#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xcq s ILE 2 N 0.00 5.08 0.46 1.69 1.01 -1.26 -3.98 121.20 124.21 1xcq s ILE 2 Ca 0.00 -1.58 0.03 0.00 0.00 0.00 0.00 60.65 59.09 1xcq s ILE 2 Cb 0.00 -4.52 -0.01 0.00 0.01 0.00 0.00 42.46 37.94 1xcq s ILE 2 CO 0.00 -1.13 0.09 -1.58 0.00 0.00 0.00 174.94 172.32 1xcq s GLN 3 N 1.83 2.08 -0.24 2.79 0.74 0.21 -4.95 119.66 122.11 1xcq s GLN 3 Ca 0.16 -2.31 -0.02 0.00 0.05 0.00 0.00 55.36 53.23 1xcq s GLN 3 Cb -0.18 -0.92 0.12 0.00 1.10 0.00 0.00 33.01 33.13 1xcq s GLN 3 CO -0.01 -0.49 0.31 -0.51 -0.55 0.00 0.00 175.29 174.04 1xcq s LEU 4 N -3.73 -0.39 -0.04 3.68 1.43 -1.26 -1.80 118.68 116.57 1xcq s LEU 4 Ca 0.14 -0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1xcq s LEU 4 Cb 0.01 0.74 -0.04 0.00 0.03 0.00 0.00 46.19 46.93 1xcq s LEU 4 CO 0.10 -0.33 0.10 -0.69 0.23 0.00 0.00 176.35 175.75 1xcq s VAL 5 N 2.43 4.91 0.20 -1.59 1.01 -1.26 -3.93 120.40 122.18 1xcq s VAL 5 Ca 0.10 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 61.92 1xcq s VAL 5 Cb -0.15 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1xcq s VAL 5 CO -0.19 0.43 -0.17 -1.58 0.00 0.00 0.00 175.10 173.58 1xcq s GLN 6 N -1.53 1.38 -0.25 2.72 0.74 -1.26 -3.43 119.66 118.03 1xcq s GLN 6 Ca 0.21 -1.55 -0.41 0.00 0.05 0.00 0.00 55.36 53.66 1xcq s GLN 6 Cb -0.12 -1.35 -0.17 0.00 1.10 0.00 0.00 33.01 32.47 1xcq s GLN 6 CO 0.11 0.25 1.64 -1.13 -0.55 0.00 0.00 175.29 175.62 1xcq n SER 7 N -0.13 2.02 -3.31 6.67 3.41 0.55 -4.94 113.62 117.88 1xcq n SER 7 Ca -0.10 1.10 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1xcq n SER 7 Cb 0.59 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 1xcq n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xcq n GLY 8 N 3.83 -2.78 3.31 5.00 0.00 -1.26 -4.33 105.19 108.95 1xcq n GLY 8 Ca 0.26 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 1xcq n GLY 8 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xcq n PRO 9 N 0.00 -1.03 -3.63 1.61 -0.02 -1.26 -4.69 135.00 125.98 1xcq n PRO 9 Ca 0.00 -0.28 -0.13 0.00 -2.02 0.00 0.00 63.50 61.07 1xcq n PRO 9 Cb 0.00 -1.70 -0.07 0.00 -0.02 0.00 0.00 33.50 31.71 1xcq n PRO 9 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1xcq s GLU 10 N -3.41 0.79 -0.26 -0.52 0.41 -1.16 -4.95 118.70 109.61 1xcq s GLU 10 Ca 0.55 0.96 -0.02 0.00 -0.41 0.00 0.00 54.97 56.05 1xcq s GLU 10 Cb -0.14 0.38 0.14 0.00 -1.78 0.00 0.00 34.13 32.73 1xcq s GLU 10 CO 0.67 -0.10 0.41 -1.17 -0.49 0.00 0.00 175.26 174.59 1xcq s LEU 11 N 0.41 -0.77 0.00 1.80 1.98 -1.21 0.13 118.68 121.02 1xcq s LEU 11 Ca -0.00 0.27 0.02 0.00 -2.89 0.00 0.00 54.13 51.53 1xcq s LEU 11 Cb -0.05 1.28 -0.01 0.00 0.66 0.00 0.00 46.19 48.07 1xcq s LEU 11 CO -0.01 -0.30 0.08 0.29 -1.89 0.00 0.00 176.35 174.52 1xcq n LYS 12 N 5.37 0.66 -4.77 1.98 4.76 -1.05 -4.97 118.16 120.14 1xcq n LYS 12 Ca -0.03 -3.64 -0.33 0.00 -2.87 0.00 0.00 58.31 51.44 1xcq n LYS 12 Cb 0.50 1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 35.06 1xcq n LYS 12 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1xcq s LYS 13 N -3.72 2.77 -0.85 1.97 1.02 -1.24 -0.21 119.74 119.48 1xcq s LYS 13 Ca 0.11 -0.64 -0.14 0.00 0.02 0.00 0.00 55.97 55.32 1xcq s LYS 13 Cb 0.01 -2.51 -0.25 0.00 -0.52 0.00 0.00 37.83 34.55 1xcq s LYS 13 CO 0.08 0.56 2.00 -0.35 -0.92 0.00 0.00 175.35 176.71 1xcq n PRO 14 N 2.52 0.00 0.00 -1.68 -0.04 -1.26 -1.70 135.00 132.85 1xcq n PRO 14 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1xcq n PRO 14 Cb 0.52 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.98 1xcq n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xcq n GLY 15 N 4.99 3.07 0.00 0.55 0.00 0.94 -4.79 105.19 109.95 1xcq n GLY 15 Ca 0.57 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1xcq n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xcq n GLU 16 N 0.00 1.30 -3.74 1.61 1.02 -0.69 0.53 120.64 120.67 1xcq n GLU 16 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1xcq n GLU 16 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.26 1xcq n GLU 16 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1xcq s THR 17 N -0.06 -0.08 0.13 2.62 -4.23 -1.26 -1.34 115.64 111.42 1xcq s THR 17 Ca 0.00 0.28 0.02 0.00 -1.18 0.00 0.00 61.69 60.81 1xcq s THR 17 Cb 0.00 -0.12 -0.04 0.00 1.34 0.00 0.00 72.50 73.68 1xcq s THR 17 CO 0.00 0.12 0.26 0.54 -0.54 0.00 0.00 174.62 175.00 1xcq s VAL 18 N 1.45 5.33 -0.07 2.29 0.11 -1.17 -4.95 120.40 123.38 1xcq s VAL 18 Ca -0.05 -0.62 -0.03 0.00 -2.93 0.00 0.00 61.98 58.35 1xcq s VAL 18 Cb -0.13 -3.71 0.04 0.00 -1.53 0.00 0.00 36.38 31.06 1xcq s VAL 18 CO -0.03 -0.04 0.14 -0.75 -3.33 0.00 0.00 175.10 171.08 1xcq s LYS 19 N -3.06 0.01 0.23 1.54 2.20 -1.26 -2.46 119.74 116.94 1xcq s LYS 19 Ca 0.35 0.50 -0.02 0.00 -0.36 0.00 0.00 55.97 56.43 1xcq s LYS 19 Cb -0.11 -0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 35.85 1xcq s LYS 19 CO 0.28 -0.29 0.45 0.96 -0.36 0.00 0.00 175.35 176.39 1xcq s ILE 20 N 2.13 5.14 -0.06 5.43 -4.36 -0.95 -4.97 121.20 123.56 1xcq s ILE 20 Ca 0.02 -0.21 0.03 0.00 -0.26 0.00 0.00 60.65 60.23 1xcq s ILE 20 Cb -0.12 -3.73 0.01 0.00 1.25 0.00 0.00 42.46 39.87 1xcq s ILE 20 CO -0.05 -0.22 -0.14 -0.94 0.24 0.00 0.00 174.94 173.83 1xcq s SER 21 N -3.14 1.91 -0.29 4.36 1.04 -1.26 -2.82 113.70 113.50 1xcq s SER 21 Ca 0.40 -0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.55 1xcq s SER 21 Cb -0.11 -0.74 0.17 0.00 0.10 0.00 0.00 66.02 65.44 1xcq s SER 21 CO 0.29 0.08 0.47 0.00 0.98 0.00 0.00 173.24 175.07 1xcq s LYS 23 N 2.65 3.49 0.47 0.00 2.20 -1.22 0.33 119.74 127.66 1xcq s LYS 23 Ca 0.10 -0.17 -0.08 0.00 -0.36 0.00 0.00 55.97 55.46 1xcq s LYS 23 Cb -0.12 -3.18 -0.05 0.00 -1.51 0.00 0.00 37.83 32.98 1xcq s LYS 23 CO -0.28 0.71 0.82 0.00 -0.36 0.00 0.00 175.35 176.23 1xcq s ALA 24 N -0.83 3.33 -0.17 3.13 0.00 0.20 -4.01 121.76 123.41 1xcq s ALA 24 Ca 0.14 -0.31 -0.26 0.00 0.00 0.00 0.00 51.96 51.52 1xcq s ALA 24 Cb -0.12 -2.72 0.07 0.00 0.00 0.00 0.00 23.12 20.35 1xcq s ALA 24 CO 0.03 -0.27 0.68 0.45 0.00 0.00 0.00 175.76 176.65 1xcq s SER 25 N -3.73 -0.68 0.00 0.00 0.15 -0.75 -4.91 113.70 103.78 1xcq s SER 25 Ca 0.50 1.10 0.00 0.00 0.70 0.00 0.00 55.95 58.25 1xcq s SER 25 Cb -0.10 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.26 1xcq s SER 25 CO 0.41 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 175.07 1xcq n GLY 26 N 1.99 0.63 3.51 9.45 0.00 -1.26 -0.62 105.19 118.89 1xcq n GLY 26 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 1xcq n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xcq s TYR 27 N -2.40 1.01 0.26 1.61 1.13 -1.26 -4.53 117.35 113.17 1xcq s TYR 27 Ca 0.00 -1.27 -0.04 0.00 -1.41 0.00 0.00 57.07 54.35 1xcq s TYR 27 Cb 0.00 -0.03 0.06 0.00 -1.10 0.00 0.00 41.96 40.89 1xcq s TYR 27 CO 0.00 -1.17 0.32 0.25 -2.51 0.00 0.00 175.55 172.44 1xcq n THR 28 N -0.57 0.00 -2.67 -3.49 -2.24 -1.26 -5.06 114.28 99.00 1xcq n THR 28 Ca 0.00 -0.21 -0.03 0.00 -2.27 0.00 0.00 64.05 61.54 1xcq n THR 28 Cb 0.61 -1.67 0.12 0.00 -2.10 0.00 0.00 70.33 67.30 1xcq n THR 28 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1xcq n PHE 29 N -2.62 -2.03 -0.40 4.78 7.35 -1.26 -4.88 117.46 118.40 1xcq n PHE 29 Ca 0.04 -1.66 0.00 0.00 -0.76 0.00 0.00 57.45 55.07 1xcq n PHE 29 Cb 0.14 1.53 0.00 0.00 0.35 0.00 0.00 39.48 41.50 1xcq n PHE 29 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 1xcq n