 0.63 -3.67 -2.24 8.00 -0.37 -4.03 116.55 115.71 1ao5 n ASP 194 Ca 0.00 -0.07 -0.37 0.00 0.71 0.00 0.00 54.79 55.06 1ao5 n ASP 194 Cb 0.00 0.36 -0.01 0.00 -0.02 0.00 0.00 41.12 41.45 1ao5 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ao5 n SER 195 N -1.91 -2.06 0.00 -2.24 7.64 -1.26 -1.40 113.62 112.39 1ao5 n SER 195 Ca 0.03 0.76 0.00 0.00 1.01 0.00 0.00 58.87 60.68 1ao5 n SER 195 Cb 0.41 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 1ao5 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ao5 n GLY 196 N 1.90 2.37 3.59 0.23 0.00 -0.61 0.39 105.19 113.06 1ao5 n GLY 196 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1ao5 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ao5 s GLY 197 N -1.34 1.62 0.44 -0.02 0.00 -0.50 -3.73 107.32 103.80 1ao5 s GLY 197 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 44.72 44.86 1ao5 s GLY 197 CO 0.00 0.83 0.85 2.56 0.00 0.00 0.00 173.10 177.35 1ao5 s PRO 198 N -4.56 3.89 -0.17 2.90 0.04 -1.26 -1.42 135.00 134.43 1ao5 s PRO 198 Ca 0.68 0.71 -0.01 0.00 0.04 0.00 0.00 61.00 62.41 1ao5 s PRO 198 Cb -0.24 -2.29 0.05 0.00 0.04 0.00 0.00 34.50 32.06 1ao5 s PRO 198 CO 0.61 -0.10 -0.03 -1.17 0.04 0.00 0.00 177.00 176.36 1ao5 s LEU 199 N -3.78 1.51 -0.18 -3.56 2.96 0.85 -3.70 118.68 112.78 1ao5 s LEU 199 Ca 0.55 -0.70 -0.01 0.00 -0.22 0.00 0.00 54.13 53.75 1ao5 s LEU 199 Cb -0.10 -0.82 -0.00 0.00 0.50 0.00 0.00 46.19 45.77 1ao5 s LEU 199 CO 0.29 -0.22 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.35 1ao5 s ILE 200 N 1.69 2.90 -0.11 6.68 1.01 -0.33 -1.08 121.20 131.97 1ao5 s ILE 200 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 59.99 1ao5 s ILE 200 Cb -0.16 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1ao5 s ILE 200 CO -0.07 0.48 -0.16 0.00 0.00 0.00 0.00 174.94 175.19 1ao5 n ASP 202 N 3.31 -3.07 0.00 0.00 9.92 -0.98 -0.15 116.55 125.58 1ao5 n ASP 202 Ca -0.18 -1.00 0.00 0.00 -0.53 0.00 0.00 54.79 53.07 1ao5 n ASP 202 Cb 0.53 -2.82 0.00 0.00 -0.64 0.00 0.00 41.12 38.19 1ao5 n ASP 202 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ao5 n GLY 207 N -1.47 0.50 3.16 0.44 0.00 -1.26 -5.04 105.19 101.52 1ao5 n GLY 207 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 1ao5 n GLY 207 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ao5 s ILE 208 N -2.03 1.27 -0.22 -0.61 2.07 0.79 -5.09 121.20 117.38 1ao5 s ILE 208 Ca 0.00 -0.86 -0.29 0.00 -1.41 0.00 0.00 60.65 58.09 1ao5 s ILE 208 Cb 0.00 -1.09 -0.03 0.00 0.13 0.00 0.00 42.46 41.47 1ao5 s ILE 208 CO 0.00 0.22 1.69 -0.22 -1.91 0.00 0.00 174.94 174.71 1ao5 s LEU 