THR 30 N -1.32 0.00 -3.18 -2.13 5.66 -1.26 -4.71 114.28 107.33 1xcq n THR 30 Ca -0.15 -0.26 -0.19 0.00 -3.05 0.00 0.00 64.05 60.41 1xcq n THR 30 Cb 0.86 1.40 -0.03 0.00 -1.55 0.00 0.00 70.33 71.00 1xcq n THR 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1xcq n ASP 31 N -0.09 0.88 -3.56 1.09 9.92 -1.26 -4.72 116.55 118.81 1xcq n ASP 31 Ca 0.00 -3.00 -0.09 0.00 -0.53 0.00 0.00 54.79 51.17 1xcq n ASP 31 Cb 0.10 -0.62 -0.04 0.00 -0.64 0.00 0.00 41.12 39.92 1xcq n ASP 31 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1xcq s PHE 32 N -2.34 -0.31 -0.14 1.24 0.08 -1.26 -5.07 117.98 110.19 1xcq s PHE 32 Ca 0.40 0.40 -0.06 0.00 0.12 0.00 0.00 56.93 57.79 1xcq s PHE 32 Cb 0.33 0.49 -0.04 0.00 -0.57 0.00 0.00 43.02 43.23 1xcq s PHE 32 CO -0.08 -0.37 0.07 -1.12 -0.10 0.00 0.00 175.22 173.62 1xcq s SER 33 N -1.66 5.75 -0.16 1.36 0.01 -1.24 -4.02 113.70 113.73 1xcq s SER 33 Ca 0.02 0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.48 1xcq s SER 33 Cb -0.01 -1.85 -0.02 0.00 0.21 0.00 0.00 66.02 64.36 1xcq s SER 33 CO -0.03 0.31 -0.08 -0.32 0.41 0.00 0.00 173.24 173.52 1xcq s MET 34 N -0.42 3.46 0.38 12.44 1.75 -1.25 -0.22 119.30 135.44 1xcq s MET 34 Ca 0.10 -0.63 0.08 0.00 -1.25 0.00 0.00 55.69 53.99 1xcq s MET 34 Cb -0.12 -2.80 -0.06 0.00 2.84 0.00 0.00 34.83 34.69 1xcq s MET 34 CO 0.02 0.12 0.05 -1.01 -0.65 0.00 0.00 175.02 173.55 1xcq s HIS 35 N 0.63 2.55 -0.04 4.11 3.76 -0.25 -2.06 115.29 123.99 1xcq s HIS 35 Ca -0.05 -0.54 0.01 0.00 -0.15 0.00 0.00 55.06 54.34 1xcq s HIS 35 Cb -0.15 -1.68 0.02 0.00 1.11 0.00 0.00 32.58 31.88 1xcq s HIS 35 CO 0.03 0.40 -0.05 -1.58 -0.85 0.00 0.00 174.74 172.68 1xcq s TRP 36 N -2.59 0.79 -0.07 1.40 0.52 -1.23 -2.60 118.94 115.15 1xcq s TRP 36 Ca 0.36 -0.22 -0.03 0.00 0.02 0.00 0.00 56.10 56.23 1xcq s TRP 36 Cb 0.04 -0.67 0.04 0.00 -1.15 0.00 0.00 33.47 31.72 1xcq s TRP 36 CO 0.20 -0.18 0.16 0.08 0.02 0.00 0.00 176.95 177.23 1xcq s VAL 37 N 0.82 -0.04 0.45 4.03 1.01 -1.13 -0.04 120.40 125.50 1xcq s VAL 37 Ca -0.12 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.11 1xcq s VAL 37 Cb -0.14 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 35.98 1xcq s VAL 37 CO 0.01 0.07 0.51 0.54 0.00 0.00 0.00 175.10 176.22 1xcq s ASN 38 N 1.12 5.24 -0.30 3.32 4.22 -0.78 -0.82 114.94 126.95 1xcq s ASN 38 Ca -0.09 -0.69 0.01 0.00 -2.14 0.00 0.00 52.86 49.96 1xcq s ASN 38 Cb -0.11 -0.39 0.19 0.00 1.28 0.00 0.00 41.25 42.23 1xcq s ASN 38 CO -0.06 -0.83 0.60 -1.58 -2.04 0.00 0.00 177.10 173.18 1xcq s GLN 39 N -4.30 0.57 0.56 3.55 0.74 -1.26 -2.46 119.66 117.05 1xcq s GLN 39 Ca 0.51 0.85 -0.19 0.00 0.05 0.00 0.00 55.36 56.58 1xcq s GLN 39 Cb -0.06 0.45 -0.05 0.00 1.10 0.00 0.00 33.01 34.45 1xcq s GLN 39 CO 0.31 -0.77 1.15 0.00 -0.55 0.00 0.00 175.29 175.42 1xcq s ALA 40 N 2.85 2.65 -0.24 1.58 0.00 -1.26 -3.02 121.76 124.32 1xcq s ALA 40 Ca 0.17 0.85 -0.37 0.00 0.00 0.00 0.00 51.96 52.61 1xcq s ALA 40 Cb -0.13 -3.38 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 1xcq s ALA 40 CO -0.23 -0.89 1.89 -2.30 0.00 0.00 0.00 175.76 174.23 1xcq n PRO 41 N -1.43 1.43 0.00 0.00 -0.02 -1.26 -0.34 135.00 133.37 1xcq n PRO 41 Ca 0.12 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1xcq n PRO 41 Cb 0.51 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1xcq n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xcq n GLY 42 N 4.79 2.76 0.00 -1.23 0.00 -1.26 -4.98 105.19 105.27 1xcq n GLY 42 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1xcq n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xcq n LYS 43 N -2.00 1.36 -2.35 1.61 4.76 0.53 -5.13 118.16 116.94 1xcq n LYS 43 Ca 0.00 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.36 1xcq n LYS 43 Cb 0.00 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1xcq n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xcq n GLY 44 N 5.00 3.23 3.77 0.72 0.00 -1.26 -4.77 105.19 111.87 1xcq n GLY 44 Ca 0.00 -2.22 -0.39 0.00 0.00 0.00 0.00 46.02 43.41 1xcq n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xcq s LEU 45 N 0.00 4.47 -0.32 0.99 1.43 -1.26 -4.06 118.68 119.93 1xcq s LEU 45 Ca 0.07 1.33 -0.00 0.00 -1.03 0.00 0.00 54.13 54.49 1xcq s LEU 45 Cb -0.01 -3.05 0.13 0.00 0.03 0.00 0.00 46.19 43.30 1xcq s LEU 45 CO 0.04 0.13 0.26 0.20 0.23 0.00 0.00 176.35 177.22 1xcq s ASN 46 N -0.49 2.22 0.10 2.29 0.01 -1.03 -4.99 114.94 113.06 1xcq s ASN 46 Ca 0.33 -1.35 -0.35 0.00 -0.71 0.00 0.00 52.86 50.77 1xcq s ASN 46 Cb -0.20 0.15 -0.15 0.00 0.41 0.00 0.00 41.25 41.47 1xcq s ASN 46 CO 0.20 -0.35 1.51 1.87 -1.51 0.00 0.00 177.10 178.82 1xcq n TRP 47 N 4.79 1.97 -0.08 2.20 -0.00 -1.26 -1.86 117.44 123.21 1xcq n TRP 47 Ca 0.03 0.41 -0.11 0.00 -0.00 0.00 0.00 57.50 57.83 1xcq n TRP 47 Cb 0.43 -2.46 -0.15 0.00 -0.00 0.00 0.00 31.31 29.13 1xcq n TRP 47 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 1xcq n MET 48 N 3.37 0.67 0.00 5.87 2.81 0.95 -4.87 117.12 125.91 1xcq n MET 48 Ca 0.18 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 56.17 1xcq n MET 48 Cb 0.24 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 1xcq n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xcq n GLY 49 N 1.74 -0.30 3.81 3.03 0.00 -1.13 -3.82 105.19 108.52 1xcq n GLY 49 Ca -0.29 -0.53 -0.00 0.00 0.00 0.00 0.00 46.02 45.19 1xcq n GLY 49 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1xcq n TRP 50 N 0.00 -0.92 -3.99 1.61 4.27 -1.25 -3.53 117.44 113.63 1xcq n TRP 50 Ca 0.00 -1.01 -0.11 0.00 -3.89 0.00 0.00 57.50 52.50 1xcq n TRP 50 Cb 0.00 0.48 -0.12 0.00 -1.36 0.00 0.00 31.31 30.31 1xcq n TRP 50 CO 0.00 0.00 0.00 0.14 -2.29 0.00 0.00 177.69 175.54 1xcq s VAL 51 N -2.05 0.20 -1.11 -1.67 -7.23 -0.87 -3.05 120.40 104.61 1xcq s VAL 51 Ca 0.25 -0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 59.53 1xcq s VAL 51 Cb -0.02 -0.30 0.17 0.00 0.56 0.00 0.00 36.38 36.79 1xcq s VAL 51 CO 0.03 -0.35 1.31 0.21 -0.31 0.00 0.00 175.10 175.99 1xcq s ASN 52 N -1.16 6.96 0.00 4.85 3.04 -1.11 -3.88 114.94 123.64 1xcq s ASN 52 Ca -0.11 -2.77 0.00 0.00 0.04 0.00 0.00 52.86 50.03 1xcq s ASN 52 Cb -0.08 -2.38 0.00 0.00 -1.54 0.00 0.00 41.25 37.25 1xcq s ASN 52 CO -0.00 -0.80 0.03 0.35 -3.04 0.00 0.00 177.10 173.63 1xcq n THR 53 N 4.72 0.00 0.23 -5.21 -2.24 -1.26 -1.53 114.28 108.99 1xcq n THR 53 Ca 0.32 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.22 1xcq n THR 53 Cb 0.44 -0.54 0.44 0.00 -2.10 0.00 0.00 70.33 68.58 1xcq n THR 53 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xcq h GLU 54 N 0.00 0.00 0.00 -0.78 4.39 -1.88 -3.46 114.58 112.86 1xcq h GLU 54 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xcq h GLU 54 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1xcq h GLU 54 CO 0.00 0.13 0.00 -2.37 -1.16 0.00 0.00 179.01 175.61 1xcq n THR 55 N -3.22 0.00 0.00 1.13 5.66 -0.58 -5.06 114.28 112.20 1xcq n THR 55 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1xcq n THR 55 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 1xcq n THR 55 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xcq n GLY 56 N 0.79 0.80 0.00 1.09 0.00 -1.24 -4.98 105.19 101.65 1xcq n GLY 56 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1xcq n GLY 56 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xcq n GLU 57 N 0.00 0.00 -3.72 1.61 2.13 -1.26 -4.44 120.64 114.96 1xcq n GLU 57 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1xcq n GLU 57 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 1xcq n GLU 57 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1xcq s PRO 58 N 0.00 3.37 -0.16 5.31 0.04 -1.26 -2.76 135.00 139.54 1xcq s PRO 58 Ca 0.00 -0.71 -0.04 0.00 0.04 0.00 0.00 61.00 60.29 1xcq s PRO 58 Cb 0.00 -2.82 0.06 0.00 0.04 0.00 0.00 34.50 31.78 1xcq s PRO 58 CO 0.00 0.27 0.06 0.99 0.04 0.00 0.00 177.00 178.37 1xcq s THR 59 N -2.11 0.16 0.28 1.26 2.01 -1.17 -5.02 115.64 111.05 1xcq s THR 59 Ca 0.38 -0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1xcq s THR 59 Cb -0.09 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1xcq s THR 59 CO 0.31 -0.18 0.45 -0.31 -0.69 0.00 0.00 174.62 174.20 1xcq s TYR 60 N 2.03 3.48 0.49 4.92 2.02 -1.26 -3.92 117.35 125.10 1xcq s TYR 60 Ca 0.01 0.21 -0.17 0.00 -0.37 0.00 0.00 57.07 56.75 1xcq s TYR 60 Cb -0.16 -1.77 -0.09 0.00 -0.40 0.00 0.00 41.96 39.55 1xcq s TYR 60 CO -0.08 0.28 0.97 0.00 -1.57 0.00 0.00 175.55 175.15 1xcq s ALA 61 N -2.12 3.07 -1.55 3.71 0.00 -1.25 -4.75 121.76 118.88 1xcq s ALA 61 Ca 0.38 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1xcq s ALA 61 Cb -0.10 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1xcq s ALA 61 CO 0.32 -0.13 0.00 -0.25 0.00 0.00 0.00 175.76 175.71 1xcq n ASP 62 N -1.31 0.00 0.00 0.00 9.92 -1.26 0.14 116.55 124.03 1xcq n ASP 62 Ca 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 1xcq n ASP 62 Cb 0.54 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.02 1xcq n ASP 62 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1xcq n ASP 63 N -0.13 0.27 -0.60 -2.24 9.92 -1.26 -4.85 116.55 117.66 1xcq n ASP 63 Ca 0.00 -0.31 -0.00 0.00 -0.53 0.00 0.00 54.79 53.95 1xcq n ASP 63 Cb 0.00 0.67 -0.00 0.00 -0.64 0.00 0.00 41.12 41.14 1xcq n ASP 63 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1xcq n PHE 64 N -0.69 0.00 0.96 1.24 3.01 0.19 -4.93 117.46 117.23 1xcq n PHE 64 Ca 0.00 -0.06 -0.00 0.00 1.01 0.00 0.00 57.45 58.39 1xcq n PHE 64 Cb 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.55 1xcq n PHE 64 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1xcq n LYS 65 N 0.04 1.03 0.00 -1.08 4.81 0.36 -4.18 118.16 119.14 1xcq n LYS 65 Ca -0.01 -0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 1xcq n LYS 65 Cb 0.66 -1.05 0.00 0.00 0.02 0.00 0.00 35.03 34.66 1xcq n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xcq n GLY 66 N 0.44 1.52 2.24 3.14 0.00 -1.26 -4.96 105.19 106.31 1xcq n GLY 66 Ca 0.01 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1xcq n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xcq n ARG 67 N 0.00 2.59 -3.89 1.61 1.85 -1.26 -4.84 116.66 112.72 1xcq n ARG 67 Ca 0.00 -1.80 -0.27 0.00 -1.00 0.00 0.00 57.85 54.78 1xcq n ARG 67 Cb 0.00 -2.21 -0.17 0.00 -1.05 0.00 0.00 32.46 29.03 1xcq n ARG 67 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1xcq s PHE 68 N 0.11 1.49 0.11 2.89 0.08 -1.26 -4.15 117.98 117.25 1xcq s PHE 68 Ca 0.64 -0.82 0.07 0.00 0.12 0.00 0.00 56.93 56.94 1xcq s PHE 68 Cb 0.31 -1.23 -0.04 0.00 -0.57 0.00 0.00 43.02 41.49 1xcq s PHE 68 CO -0.09 -0.54 -0.10 0.00 -0.10 0.00 0.00 175.22 174.39 1xcq s ALA 69 N 1.70 2.95 -0.01 5.36 0.00 -0.17 -4.91 121.76 126.68 1xcq s ALA 69 Ca 0.03 -1.26 0.03 0.00 0.00 0.00 0.00 51.96 50.77 1xcq s ALA 69 Cb -0.13 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 1xcq s ALA 69 CO -0.08 0.63 -0.10 -0.06 0.00 0.00 0.00 175.76 176.15 1xcq s PHE 70 N -1.24 0.95 0.32 0.00 2.99 -1.26 0.15 117.98 119.89 1xcq s PHE 70 Ca 0.21 -0.19 -0.07 0.00 0.00 0.00 0.00 56.93 56.88 1xcq s PHE 70 Cb -0.11 -0.62 0.03 0.00 0.00 0.00 0.00 43.02 42.32 1xcq s PHE 70 CO 0.14 -0.03 0.54 0.43 -0.00 0.00 0.00 175.22 176.30 1xcq n SER 71 N 2.89 -1.56 -3.36 1.36 7.64 -0.83 -4.96 113.62 114.80 1xcq n SER 71 Ca -0.14 -2.47 -0.16 0.00 1.01 0.00 0.00 58.87 57.10 1xcq n SER 71 Cb 0.56 2.71 -0.07 0.00 -1.01 0.00 0.00 64.21 66.40 1xcq n SER 71 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1xcq s LEU 72 N 0.00 -0.10 -0.40 -3.43 2.96 -1.26 -1.01 118.68 115.43 1xcq s LEU 72 Ca 0.19 -1.54 -0.05 0.00 -0.22 0.00 0.00 54.13 52.50 1xcq s LEU 72 Cb -0.03 0.60 -0.05 0.00 0.50 0.00 0.00 46.19 47.21 1xcq s LEU 72 CO 0.14 -0.26 1.52 1.21 -1.32 0.00 0.00 176.35 177.64 1xcq n GLU 73 N 4.27 0.90 0.00 1.98 2.13 0.13 -4.79 120.64 125.26 1xcq n GLU 73 Ca 0.11 -0.98 0.00 0.00 0.66 0.00 0.00 57.16 56.95 1xcq n GLU 73 Cb 0.45 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.91 1xcq n GLU 73 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1xcq n THR 74 N 4.85 0.00 0.00 6.31 -2.24 -1.26 -2.13 114.28 119.81 1xcq n THR 74 Ca 0.23 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 62.11 1xcq n THR 74 Cb 0.10 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1xcq n THR 74 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xcq n SER 75 N -0.25 0.00 0.09 3.42 7.64 -1.26 0.16 113.62 123.41 1xcq n SER 75 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.84 1xcq n SER 75 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1xcq n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xcq h ALA 76 N 0.00 -0.65 0.00 -0.43 0.00 -1.85 -3.48 119.26 112.85 1xcq h ALA 76 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xcq h ALA 76 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xcq h ALA 76 CO 0.00 -0.63 0.00 0.45 0.00 0.00 0.00 179.25 179.07 1xcq n SER 77 N -2.98 0.00 -4.90 0.00 2.88 0.42 -5.00 113.62 104.03 1xcq n SER 77 Ca -0.03 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.30 1xcq n SER 77 Cb 0.09 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.53 1xcq n SER 77 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1xcq s THR 78 N -0.37 4.06 -0.02 2.46 2.01 -1.16 0.59 115.64 123.22 1xcq s THR 78 Ca 0.00 -1.22 0.03 0.00 0.31 0.00 0.00 61.69 60.81 1xcq s THR 78 Cb 0.00 -3.37 -0.00 0.00 0.01 0.00 0.00 72.50 69.14 1xcq s THR 78 CO 0.00 -0.22 -0.10 0.00 -0.69 0.00 0.00 174.62 173.61 1xcq s ALA 79 N -2.20 0.87 0.33 7.40 0.00 0.99 0.22 121.76 129.38 1xcq s ALA 79 Ca 0.40 -0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.00 1xcq s ALA 79 Cb -0.08 -0.27 -0.07 0.00 0.00 0.00 0.00 23.12 22.71 1xcq s ALA 79 CO 0.28 0.18 0.04 0.71 0.00 0.00 0.00 175.76 176.97 1xcq s TYR 80 N -0.06 2.06 -0.30 0.00 2.02 -0.18 -2.39 117.35 118.50 1xcq s TYR 80 Ca 0.01 -0.89 -0.11 0.00 -0.37 0.00 0.00 57.07 55.71 1xcq s TYR 80 Cb -0.06 -1.35 0.13 0.00 -0.40 0.00 0.00 41.96 40.28 1xcq s TYR 80 CO -0.00 0.11 0.70 -1.17 -1.57 0.00 0.00 175.55 173.62 1xcq s LEU 81 N -3.52 -1.06 0.02 -1.29 0.20 -1.13 -1.98 118.68 109.94 1xcq s LEU 81 Ca 0.36 1.46 0.02 0.00 0.69 0.00 0.00 54.13 56.66 1xcq s LEU 81 Cb 0.09 2.22 -0.04 0.00 -0.43 0.00 0.00 46.19 48.03 1xcq s LEU 81 CO 0.16 -0.21 0.01 -1.58 -0.29 0.00 0.00 176.35 174.44 1xcq s GLN 82 N 2.76 2.77 -0.27 1.98 0.74 0.41 -2.24 119.66 125.81 1xcq s GLN 82 Ca -0.06 -0.65 -0.04 0.00 0.05 0.00 0.00 55.36 54.66 1xcq s GLN 82 Cb -0.11 -2.66 0.09 0.00 1.10 0.00 0.00 33.01 31.43 1xcq s GLN 82 CO -0.19 0.61 0.12 0.42 -0.55 0.00 0.00 175.29 175.70 1xcq s ILE 83 N -1.16 -0.02 0.00 -2.34 1.01 -1.03 -1.00 121.20 116.67 1xcq s ILE 83 Ca 0.22 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.19 1xcq s ILE 83 Cb -0.12 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.41 1xcq s ILE 83 CO 0.13 -0.64 0.00 0.59 0.00 0.00 0.00 174.94 175.02 1xcq n ASN 84 N 