209 N -0.74 3.85 -0.10 8.50 2.96 -1.26 0.28 118.68 132.17 1ao5 s LEU 209 Ca 0.05 1.65 0.13 0.00 -0.22 0.00 0.00 54.13 55.74 1ao5 s LEU 209 Cb -0.07 -3.53 -0.18 0.00 0.50 0.00 0.00 46.19 42.91 1ao5 s LEU 209 CO 0.00 -1.34 0.12 0.00 -1.32 0.00 0.00 176.35 173.82 1ao5 n GLN 210 N 7.80 1.43 -3.71 1.98 1.13 -0.24 -3.72 117.38 122.05 1ao5 n GLN 210 Ca 0.20 -0.04 0.02 0.00 -1.94 0.00 0.00 57.00 55.24 1ao5 n GLN 210 Cb 0.45 -1.34 0.01 0.00 0.11 0.00 0.00 30.24 29.47 1ao5 n GLN 210 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ao5 n GLY 211 N 2.04 0.29 3.30 1.08 0.00 -1.10 -1.58 105.19 109.21 1ao5 n GLY 211 Ca -0.17 -1.02 -0.22 0.00 0.00 0.00 0.00 46.02 44.61 1ao5 n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ao5 s THR 212 N -2.04 1.70 0.26 2.61 -4.23 -1.22 -0.11 115.64 112.62 1ao5 s THR 212 Ca 0.26 -1.69 -0.30 0.00 -1.18 0.00 0.00 61.69 58.77 1ao5 s THR 212 Cb -0.01 -1.65 -0.11 0.00 1.34 0.00 0.00 72.50 72.07 1ao5 s THR 212 CO -0.00 -0.19 1.59 -0.89 -0.54 0.00 0.00 174.62 174.58 1ao5 s THR 213 N -1.58 2.22 0.00 3.99 2.01 -0.50 -0.90 115.64 120.88 1ao5 s THR 213 Ca 0.10 0.18 0.00 0.00 0.31 0.00 0.00 61.69 62.27 1ao5 s THR 213 Cb -0.08 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.32 1ao5 s THR 213 CO 0.05 0.02 0.00 -0.24 -0.69 0.00 0.00 174.62 173.76 1ao5 n SER 214 N 2.71 0.00 -3.96 3.53 2.88 -1.02 -1.58 113.62 116.18 1ao5 n SER 214 Ca 0.10 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.55 1ao5 n SER 214 Cb 0.38 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.76 1ao5 n SER 214 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1ao5 s TYR 215 N -0.52 0.38 0.10 0.66 1.13 -1.07 -4.86 117.35 113.17 1ao5 s TYR 215 Ca 0.00 -0.78 -0.03 0.00 -1.41 0.00 0.00 57.07 54.85 1ao5 s TYR 215 Cb 0.00 -0.12 0.01 0.00 -1.10 0.00 0.00 41.96 40.75 1ao5 s TYR 215 CO 0.00 -0.63 0.20 0.41 -2.51 0.00 0.00 175.55 173.02 1ao5 n GLY 216 N -0.14 1.93 3.77 5.49 0.00 -1.26 -0.80 105.19 114.18 1ao5 n GLY 216 Ca -0.10 -1.15 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1ao5 n GLY 216 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ao5 s PRO 217 N -2.06 2.65 -0.25 1.61 0.04 -1.26 -5.01 135.00 130.72 1ao5 s PRO 217 Ca 0.05 1.32 0.02 0.00 0.04 0.00 0.00 61.00 62.44 1ao5 s PRO 217 Cb -0.01 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.65 1ao5 s PRO 217 CO 0.04 -1.35 -0.10 0.08 0.04 0.00 0.00 177.00 175.71 1ao5 s VAL 218 N -2.51 2.02 0.86 -0.36 1.01 -1.26 -2.95 120.40 117.22 1ao5 s VAL 218 Ca 0.65 -1.53 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 1ao5 s VAL 218 Cb -0.19 -2.16 0.11 0.00 0.00 0.00 0.00 36.38 34.14 1ao5 s VAL 218 CO 0.46 -0.04 1.15 -2.16 0.00 0.00 0.00 175.10 174.50 1ao5 s PRO 219 N 1.17 1.52 0.41 2.72 0.04 -1.26 -5.04 135.00 134.56 1ao5 s PRO 219 Ca -0.08 0.27 -0.24 0.00 0.04 0.00 0.00 61.00 60.99 1ao5 s PRO 219 Cb -0.20 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1ao5 s PRO 219 CO -0.05 -1.93 1.09 0.00 0.04 0.00 0.00 177.00 176.15 1ao5 n GLY 221 N 0.41 0.47 3.64 0.00 0.00 -1.26 -4.76 105.19 103.68 1ao5 n GLY 221 Ca 0.05 -0.19 -0.48 0.00 0.00 0.00 0.00 46.02 45.41 1ao5 n GLY 221 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ao5 n LYS 222 N -2.53 1.75 -1.87 1.61 4.81 -1.20 -0.50 118.16 120.22 1ao5 n LYS 222 Ca -0.01 0.63 -0.42 0.00 -0.87 0.00 0.00 58.31 57.64 1ao5 n LYS 222 Cb 0.08 -2.31 -0.03 0.00 0.02 0.00 0.00 35.03 32.78 1ao5 n LYS 222 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1ao5 s PRO 223 N 0.39 4.19 0.00 1.64 0.02 -1.26 -2.60 135.00 137.38 1ao5 s PRO 223 Ca 0.77 2.43 0.00 0.00 0.02 0.00 0.00 61.00 64.22 1ao5 s PRO 223 Cb -0.77 -3.22 0.00 0.00 0.02 0.00 0.00 34.50 30.53 1ao5 s PRO 223 CO 0.44 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.85 1ao5 n GLY 223 N 3.87 1.90 3.10 0.52 0.00 -0.52 -4.94 105.19 109.12 1ao5 n GLY 223 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1ao5 n GLY 223 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ao5 s VAL 224 N -2.91 3.24 1.13 1.61 1.01 -1.07 -4.93 120.40 118.48 1ao5 s VAL 224 Ca 0.00 -2.32 -0.19 0.00 0.00 0.00 0.00 61.98 59.47 1ao5 s VAL 224 Cb 0.00 -3.21 0.29 0.00 0.00 0.00 0.00 36.38 33.46 1ao5 s VAL 224 CO 0.00 -0.72 0.82 -2.65 0.00 0.00 0.00 175.10 172.55 1ao5 n PRO 225 N 4.27 -3.62 -4.36 2.72 -0.02 -1.26 -4.59 135.00 128.14 1ao5 n PRO 225 Ca 0.01 -1.35 -0.24 0.00 -2.02 0.00 0.00 63.50 59.90 1ao5 n PRO 225 Cb 0.40 -1.48 -0.09 0.00 -0.02 0.00 0.00 33.50 32.31 1ao5 n PRO 225 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ao5 s ALA 226 N -2.56 2.94 -0.19 3.55 0.00 -0.09 -4.49 121.76 120.92 1ao5 s ALA 226 Ca 0.58 -1.69 -0.09 0.00 0.00 0.00 0.00 51.96 50.75 1ao5 s ALA 226 Cb -0.08 -0.56 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 1ao5 s ALA 226 CO 0.46 0.32 0.11 0.42 0.00 0.00 0.00 175.76 177.08 1ao5 s ILE 227 N -2.22 5.25 0.15 0.00 -1.09 0.02 -1.84 121.20 121.47 1ao5 s ILE 227 Ca 0.29 0.13 0.07 0.00 -2.23 0.00 0.00 60.65 58.91 1ao5 s ILE 227 Cb -0.07 -3.38 -0.04 0.00 -1.58 0.00 0.00 42.46 37.39 1ao5 s ILE 227 CO 0.17 0.45 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.87 1ao5 s TYR 228 N 0.31 1.55 0.20 3.97 1.51 -0.70 -2.44 117.35 121.76 