5.23 0.00 -1.65 3.58 3.02 -1.26 -3.04 115.26 121.14 1xcq n ASN 84 Ca -0.06 -0.36 -0.09 0.00 -0.03 0.00 0.00 54.58 54.04 1xcq n ASN 84 Cb 0.43 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.61 1xcq n ASN 84 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1xcq n SER 85 N -1.08 -1.26 -4.80 6.41 3.41 -1.00 -4.77 113.62 110.52 1xcq n SER 85 Ca 0.00 -0.05 -0.34 0.00 -0.26 0.00 0.00 58.87 58.22 1xcq n SER 85 Cb 0.00 -0.37 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 1xcq n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1xcq s LEU 86 N -0.68 3.97 0.07 1.04 1.43 0.19 -4.66 118.68 120.03 1xcq s LEU 86 Ca 0.09 1.82 -0.08 0.00 -1.03 0.00 0.00 54.13 54.93 1xcq s LEU 86 Cb -0.01 -4.46 -0.01 0.00 0.03 0.00 0.00 46.19 41.74 1xcq s LEU 86 CO 0.21 -0.49 0.16 -0.54 0.23 0.00 0.00 176.35 175.92 1xcq s LYS 87 N -3.02 0.78 0.55 1.70 1.02 -1.26 0.32 119.74 119.82 1xcq s LYS 87 Ca 0.62 -0.93 0.33 0.00 0.02 0.00 0.00 55.97 56.01 1xcq s LYS 87 Cb -0.14 0.31 1.42 0.00 -0.52 0.00 0.00 37.83 38.91 1xcq s LYS 87 CO 0.18 -0.23 2.01 -0.91 -0.92 0.00 0.00 175.35 175.47 1xcq h ASN 88 N 2.94 0.00 -0.09 2.83 4.21 -1.98 -0.72 115.58 122.77 1xcq h ASN 88 Ca -0.34 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.17 1xcq h ASN 88 Cb 1.19 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.39 1xcq h ASN 88 CO 0.56 0.04 0.00 1.21 -1.29 0.00 0.00 177.43 177.95 1xcq n GLU 89 N -3.16 1.58 -0.00 0.81 0.00 -1.26 -2.12 120.64 116.48 1xcq n GLU 89 Ca 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 57.16 56.70 1xcq n GLU 89 Cb 0.30 -1.60 0.02 0.00 0.00 0.00 0.00 31.44 30.16 1xcq n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1xcq n ASP 90 N 0.10 1.44 -2.49 4.31 8.00 -0.27 -4.88 116.55 122.76 1xcq n ASP 90 Ca 0.04 -1.24 0.00 0.00 0.71 0.00 0.00 54.79 54.31 1xcq n ASP 90 Cb 0.41 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1xcq n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1xcq n THR 91 N 0.24 0.00 -2.84 -3.53 -1.04 -0.90 -4.71 114.28 101.50 1xcq n THR 91 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1xcq n THR 91 Cb 0.13 -1.35 0.00 0.00 -1.82 0.00 0.00 70.33 67.29 1xcq n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xcq n ALA 92 N 2.80 0.00 -0.09 2.41 0.00 -1.26 -4.45 120.51 119.92 1xcq n ALA 92 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1xcq n ALA 92 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1xcq n ALA 92 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1xcq n THR 93 N -0.26 1.48 -1.38 0.00 -1.04 -1.17 -2.41 114.28 109.51 1xcq n THR 93 Ca 0.00 0.09 -0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1xcq n THR 93 Cb 0.00 -2.29 -0.00 0.00 -1.82 0.00 0.00 70.33 66.22 1xcq n THR 93 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1xcq n TYR 94 N -4.47 -0.08 -4.05 -1.42 4.01 -1.26 -3.23 117.16 106.65 1xcq n TYR 94 Ca -0.18 0.05 -0.25 0.00 -0.16 0.00 0.00 57.90 57.36 1xcq n TYR 94 Cb 0.51 -1.68 -0.06 0.00 -0.31 0.00 0.00 39.34 37.80 1xcq n TYR 94 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1xcq s PHE 95 N -0.01 2.43 -0.04 -0.72 2.99 -0.00 -3.57 117.98 119.06 1xcq s PHE 95 Ca -0.00 -0.64 -0.01 0.00 0.00 0.00 0.00 56.93 56.28 1xcq s PHE 95 Cb 0.00 -1.96 0.03 0.00 0.00 0.00 0.00 43.02 41.09 1xcq s PHE 95 CO 0.01 0.05 0.07 0.00 -0.00 0.00 0.00 175.22 175.35 1xcq s ALA 97 N 1.16 0.24 0.14 0.00 0.00 -1.07 0.17 121.76 122.41 1xcq s ALA 97 Ca -0.08 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 1xcq s ALA 97 Cb -0.12 0.19 -0.07 0.00 0.00 0.00 0.00 23.12 23.12 1xcq s ALA 97 CO -0.04 -0.24 1.18 0.50 0.00 0.00 0.00 175.76 177.16 1xcq s ARG 98 N -2.35 4.49 -0.29 0.00 3.52 0.04 -1.09 118.95 123.27 1xcq s ARG 98 Ca -0.08 1.81 -0.07 0.00 -0.13 0.00 0.00 55.73 57.26 1xcq s ARG 98 Cb -0.03 -3.28 -0.00 0.00 -1.56 0.00 0.00 34.95 30.07 1xcq s ARG 98 CO -0.04 -0.11 0.09 0.12 -0.81 0.00 0.00 175.30 174.54 1xcq s PHE 99 N 0.27 3.14 0.70 5.12 2.19 0.70 -3.21 117.98 126.88 1xcq s PHE 99 Ca 0.54 -0.80 -0.11 0.00 0.33 0.00 0.00 56.93 56.89 1xcq s PHE 99 Cb -0.31 -2.27 0.01 0.00 -1.31 0.00 0.00 43.02 39.14 1xcq s PHE 99 CO 0.34 -0.51 1.06 -0.51 1.83 0.00 0.00 175.22 177.43 1xcq s LEU 100 N 1.54 3.15 0.00 6.12 1.43 0.11 -3.66 118.68 127.38 1xcq s LEU 100 Ca 0.04 1.66 0.17 0.00 -1.03 0.00 0.00 54.13 54.97 1xcq s LEU 100 Cb -0.17 -4.50 0.52 0.00 0.03 0.00 0.00 46.19 42.07 1xcq s LEU 100 CO 0.03 -1.49 1.41 0.18 0.23 0.00 0.00 176.35 176.72 1xcq n LEU 101 N -3.08 2.27 -0.99 1.79 4.77 -1.26 -1.95 117.00 118.55 1xcq n LEU 101 Ca 0.08 -1.06 0.10 0.00 -0.03 0.00 0.00 56.01 55.11 1xcq n LEU 101 Cb 0.53 -0.22 0.17 0.00 -2.33 0.00 0.00 43.42 41.57 1xcq n LEU 101 CO 0.55 0.53 0.65 0.54 -1.33 0.00 0.00 177.39 178.32 1xcq n ARG 102 N 0.72 2.26 -1.35 3.23 1.74 -1.26 -5.01 116.66 116.99 1xcq n ARG 102 Ca 0.16 -2.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.16 1xcq n ARG 102 Cb 0.39 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 1xcq n ARG 102 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1xcq n GLN 103 N 1.26 0.00 0.00 5.56 1.13 -0.82 -5.07 117.38 119.44 1xcq n GLN 103 Ca 0.16 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1xcq n GLN 103 Cb 0.54 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.51 1xcq n GLN 103 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 1xcq n TYR 104 N -1.28 0.00 -4.02 1.08 0.18 -1.25 -4.94 117.16 106.93 1xcq n TYR 104 Ca 0.00 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.42 1xcq n TYR 104 Cb 0.44 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.33 1xcq n TYR 104 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 1xcq s PHE 105 N -2.00 3.47 -0.09 -3.48 0.08 -1.26 -0.71 117.98 113.99 1xcq s PHE 105 Ca 0.00 0.43 0.12 0.00 0.12 0.00 0.00 56.93 57.60 1xcq s PHE 105 Cb 0.00 -1.90 -0.17 0.00 -0.57 0.00 0.00 43.02 40.38 1xcq s PHE 105 CO 0.00 0.66 0.13 -0.40 -0.10 0.00 0.00 175.22 175.51 1xcq n ASP 106 N 2.04 1.87 -3.74 1.36 3.85 -1.20 -5.00 116.55 115.74 1xcq n ASP 106 Ca -0.20 0.00 -0.12 0.00 -0.71 0.00 0.00 54.79 53.76 1xcq n ASP 106 Cb 0.55 1.08 -0.12 0.00 -1.35 0.00 0.00 41.12 41.27 1xcq n ASP 106 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1xcq s VAL 107 N -2.52 -0.03 0.24 2.12 1.01 -1.26 -5.06 120.40 114.90 1xcq s VAL 107 Ca -0.06 0.10 0.11 0.00 0.00 0.00 0.00 61.98 62.14 1xcq s VAL 107 Cb 0.05 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 36.00 1xcq s VAL 107 CO 0.54 0.04 -0.19 0.26 0.00 0.00 0.00 175.10 175.75 1xcq s TRP 108 N 0.96 2.35 0.00 5.22 0.52 -1.26 -0.78 118.94 125.95 1xcq s TRP 108 Ca -0.07 -0.32 0.00 0.00 0.02 0.00 0.00 56.10 55.73 1xcq s TRP 108 Cb -0.08 -1.08 0.00 0.00 -1.15 0.00 0.00 33.47 31.16 1xcq s TRP 108 CO -0.06 0.62 0.00 0.41 0.02 0.00 0.00 176.95 177.93 1xcq n GLY 109 N -0.26 -1.94 0.00 0.98 0.00 0.44 -4.72 105.19 99.70 1xcq n GLY 109 Ca -0.08 -1.44 0.06 0.00 0.00 0.00 0.00 46.02 44.56 1xcq n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcq n ALA 110 N -3.00 3.50 0.00 4.61 0.00 -1.25 -4.86 120.51 119.51 1xcq n ALA 110 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1xcq n ALA 110 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1xcq n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcq n GLY 111 N 1.36 0.70 0.00 0.00 0.00 -1.26 -4.93 105.19 101.05 1xcq n GLY 111 Ca 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1xcq n GLY 111 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xcq n THR 112 N 0.00 0.00 0.00 2.61 -1.04 -1.20 -4.53 114.28 110.12 1xcq n THR 112 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1xcq n THR 112 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1xcq n THR 112 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1xcq n THR 113 N 0.00 0.00 -2.66 12.58 -2.24 -1.24 -4.24 114.28 116.48 1xcq n THR 113 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1xcq n THR 113 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1xcq n THR 113 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1xcq n VAL 114 N 0.00 4.42 -1.73 2.28 3.14 -1.01 -3.01 118.33 122.42 1xcq n VAL 114 Ca 0.00 -4.70 -0.42 0.00 -2.96 0.00 0.00 64.34 56.26 1xcq n VAL 114 Cb 0.00 -2.38 -0.03 0.00 -1.06 0.00 0.00 33.84 30.37 1xcq n VAL 114 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1xcq n THR 115 N 3.55 0.35 -3.99 1.55 -1.04 0.34 -4.35 114.28 110.69 1xcq n THR 115 Ca 0.37 -0.09 -0.31 0.00 -2.04 0.00 0.00 64.05 61.98 1xcq n THR 115 Cb 0.38 -1.97 -0.15 0.00 -1.82 0.00 0.00 70.33 66.77 1xcq n THR 115 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1xcq s VAL 116 N 0.76 1.99 0.00 12.58 1.01 -1.26 -2.52 120.40 132.96 1xcq s VAL 116 Ca 0.71 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.82 1xcq s VAL 116 Cb -0.50 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 33.55 1xcq s VAL 116 CO 0.38 -0.36 0.00 -0.24 0.00 0.00 0.00 175.10 174.88 1xcq n SER 117 N 4.43 0.00 -0.08 3.32 2.88 0.71 -4.65 113.62 120.23 1xcq n SER 117 Ca -0.04 -0.99 -0.13 0.00 -1.33 0.00 0.00 58.87 56.37 1xcq n SER 117 Cb 0.42 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.82 1xcq n SER 117 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1xcq n SER 118 N -2.72 2.19 -1.54 -3.46 7.64 -1.26 -3.71 113.62 110.75 1xcq n SER 118 Ca 0.00 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1xcq n SER 118 Cb 0.00 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1xcq n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xcq n ALA 119 N -3.24 0.00 -2.53 -0.43 0.00 -1.26 -4.98 120.51 108.07 1xcq n ALA 119 Ca -0.29 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.87 1xcq n ALA 119 Cb 0.76 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.11 1xcq n ALA 119 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xcq s LYS 120 N 0.00 1.91 -0.12 0.00 1.02 -1.26 -5.06 119.74 116.23 1xcq s LYS 120 Ca 0.00 -1.25 -0.29 0.00 0.02 0.00 0.00 55.97 54.44 1xcq s LYS 120 Cb 0.00 -2.12 -0.01 0.00 -0.52 0.00 0.00 37.83 35.18 1xcq s LYS 120 CO 0.00 0.45 1.03 0.99 -0.92 0.00 0.00 175.35 176.90 1xcq s THR 121 N -1.49 4.72 -0.13 2.17 2.01 -1.26 -4.76 115.64 116.90 1xcq s THR 121 Ca 0.22 2.00 -0.14 0.00 0.31 0.00 0.00 61.69 64.08 1xcq s THR 121 Cb -0.09 -4.28 0.04 0.00 0.01 0.00 0.00 72.50 68.17 1xcq s THR 121 CO 0.13 -0.02 0.39 0.28 -0.69 0.00 0.00 174.62 174.70 1xcq s THR 122 N 2.21 0.01 0.19 -0.82 -1.32 -1.26 -4.98 115.64 109.67 1xcq s THR 122 Ca 0.48 -0.06 -0.03 0.00 -1.21 0.00 0.00 61.69 60.88 1xcq s THR 122 Cb -0.18 -0.57 -0.05 0.00 -1.51 0.00 0.00 72.50 70.19 1xcq s THR 122 CO 0.17 -0.03 0.41 -2.16 -2.21 0.00 0.00 174.62 170.79 1xcq s PRO 123 N 0.00 3.57 1.04 7.08 0.04 -1.26 -0.64 135.00 144.84 1xcq s PRO 123 Ca -0.02 -0.20 -0.16 0.00 0.04 0.00 0.00 61.00 60.66 1xcq s PRO 123 Cb -0.03 -2.82 0.22 0.00 0.04 0.00 0.00 34.50 31.91 1xcq s PRO 123 CO 0.01 0.40 1.19 -1.25 0.04 0.00 0.00 177.00 177.39 1xcq s PRO 124 N -3.10 0.03 0.41 0.56 0.04 -1.25 -4.52 135.00 127.17 1xcq s PRO 124 Ca 0.40 -0.08 0.07 0.00 0.04 0.00 0.00 61.00 61.43 1xcq s PRO 124 Cb -0.11 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 1xcq s PRO 124 CO 0.27 -2.88 0.01 -1.12 0.04 0.00 0.00 177.00 173.33 1xcq s SER 125 N -4.25 3.86 -0.30 6.66 0.01 -0.72 -4.95 113.70 114.01 1xcq s SER 125 Ca 0.70 -1.37 -0.11 0.00 1.31 0.00 0.00 55.95 56.47 1xcq s SER 125 Cb -0.09 -0.39 0.12 0.00 0.21 0.00 0.00 66.02 65.87 1xcq s SER 125 CO 0.54 -0.46 0.66 -0.69 0.41 0.00 0.00 173.24 173.71 1xcq s VAL 126 N -2.72 -0.77 -0.07 3.43 1.01 -1.25 -3.01 120.40 117.02 1xcq s VAL 126 Ca 0.35 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.34 1xcq s VAL 126 Cb 0.10 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.50 1xcq s VAL 126 CO 0.18 0.00 -0.08 -0.31 0.00 0.00 0.00 175.10 174.89 1xcq s TYR 127 N 2.61 1.19 -0.54 5.22 2.02 -0.72 -4.93 117.35 122.20 1xcq s TYR 127 Ca -0.07 -0.45 -0.28 0.00 -0.37 0.00 0.00 57.07 55.90 1xcq s TYR 127 Cb -0.10 -0.96 0.01 0.00 -0.40 0.00 0.00 41.96 40.51 1xcq s TYR 127 CO -0.19 -0.31 1.45 -1.25 -1.57 0.00 0.00 175.55 173.68 1xcq s PRO 128 N 1.06 3.29 -0.94 -1.71 0.04 -1.26 -0.92 135.00 134.56 1xcq s PRO 128 Ca -0.08 0.53 -0.24 0.00 0.04 0.00 0.00 61.00 61.25 1xcq s PRO 128 Cb -0.14 -4.13 0.03 0.00 0.04 0.00 0.00 34.50 30.29 1xcq s PRO 128 CO -0.01 -1.94 1.52 -0.51 0.04 0.00 0.00 177.00 176.10 1xcq s LEU 129 N 6.18 3.38 0.04 -3.56 1.43 -0.61 -4.94 118.68 120.60 1xcq s LEU 129 Ca 0.55 -1.08 0.05 0.00 -1.03 0.00 0.00 54.13 52.62 1xcq s LEU 129 Cb -0.11 -2.56 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 1xcq s LEU 129 CO 0.26 -1.81 -0.10 0.00 0.23 0.00 0.00 176.35 174.93 1xcq s ALA 130 N 6.12 2.92 0.77 4.21 0.00 -1.26 -2.11 121.76 132.42 1xcq s ALA 130 Ca 0.49 -1.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 1xcq s ALA 130 Cb -0.03 -0.99 0.06 0.00 0.00 0.00 0.00 23.12 22.15 1xcq s ALA 130 CO -0.03 0.62 1.09 -1.25 0.00 0.00 0.00 175.76 176.19 1xcq s PRO 131 N -1.64 2.25 0.38 0.00 0.04 -1.26 -4.96 135.00 129.81 1xcq s PRO 131 Ca 0.18 1.17 -0.06 0.00 0.04 0.00 0.00 61.00 62.33 1xcq s PRO 131 Cb -0.11 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 1xcq s PRO 131 CO 0.09 -1.65 0.68 0.20 0.04 0.00 0.00 177.00 176.36 1xcq s GLY 132 N -3.39 1.71 0.65 0.56 0.00 -1.26 -4.09 107.32 101.50 1xcq s GLY 132 Ca 0.61 -0.50 0.08 0.00 0.00 0.00 0.00 44.72 44.91 1xcq s GLY 132 CO 0.56 -0.36 1.09 1.76 0.00 0.00 0.00 173.10 176.16 1xcq h SER 133 N 1.04 0.00 0.00 1.64 0.02 -1.96 -1.82 113.55 112.47 1xcq h SER 133 Ca -0.48 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.45 1xcq h SER 133 Cb 1.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 1xcq h SER 133 CO 0.64 0.00 0.06 0.00 -1.14 0.00 0.00 176.83 176.39 1xcq n ALA 134 N -1.72 2.58 -1.44 3.77 0.00 -1.26 -4.74 120.51 117.69 1xcq n ALA 134 Ca 0.07 -0.23 -0.11 0.00 0.00 0.00 0.00 53.44 53.17 1xcq n ALA 134 Cb 1.15 -1.87 -0.09 0.00 0.00 0.00 0.00 19.45 18.64 1xcq n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xcq n ALA 135 N 2.17 0.27 1.48 0.00 0.00 -0.69 -4.75 120.51 119.01 1xcq n ALA 135 Ca 0.05 -1.89 0.10 0.00 0.00 0.00 0.00 53.44 51.71 1xcq n ALA 135 Cb 0.23 -2.68 0.59 0.00 0.00 0.00 0.00 19.45 17.60 1xcq n ALA 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xcq n GLN 136 N 7.29 0.74 0.00 0.00 6.02 -1.26 -4.94 117.38 125.23 1xcq n GLN 136 Ca 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 1xcq n GLN 136 Cb 0.47 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.31 1xcq n GLN 136 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1xcq n THR 137 N -0.92 0.00 -1.49 5.09 -1.04 -1.26 -4.99 114.28 109.67 1xcq n THR 137 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 1xcq n THR 137 Cb 0.07 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.58 1xcq n THR 137 