1ao5 s TYR 228 Ca 0.07 -0.57 -0.30 0.00 -1.01 0.00 0.00 57.07 55.26 1ao5 s TYR 228 Cb -0.11 -0.77 -0.08 0.00 -0.11 0.00 0.00 41.96 40.88 1ao5 s TYR 228 CO -0.01 0.23 0.96 0.95 -1.11 0.00 0.00 175.55 176.56 1ao5 s THR 229 N -2.46 4.16 -0.88 -0.71 -4.23 -0.07 0.99 115.64 112.44 1ao5 s THR 229 Ca 0.15 2.05 -0.23 0.00 -1.18 0.00 0.00 61.69 62.47 1ao5 s THR 229 Cb -0.03 -4.31 0.06 0.00 1.34 0.00 0.00 72.50 69.57 1ao5 s THR 229 CO 0.04 0.44 1.27 0.21 -0.54 0.00 0.00 174.62 176.04 1ao5 s ASN 230 N -0.81 6.39 0.42 3.99 3.84 -0.77 -3.43 114.94 124.58 1ao5 s ASN 230 Ca 0.43 -1.25 0.10 0.00 0.21 0.00 0.00 52.86 52.35 1ao5 s ASN 230 Cb -0.26 -2.51 0.94 0.00 -0.55 0.00 0.00 41.25 38.87 1ao5 s ASN 230 CO 0.32 -1.49 2.01 -0.07 -2.79 0.00 0.00 177.10 175.08 1ao5 h LEU 231 N 12.17 0.43 -1.16 3.21 3.38 -1.62 -2.75 115.31 128.97 1ao5 h LEU 231 Ca -0.00 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1ao5 h LEU 231 Cb 1.03 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.62 1ao5 h LEU 231 CO 1.29 0.29 0.59 -0.29 0.09 0.00 0.00 178.44 180.41 1ao5 h ILE 232 N 0.50 1.00 0.00 1.22 6.09 -1.90 -0.26 117.51 124.15 1ao5 h ILE 232 Ca 0.23 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 63.39 1ao5 h ILE 232 Cb 0.26 -0.04 0.00 0.00 0.47 0.00 0.00 36.82 37.52 1ao5 h ILE 232 CO -0.06 0.17 0.00 0.11 -3.07 0.00 0.00 178.15 175.30 1ao5 h LYS 233 N 0.95 0.00 -0.01 2.19 1.79 -1.88 -2.91 116.57 116.71 1ao5 h LYS 233 Ca 0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 1ao5 h LYS 233 Cb 0.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1ao5 h LYS 233 CO -0.17 0.00 -0.12 1.19 -1.08 0.00 0.00 179.45 179.27 1ao5 n PHE 234 N -2.38 0.00 -0.30 -1.35 3.72 -0.12 -4.73 117.46 112.30 1ao5 n PHE 234 Ca 0.00 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 1ao5 n PHE 234 Cb 0.15 0.00 0.23 0.00 -0.94 0.00 0.00 39.48 38.92 1ao5 n PHE 234 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1ao5 h ASN 235 N 1.97 -0.38 0.67 4.37 2.35 -1.36 -1.69 115.58 121.53 1ao5 h ASN 235 Ca 0.00 0.23 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 1ao5 h ASN 235 Cb 0.48 0.40 0.01 0.00 0.05 0.00 0.00 38.32 39.26 1ao5 h ASN 235 CO 0.00 -0.25 -0.32 0.28 -1.65 0.00 0.00 177.43 175.49 1ao5 h SER 236 N 0.08 -0.77 -0.94 5.81 0.02 -1.85 -2.16 113.55 113.74 1ao5 h SER 236 Ca 0.51 0.01 0.13 0.00 -0.84 0.00 0.00 61.79 61.60 1ao5 h SER 236 Cb 0.97 0.20 -0.09 0.00 0.14 0.00 0.00 62.40 63.63 1ao5 h SER 236 CO -0.78 -0.52 0.56 -0.25 -1.14 0.00 0.00 176.83 174.70 1ao5 h TRP 237 N -0.94 1.01 0.50 3.45 7.01 -1.73 0.16 115.95 125.41 1ao5 h