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1xcq n ASN 138 N 0.00 0.10 -0.07 8.00 5.15 -1.26 -4.93 115.26 122.25 1xcq n ASN 138 Ca 0.00 0.00 0.25 0.00 -0.60 0.00 0.00 54.58 54.23 1xcq n ASN 138 Cb 0.00 0.00 0.72 0.00 -0.53 0.00 0.00 39.78 39.97 1xcq n ASN 138 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 1xcq h SER 139 N 0.00 0.00 -4.84 1.20 0.87 -2.00 -3.43 113.55 105.36 1xcq h SER 139 Ca 0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1xcq h SER 139 Cb 0.00 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 61.81 1xcq h SER 139 CO 0.00 0.00 0.31 0.00 -0.53 0.00 0.00 176.83 176.61 1xcq s MET 140 N -4.84 1.07 0.83 2.24 0.23 -1.26 -4.23 119.30 113.34 1xcq s MET 140 Ca -0.05 -0.26 -0.09 0.00 -1.03 0.00 0.00 55.69 54.26 1xcq s MET 140 Cb 0.19 0.49 0.14 0.00 -1.53 0.00 0.00 34.83 34.13 1xcq s MET 140 CO 0.68 -0.44 1.16 0.54 -2.03 0.00 0.00 175.02 174.93 1xcq s VAL 141 N -2.97 2.09 -0.30 5.16 0.11 -0.85 -4.83 120.40 118.82 1xcq s VAL 141 Ca -0.00 -0.23 -0.11 0.00 -2.93 0.00 0.00 61.98 58.70 1xcq s VAL 141 Cb -0.01 -2.86 0.13 0.00 -1.53 0.00 0.00 36.38 32.11 1xcq s VAL 141 CO -0.07 0.00 0.69 -0.89 -3.33 0.00 0.00 175.10 171.50 1xcq s THR 142 N -3.52 -0.83 0.25 5.04 2.01 -1.26 0.75 115.64 118.08 1xcq s THR 142 Ca 0.68 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.76 1xcq s THR 142 Cb -0.06 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 1xcq s THR 142 CO 0.49 0.00 0.15 -0.76 -0.69 0.00 0.00 174.62 173.80 1xcq s LEU 143 N 2.69 3.67 0.24 4.42 1.43 -0.66 -4.84 118.68 125.63 1xcq s LEU 143 Ca -0.06 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1xcq s LEU 143 Cb -0.11 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 1xcq s LEU 143 CO -0.19 -0.02 0.13 -0.83 0.23 0.00 0.00 176.35 175.66 1xcq s GLY 144 N -3.77 1.66 -0.23 -3.19 0.00 -0.90 -2.02 107.32 98.88 1xcq s GLY 144 Ca 0.32 -1.78 -0.08 0.00 0.00 0.00 0.00 44.72 43.18 1xcq s GLY 144 CO 0.24 -1.50 0.49 0.00 0.00 0.00 0.00 173.10 172.33 1xcq s LEU 146 N 2.56 3.46 -0.47 0.00 2.96 -0.10 -1.01 118.68 126.07 1xcq s LEU 146 Ca -0.04 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.64 1xcq s LEU 146 Cb -0.11 -1.91 0.12 0.00 0.50 0.00 0.00 46.19 44.79 1xcq s LEU 146 CO -0.15 0.02 0.32 -0.69 -1.32 0.00 0.00 176.35 174.54 1xcq s VAL 147 N 1.30 3.96 -0.24 1.68 1.01 -1.26 -1.75 120.40 125.11 1xcq s VAL 147 Ca 0.05 -1.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.01 1xcq s VAL 147 Cb -0.15 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1xcq s VAL 147 CO 0.03 -0.77 0.01 -0.75 0.00 0.00 0.00 175.10 173.62 1xcq s LYS 148 N 1.17 3.43 -0.17 2.72 2.20 -1.16 -2.55 119.74 125.38 1xcq s LYS 148 Ca 0.08 -0.61 -0.06 0.00 -0.36 0.00 0.00 55.97 55.02 1xcq s LYS 148 Cb -0.24 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 32.95 1xcq s LYS 148 CO -0.02 -0.22 0.11 0.41 -0.36 0.00 0.00 175.35 175.27 1xcq n GLY 149 N 4.84 -4.36 3.67 5.54 0.00 -0.93 -1.76 105.19 112.19 1xcq n GLY 149 Ca -0.17 0.84 -0.09 0.00 0.00 0.00 0.00 46.02 46.60 1xcq n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xcq s TYR 150 N -0.74 -0.30 0.00 1.61 1.13 -1.10 -3.81 117.35 114.14 1xcq s TYR 150 Ca -0.13 -0.06 0.00 0.00 -1.41 0.00 0.00 57.07 55.47 1xcq s TYR 150 Cb 0.01 0.62 0.00 0.00 -1.10 0.00 0.00 41.96 41.49 1xcq s TYR 150 CO 0.57 -1.07 0.00 0.34 -2.51 0.00 0.00 175.55 172.88 1xcq n PHE 151 N -0.42 0.00 -0.29 -3.49 7.35 0.19 -1.19 117.46 119.61 1xcq n PHE 151 Ca -0.09 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.53 1xcq n PHE 151 Cb 0.61 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.41 1xcq n PHE 151 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1xcq n PRO 152 N 0.00 0.00 -0.05 -7.13 -0.02 -1.26 -4.60 135.00 121.94 1xcq n PRO 152 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1xcq n PRO 152 Cb 0.00 -0.26 0.01 0.00 -0.02 0.00 0.00 33.50 33.22 1xcq n PRO 152 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1xcq n GLU 153 N 1.47 -0.03 -1.50 -0.52 0.00 -1.26 -4.56 120.64 114.24 1xcq n GLU 153 Ca 0.13 0.21 -0.52 0.00 0.00 0.00 0.00 57.16 56.97 1xcq n GLU 153 Cb 0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 31.44 31.09 1xcq n GLU 153 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1xcq n PRO 154 N -4.20 0.41 -3.68 5.31 -0.04 -1.26 -4.93 135.00 126.62 1xcq n PRO 154 Ca 0.01 0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.49 1xcq n PRO 154 Cb 0.05 -1.51 -0.08 0.00 -0.04 0.00 0.00 33.50 31.92 1xcq n PRO 154 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xcq s VAL 155 N -0.35 -0.00 -0.31 0.52 1.01 -1.26 -4.25 120.40 115.75 1xcq s VAL 155 Ca 0.77 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.79 1xcq s VAL 155 Cb -1.03 -0.81 0.08 0.00 0.00 0.00 0.00 36.38 34.63 1xcq s VAL 155 CO 0.55 0.00 -0.00 0.28 0.00 0.00 0.00 175.10 175.93 1xcq s THR 156 N 0.44 2.33 -0.10 3.92 -1.32 0.66 -5.01 115.64 116.57 1xcq s THR 156 Ca -0.01 -2.02 -0.00 0.00 -1.21 0.00 0.00 61.69 58.45 1xcq s THR 156 Cb -0.04 -2.57 -0.03 0.00 -1.51 0.00 0.00 72.50 68.35 1xcq s THR 156 CO -0.01 -0.37 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.27 1xcq s VAL 157 N 1.01 3.65 0.01 5.08 1.01 -1.26 -0.50 120.40 129.39 1xcq s VAL 157 Ca 0.03 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 1xcq s VAL 157 Cb -0.20 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.66 1xcq s VAL 157 CO -0.06 0.56 0.15 0.42 0.00 0.00 0.00 175.10 176.17 1xcq s THR 158 N -0.35 0.09 -0.14 3.92 -4.23 0.40 -4.98 115.64 110.34 1xcq s THR 158 Ca 0.05 -0.73 -0.03 0.00 -1.18 0.00 0.00 61.69 59.79 1xcq s THR 158 Cb -0.12 -0.54 -0.03 0.00 1.34 0.00 0.00 72.50 73.15 1xcq s THR 158 CO 0.02 -0.40 -0.04 0.26 -0.54 0.00 0.00 174.62 173.92 1xcq s TRP 159 N -1.62 3.02 0.00 3.99 0.52 -1.26 -1.70 118.94 121.89 1xcq s TRP 159 Ca -0.13 -0.24 0.00 0.00 0.02 0.00 0.00 56.10 55.75 1xcq s TRP 159 Cb -0.06 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.34 1xcq s TRP 159 CO 0.01 0.03 0.00 0.09 0.02 0.00 0.00 176.95 177.10 1xcq n ASN 160 N 3.32 0.00 0.00 2.95 3.02 0.96 -3.01 115.26 122.50 1xcq n ASN 160 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 1xcq n ASN 160 Cb 0.53 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 1xcq n ASN 160 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xcq n SER 161 N 1.01 0.00 0.00 6.41 7.64 -1.26 -3.33 113.62 124.10 1xcq n SER 161 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1xcq n SER 161 Cb 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1xcq n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xcq n GLY 162 N -1.60 0.00 0.70 0.23 0.00 -1.16 -4.98 105.19 98.38 1xcq n GLY 162 Ca 0.00 0.00 0.53 0.00 0.00 0.00 0.00 46.02 46.55 1xcq n GLY 162 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xcq h SER 163 N 0.00 0.00 -3.13 1.61 0.02 -1.74 -3.29 113.55 107.02 1xcq h SER 163 Ca 0.00 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.28 1xcq h SER 163 Cb 0.00 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 62.21 1xcq h SER 163 CO 0.00 -0.00 -0.84 -0.76 -1.14 0.00 0.00 176.83 174.09 1xcq s LEU 164 N -7.92 2.26 0.00 5.07 1.43 -1.26 -5.08 118.68 113.18 1xcq s LEU 164 Ca -0.05 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1xcq s LEU 164 Cb 0.27 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.97 1xcq s LEU 164 CO 0.89 0.01 0.00 -1.54 0.23 0.00 0.00 176.35 175.94 1xcq n SER 165 N 4.57 0.00 -4.93 2.29 3.41 -1.24 -4.71 113.62 113.01 1xcq n SER 165 Ca -0.20 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.19 1xcq n SER 165 Cb 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1xcq n SER 165 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1xcq s SER 166 N -1.00 6.10 0.00 4.04 0.01 -1.26 -4.47 113.70 117.12 1xcq s SER 166 Ca 0.00 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1xcq s SER 166 Cb 0.00 -1.74 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1xcq s SER 166 CO 0.00 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.21 1xcq n GLY 167 N -1.27 1.64 3.08 3.44 0.00 -1.26 -4.98 105.19 105.85 1xcq n GLY 167 Ca -0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 1xcq n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcq s VAL 168 N -2.00 0.79 -0.16 1.61 1.01 -1.26 -2.14 120.40 118.25 1xcq s VAL 168 Ca 0.00 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.08 1xcq s VAL 168 Cb 0.00 -0.75 0.06 0.00 0.00 0.00 0.00 36.38 35.69 1xcq s VAL 168 CO 0.00 -0.08 0.10 -1.00 0.00 0.00 0.00 175.10 174.12 1xcq s HIS 169 N -0.84 0.13 -0.73 5.22 3.76 -1.26 -5.01 115.29 116.57 1xcq s HIS 169 Ca -0.02 -0.21 -0.02 0.00 -0.15 0.00 0.00 55.06 54.66 1xcq s HIS 169 Cb -0.07 -0.64 0.40 0.00 1.11 0.00 0.00 32.58 33.38 1xcq s HIS 169 CO 0.01 -0.50 2.05 2.41 -0.85 0.00 0.00 174.74 177.86 1xcq n THR 170 N 5.29 3.60 0.00 1.30 -1.04 -1.26 -2.39 114.28 119.77 1xcq n THR 170 Ca -0.07 -3.42 0.00 0.00 -2.04 0.00 0.00 64.05 58.52 1xcq n THR 170 Cb 0.49 -1.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.80 1xcq n THR 170 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1xcq n PHE 171 N -0.71 0.00 -0.82 -1.42 3.72 -1.25 -4.82 117.46 112.16 1xcq n PHE 171 Ca 0.59 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.65 1xcq n PHE 171 Cb 0.49 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 39.15 1xcq n PHE 171 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1xcq n PRO 172 N 0.12 -0.26 -2.12 -1.08 -0.02 -1.26 -4.67 135.00 125.70 1xcq n PRO 172 Ca 0.00 -0.03 -0.32 0.00 -2.02 0.00 0.00 63.50 61.12 1xcq n PRO 172 Cb 0.00 -1.87 -0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1xcq n PRO 172 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xcq s ALA 173 N -2.38 2.83 -0.23 3.55 0.00 -1.26 -4.76 121.76 119.51 1xcq s ALA 173 Ca 0.58 0.32 -0.03 0.00 0.00 0.00 0.00 51.96 52.82 1xcq s ALA 173 Cb -0.22 -3.20 0.08 0.00 0.00 0.00 0.00 23.12 19.78 1xcq s ALA 173 CO 0.67 -0.67 0.08 0.08 0.00 0.00 0.00 175.76 175.92 1xcq s VAL 174 N -2.53 0.26 0.54 0.00 1.01 -1.02 -5.00 120.40 113.66 1xcq s VAL 174 Ca 0.62 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.88 1xcq s VAL 174 Cb -0.14 -0.99 0.13 0.00 0.00 0.00 0.00 36.38 35.38 1xcq s VAL 174 CO 0.36 -0.44 0.29 -0.11 0.00 0.00 0.00 175.10 175.21 1xcq n LEU 175 N 5.13 0.00 0.00 3.92 7.94 -1.26 -3.57 117.00 129.17 1xcq n LEU 175 Ca -0.07 -0.30 0.00 0.00 -1.11 0.00 0.00 56.01 54.54 1xcq n LEU 175 Cb 0.45 -0.37 0.00 0.00 0.53 0.00 0.00 43.42 44.03 1xcq n LEU 175 CO 0.10 -1.94 0.00 1.67 -1.11 0.00 0.00 177.39 176.10 1xcq n GLN 176 N -2.73 0.00 -2.74 1.96 0.00 -1.17 -4.82 117.38 107.89 1xcq n GLN 176 Ca 0.05 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.78 1xcq n GLN 176 Cb 0.20 0.00 0.03 0.00 0.00 0.00 0.00 30.24 30.47 1xcq n GLN 176 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1xcq n SER 177 N 0.00 -3.81 -4.02 1.69 3.41 -1.26 -1.68 113.62 107.95 1xcq n SER 177 Ca 0.00 -0.11 -0.32 0.00 -0.26 0.00 0.00 58.87 58.18 1xcq n SER 177 Cb 0.00 -1.10 0.01 0.00 -0.26 0.00 0.00 64.21 62.85 1xcq n SER 177 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xcq n ASP 178 N 0.21 -4.23 -3.34 4.04 8.00 -1.26 -4.97 116.55 114.99 1xcq n ASP 178 Ca -0.06 -0.86 0.02 0.00 0.71 0.00 0.00 54.79 54.60 1xcq n ASP 178 Cb 0.48 -3.49 -0.04 0.00 -0.02 0.00 0.00 41.12 38.04 1xcq n ASP 178 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xcq s LEU 179 N -7.27 -0.41 0.84 0.64 2.96 -0.68 -4.98 118.68 109.78 1xcq s LEU 179 Ca 0.68 0.57 -0.12 0.00 -0.22 0.00 0.00 54.13 55.04 1xcq s LEU 179 Cb -0.35 1.47 0.09 0.00 0.50 0.00 0.00 46.19 47.90 1xcq s LEU 179 CO 0.86 -0.08 1.13 -0.31 -1.32 0.00 0.00 176.35 176.64 1xcq s TYR 180 N 2.28 2.79 -0.27 5.38 2.02 -0.33 -3.03 117.35 126.19 1xcq s TYR 180 Ca -0.02 0.93 -0.26 0.00 -0.37 0.00 0.00 57.07 57.36 1xcq s TYR 180 Cb -0.04 -3.31 0.13 0.00 -0.40 0.00 0.00 41.96 38.34 1xcq s TYR 180 CO -0.17 -1.94 1.06 0.95 -1.57 0.00 0.00 175.55 173.87 1xcq s THR 181 N -3.32 0.00 -0.34 -0.71 -4.23 -1.23 -2.20 115.64 103.60 1xcq s THR 181 Ca 0.62 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 61.15 1xcq s THR 181 Cb -0.13 -1.00 0.15 0.00 1.34 0.00 0.00 72.50 72.86 1xcq s THR 181 CO 0.52 0.00 0.38 -1.48 -0.54 0.00 0.00 174.62 173.50 1xcq s LEU 182 N 0.05 -0.31 0.16 4.79 2.34 -1.06 -2.43 118.68 122.23 1xcq s LEU 182 Ca 0.03 -1.15 -0.31 0.00 0.06 0.00 0.00 54.13 52.75 1xcq s LEU 182 Cb -0.04 0.73 -0.17 0.00 -0.56 0.00 0.00 46.19 46.14 1xcq s LEU 182 CO -0.06 -0.30 0.76 -1.54 -1.06 0.00 0.00 176.35 174.16 1xcq n SER 183 N 4.67 -0.43 -3.83 1.48 3.41 -1.26 -4.07 113.62 113.59 1xcq n SER 183 Ca 0.06 1.14 -0.12 0.00 -0.26 0.00 0.00 58.87 59.70 1xcq n SER 183 Cb 0.47 -1.01 -0.12 0.00 -0.26 0.00 0.00 64.21 63.29 1xcq n SER 183 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xcq s SER 184 N -0.62 -0.13 0.61 4.04 0.15 -0.18 -3.79 113.70 113.78 1xcq s SER 184 Ca 0.71 0.21 0.04 0.00 0.70 0.00 0.00 55.95 57.61 1xcq s SER 184 Cb -0.97 0.30 0.09 0.00 -1.71 0.00 0.00 66.02 63.72 1xcq s SER 184 CO 0.56 -0.12 0.84 -0.55 1.20 0.00 0.00 173.24 175.17 1xcq s SER 185 N -0.22 4.91 0.00 5.45 0.15 -1.00 0.47 113.70 123.45 1xcq s SER 185 Ca -0.03 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1xcq s SER 185 Cb -0.03 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 1xcq s SER 185 CO 0.00 -1.44 0.00 0.55 1.20 0.00 0.00 173.24 173.55 1xcq n VAL 186 N -2.43 0.00 -2.90 4.45 3.14 -0.85 -3.98 118.33 115.75 1xcq n VAL 186 Ca 0.13 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.15 1xcq n VAL 186 Cb 0.61 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.32 1xcq n VAL 186 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1xcq s THR 187 N 0.00 4.36 0.28 1.55 -1.32 -0.91 -1.66 115.64 117.94 1xcq s THR 187 Ca 0.00 1.59 -0.05 0.00 -1.21 0.00 0.00 61.69 62.03 1xcq s THR 187 Cb 0.00 -3.92 0.02 0.00 -1.51 0.00 0.00 72.50 67.09 1xcq s THR 187 CO 0.00 0.13 0.45 1.33 -2.21 0.00 0.00 174.62 174.31 1xcq n VAL 188 N 0.51 0.00 -1.49 5.08 0.24 0.23 -4.85 118.33 118.05 1xcq n VAL 188 Ca 0.01 -1.17 -0.47 0.00 -2.04 0.00 0.00 64.34 60.66 1xcq n VAL 188 Cb 0.51 0.81 -0.06 0.00 -1.47 0.00 0.00 33.84 33.63 1xcq n VAL 188 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1xcq n PRO 189 N -0.43 1.21 0.21 7.34 -0.02 -1.26 -2.00 135.00 140.05 1xcq n PRO 189 Ca -0.02 0.30 0.17 0.00 -2.02 0.00 0.00 63.50 61.94 1xcq n PRO 189 Cb 0.45 -2.67 0.75 0.00 -0.02 0.00 0.00 33.50 32.01 1xcq n PRO 189 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1xcq h SER 190 N 13.59 0.00 0.38 2.55 0.02 -1.88 0.32 113.55 128.54 1xcq h SER 190 Ca -0.29 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.64 1xcq h SER 190 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1xcq h SER 190 CO 1.03 0.00 -0.18 -1.28 -1.14 0.00 0.00 176.83 175.26 1xcq h