TRP 237 Ca -0.09 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.92 1ao5 h TRP 237 Cb 0.71 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.46 1ao5 h TRP 237 CO -0.02 0.36 -0.24 0.82 -2.79 0.00 0.00 178.44 176.56 1ao5 h ILE 238 N 0.86 0.00 -0.79 2.65 2.04 -1.22 -2.00 117.51 119.04 1ao5 h ILE 238 Ca 0.48 -0.05 0.18 0.00 1.00 0.00 0.00 64.86 66.48 1ao5 h ILE 238 Cb 0.54 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.50 1ao5 h ILE 238 CO -0.29 0.00 0.22 0.11 0.00 0.00 0.00 178.15 178.19 1ao5 h LYS 239 N -0.72 0.28 -0.49 2.37 1.57 -1.01 0.19 116.57 118.75 1ao5 h LYS 239 Ca -0.07 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1ao5 h LYS 239 Cb 0.52 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 1ao5 h LYS 239 CO 0.11 0.18 0.25 0.22 -0.57 0.00 0.00 179.45 179.65 1ao5 h ASP 240 N 0.28 0.36 -0.64 0.86 3.58 -0.69 -0.97 116.42 119.20 1ao5 h ASP 240 Ca 0.47 0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.86 1ao5 h ASP 240 Cb 0.84 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.82 1ao5 h ASP 240 CO -0.54 0.25 0.11 0.74 -2.88 0.00 0.00 179.24 176.92 1ao5 h THR 241 N 0.49 1.26 0.15 2.25 2.02 0.11 -0.19 112.91 119.00 1ao5 h THR 241 Ca 0.21 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 1ao5 h THR 241 Cb 0.12 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1ao5 h THR 241 CO -0.15 0.38 -0.07 0.24 0.37 0.00 0.00 175.52 176.29 1ao5 h MET 242 N 1.01 -0.20 -0.41 6.66 2.86 -0.67 -2.13 114.93 122.06 1ao5 h MET 242 Ca 0.20 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 1ao5 h MET 242 Cb 0.43 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 1ao5 h MET 242 CO 0.01 0.06 0.10 1.98 1.06 0.00 0.00 176.91 180.12 1ao5 h MET 243 N -0.44 0.65 0.00 1.72 1.85 -1.17 -2.99 114.93 114.54 1ao5 h MET 243 Ca -0.02 -0.16 0.00 0.00 -0.61 0.00 0.00 59.70 58.91 1ao5 h MET 243 Cb 0.35 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 32.29 1ao5 h MET 243 CO 0.03 0.67 0.00 0.87 -0.40 0.00 0.00 176.91 178.09 1ao5 h LYS 244 N 0.51 0.00 -2.95 0.39 1.57 -1.05 -3.37 116.57 111.67 1ao5 h LYS 244 Ca 0.13 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.21 1ao5 h LYS 244 Cb 0.31 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.26 1ao5 h LYS 244 CO 0.00 0.00 -0.08 0.09 -0.57 0.00 0.00 179.45 178.89 1ao5 n ASN 245 N -2.71 4.43 0.00 0.86 3.02 -0.80 -5.07 115.26 114.99 1ao5 n ASN 245 Ca 0.01 -3.27 0.00 0.00 -0.03 0.00 0.00 54.58 51.30 1ao5 n ASN 245 Cb 0.28 -0.98 0.00 0.00 -0.61 0.00 0.00 39.78 38.47 1ao5 n ASN 245 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64