SER 191 N 0.00 -0.43 0.37 3.07 0.87 -1.89 -3.25 113.55 112.28 1xcq h SER 191 Ca 0.10 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1xcq h SER 191 Cb 0.96 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1xcq h SER 191 CO -0.00 -0.03 0.00 0.35 -0.53 0.00 0.00 176.83 176.62 1xcq n THR 192 N -5.16 1.15 -4.40 2.23 -2.24 0.11 -4.66 114.28 101.31 1xcq n THR 192 Ca -0.09 0.40 -0.28 0.00 -2.27 0.00 0.00 64.05 61.81 1xcq n THR 192 Cb 0.28 -1.31 -0.12 0.00 -2.10 0.00 0.00 70.33 67.07 1xcq n THR 192 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1xcq s TRP 193 N -3.23 2.26 -0.72 4.78 -0.00 -0.88 0.73 118.94 121.89 1xcq s TRP 193 Ca 0.03 -0.37 -0.03 0.00 -0.00 0.00 0.00 56.10 55.72 1xcq s TRP 193 Cb 0.07 -1.17 0.16 0.00 -0.00 0.00 0.00 33.47 32.52 1xcq s TRP 193 CO 0.24 0.41 2.48 -0.35 -0.00 0.00 0.00 176.95 179.72 1xcq n PRO 194 N 0.59 3.04 0.00 5.86 -0.04 -1.26 -4.83 135.00 138.35 1xcq n PRO 194 Ca -0.15 -2.96 0.00 0.00 -0.04 0.00 0.00 63.50 60.35 1xcq n PRO 194 Cb 0.55 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.74 1xcq n PRO 194 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1xcq n SER 195 N 0.61 0.00 -4.65 3.54 7.64 -1.14 -4.91 113.62 114.71 1xcq n SER 195 Ca 0.52 0.17 -0.43 0.00 1.01 0.00 0.00 58.87 60.14 1xcq n SER 195 Cb 0.41 -0.25 -0.03 0.00 -1.01 0.00 0.00 64.21 63.33 1xcq n SER 195 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1xcq s GLU 196 N -0.50 4.02 -0.38 1.43 8.01 0.22 -4.86 118.70 126.65 1xcq s GLU 196 Ca 0.00 1.84 -0.40 0.00 0.01 0.00 0.00 54.97 56.42 1xcq s GLU 196 Cb 0.00 -3.96 -0.15 0.00 -4.31 0.00 0.00 34.13 25.71 1xcq s GLU 196 CO 0.00 -1.01 2.00 -2.37 0.01 0.00 0.00 175.26 173.89 1xcq n THR 197 N 5.86 0.17 -3.84 3.63 5.66 -1.26 -4.84 114.28 119.66 1xcq n THR 197 Ca 0.17 -0.11 -0.36 0.00 -3.05 0.00 0.00 64.05 60.70 1xcq n THR 197 Cb 0.44 -1.15 -0.13 0.00 -1.55 0.00 0.00 70.33 67.95 1xcq n THR 197 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1xcq s VAL 198 N 5.52 3.25 0.38 1.08 1.01 -1.26 -4.99 120.40 125.39 1xcq s VAL 198 Ca 1.08 -1.53 0.08 0.00 0.00 0.00 0.00 61.98 61.61 1xcq s VAL 198 Cb -1.13 -2.97 -0.07 0.00 0.00 0.00 0.00 36.38 32.21 1xcq s VAL 198 CO 0.61 -0.29 -0.02 0.42 0.00 0.00 0.00 175.10 175.81 1xcq s THR 199 N 1.25 2.01 -0.47 3.92 -4.23 -1.26 -0.22 115.64 116.65 1xcq s THR 199 Ca -0.01 -2.07 0.04 0.00 -1.18 0.00 0.00 61.69 58.48 1xcq s THR 199 Cb -0.21 -2.86 0.18 0.00 1.34 0.00 0.00 72.50 70.95 1xcq s THR 199 CO -0.01 -0.07 0.39 0.00 -0.54 0.00 0.00 174.62 174.38 1xcq s ASN 201 N -0.36 6.58 -0.17 0.00 0.01 -0.69 -3.89 114.94 116.43 1xcq s ASN 201 Ca 0.32 2.55 0.01 0.00 -0.71 0.00 0.00 52.86 55.03 1xcq s ASN 201 Cb 0.04 -2.57 0.03 0.00 0.41 0.00 0.00 41.25 39.15 1xcq s ASN 201 CO -0.19 -0.88 -0.15 0.54 -1.51 0.00 0.00 177.10 174.91 1xcq s VAL 202 N 2.25 1.75 -0.13 1.60 0.11 0.23 -0.46 120.40 125.75 1xcq s VAL 202 Ca 0.74 -0.82 -0.05 0.00 -2.93 0.00 0.00 61.98 58.91 1xcq s VAL 202 Cb -0.42 -1.66 -0.04 0.00 -1.53 0.00 0.00 36.38 32.74 1xcq s VAL 202 CO 0.32 0.42 0.07 0.00 -3.33 0.00 0.00 175.10 172.58 1xcq s ALA 203 N 1.40 3.51 -0.02 1.54 0.00 0.34 -2.22 121.76 126.31 1xcq s ALA 203 Ca 0.03 -0.73 0.08 0.00 0.00 0.00 0.00 51.96 51.34 1xcq s ALA 203 Cb -0.14 -1.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.17 1xcq s ALA 203 CO -0.11 0.45 -0.26 -1.58 0.00 0.00 0.00 175.76 174.26 1xcq s HIS 204 N -0.48 2.32 0.00 0.00 2.46 -1.25 -0.25 115.29 118.10 1xcq s HIS 204 Ca 0.10 -0.44 0.00 0.00 0.47 0.00 0.00 55.06 55.19 1xcq s HIS 204 Cb -0.12 -1.49 0.00 0.00 -0.13 0.00 0.00 32.58 30.84 1xcq s HIS 204 CO 0.02 -0.04 0.00 -2.30 -2.47 0.00 0.00 174.74 169.95 1xcq n PRO 205 N 2.45 0.73 0.00 2.88 -0.02 -1.26 -4.08 135.00 135.70 1xcq n PRO 205 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1xcq n PRO 205 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 1xcq n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xcq n ALA 206 N -2.97 0.00 0.04 3.55 0.00 -1.26 -2.95 120.51 116.92 1xcq n ALA 206 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.66 1xcq n ALA 206 Cb 0.00 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.12 1xcq n ALA 206 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xcq h SER 207 N 0.00 0.00 0.00 0.00 4.64 -1.94 -3.43 113.55 112.82 1xcq h SER 207 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xcq h SER 207 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xcq h SER 207 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 1xcq n SER 208 N -3.53 0.00 -4.55 4.97 7.64 -1.15 -4.88 113.62 112.12 1xcq n SER 208 Ca 0.10 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.63 1xcq n SER 208 Cb 0.82 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.97 1xcq n SER 208 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1xcq n THR 209 N -2.00 -0.07 -4.52 0.44 -1.04 -1.26 -4.87 114.28 100.95 1xcq n THR 209 Ca 0.00 -0.70 -0.32 0.00 -2.04 0.00 0.00 64.05 60.98 1xcq n THR 209 Cb 0.00 -2.51 -0.11 0.00 -1.82 0.00 0.00 70.33 65.89 1xcq n THR 209 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1xcq s LYS 210 N 8.40 2.49 -0.09 -2.82 2.20 -1.26 -3.75 119.74 124.92 1xcq s LYS 210 Ca 1.02 -0.75 -0.30 0.00 -0.36 0.00 0.00 55.97 55.59 1xcq s LYS 210 Cb -0.29 -2.46 0.11 0.00 -1.51 0.00 0.00 37.83 33.69 1xcq s LYS 210 CO 0.27 0.60 0.93 0.14 -0.36 0.00 0.00 175.35 176.93 1xcq s VAL 211 N -0.96 0.00 0.16 4.02 -7.23 -0.94 -5.05 120.40 110.39 1xcq s VAL 211 Ca 0.16 0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.35 1xcq s VAL 211 Cb -0.11 -1.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.82 1xcq s VAL 211 CO 0.06 0.00 0.06 0.47 -0.31 0.00 0.00 175.10 175.38 1xcq n ASP 212 N 0.32 1.05 0.00 4.85 8.00 -1.26 0.74 116.55 130.25 1xcq n ASP 212 Ca -0.10 -1.83 0.00 0.00 0.71 0.00 0.00 54.79 53.56 1xcq n ASP 212 Cb 0.59 0.40 0.00 0.00 -0.02 0.00 0.00 41.12 42.09 1xcq n ASP 212 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1xcq n LYS 213 N -0.35 0.00 -4.41 -1.24 4.81 -1.25 -4.86 118.16 110.85 1xcq n LYS 213 Ca -0.02 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.10 1xcq n LYS 213 Cb 0.24 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.18 1xcq n LYS 213 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1xcq s LYS 214 N -0.70 2.50 0.14 1.64 2.36 -1.26 0.19 119.74 124.60 1xcq s LYS 214 Ca 0.00 -0.76 -0.12 0.00 -2.55 0.00 0.00 55.97 52.53 1xcq s LYS 214 Cb 0.00 -2.48 -0.07 0.00 -1.05 0.00 0.00 37.83 34.23 1xcq s LYS 214 CO 0.00 0.59 0.50 0.42 1.55 0.00 0.00 175.35 178.41 1xcq s ILE 215 N -1.04 4.94 0.24 5.43 1.09 0.70 -4.94 121.20 127.62 1xcq s ILE 215 Ca 0.18 0.66 0.07 0.00 -1.10 0.00 0.00 60.65 60.46 1xcq s ILE 215 Cb -0.11 -3.69 -0.05 0.00 -1.06 0.00 0.00 42.46 37.55 1xcq s ILE 215 CO 0.09 0.22 -0.11 0.68 -0.10 0.00 0.00 174.94 175.72 1xcq s VAL 216 N -1.49 1.70 1.23 2.92 -7.23 -1.26 -4.70 120.40 111.58 1xcq s VAL 216 Ca 0.37 -2.18 -0.16 0.00 -1.81 0.00 0.00 61.98 58.20 1xcq s VAL 216 Cb -0.14 -2.22 0.30 0.00 0.56 0.00 0.00 36.38 34.89 1xcq s VAL 216 CO 0.19 -0.47 1.01 -2.16 -0.31 0.00 0.00 175.10 173.36 1xcq s PRO 217 N -3.68 -1.46 0.00 4.82 0.04 -1.26 -4.74 135.00 128.72 1xcq s PRO 217 Ca 0.26 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.79 1xcq s PRO 217 Cb 0.01 -1.52 0.00 0.00 0.04 0.00 0.00 34.50 33.03 1xcq s PRO 217 CO 0.09 -3.99 0.00 0.54 0.04 0.00 0.00 177.00 173.68