#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v3x s VAL 17 N 0.00 4.83 0.00 1.39 1.01 0.21 -4.04 120.40 123.81 1v3x s VAL 17 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1v3x s VAL 17 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1v3x s VAL 17 CO 0.00 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1v3x n GLY 18 N 3.33 -0.07 7.00 4.51 0.00 -1.26 -1.77 105.19 116.93 1v3x n GLY 18 Ca -0.17 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1v3x n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v3x n GLY 19 N 0.00 -0.24 3.24 -0.02 0.00 -1.26 -4.93 105.19 101.98 1v3x n GLY 19 Ca 0.00 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.90 1v3x n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1v3x s GLN 20 N 0.00 1.09 0.39 1.61 1.11 -0.40 -4.98 119.66 118.47 1v3x s GLN 20 Ca 0.00 -1.51 -0.27 0.00 0.01 0.00 0.00 55.36 53.59 1v3x s GLN 20 Cb 0.00 -0.35 -0.10 0.00 -1.01 0.00 0.00 33.01 31.55 1v3x s GLN 20 CO 0.00 -0.08 1.44 -1.21 0.01 0.00 0.00 175.29 175.45 1v3x s GLU 21 N -3.87 4.03 0.09 2.91 2.02 -1.26 -0.32 118.70 122.31 1v3x s GLU 21 Ca 0.22 2.47 -0.31 0.00 0.02 0.00 0.00 54.97 57.36 1v3x s GLU 21 Cb 0.05 -2.90 -0.08 0.00 0.10 0.00 0.00 34.13 31.31 1v3x s GLU 21 CO 0.03 -0.55 1.49 0.00 0.02 0.00 0.00 175.26 176.25 1v3x s LYS 23 N 1.71 2.16 -0.03 0.00 -0.14 -1.26 -4.89 119.74 117.30 1v3x s LYS 23 Ca 0.68 -0.43 -0.36 0.00 -1.36 0.00 0.00 55.97 54.50 1v3x s LYS 23 Cb -0.38 -2.23 -0.14 0.00 -1.68 0.00 0.00 37.83 33.39 1v3x s LYS 23 CO 0.30 -1.20 1.64 -3.47 -0.76 0.00 0.00 175.35 171.86 1v3x n ASP 24 N -2.84 2.64 0.00 2.83 4.64 -1.26 -0.82 116.55 121.75 1v3x n ASP 24 Ca 0.09 1.06 0.00 0.00 -1.38 0.00 0.00 54.79 54.56 1v3x n ASP 24 Cb 0.60 -1.28 0.00 0.00 -1.04 0.00 0.00 41.12 39.40 1v3x n ASP 24 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1v3x n GLY 25 N 3.63 1.59 0.13 0.27 0.00 -1.26 -4.92 105.19 104.64 1v3x n GLY 25 Ca 0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.31 1v3x n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1v3x h GLU 26 N 2.96 0.00 -1.59 1.61 5.08 -1.33 -3.37 114.58 117.94 1v3x h GLU 26 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1v3x h GLU 26 Cb 0.00 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.84 1v3x h GLU 26 CO 0.00 0.11 -0.98 0.00 -1.00 0.00 0.00 179.01 177.14 1v3x h PRO 28 N 2.89 0.00 -0.07 0.00 0.13 -1.77 -2.08 132.00 131.10 1v3x h PRO 28 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1v3x h PRO 28 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1v3x h PRO 28 CO 0.65 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.75 1v3x n TRP 29 N -2.83 0.09 -2.18 1.56 2.14 -0.95 -1.89 117.44 113.38 1v3x n TRP 29 Ca 0.02 -0.04 -0.42 0.00 2.07 0.00 0.00 57.50 59.13 1v3x n TRP 29 Cb 0.34 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.81 1v3x n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1v3x s GLN 30 N -1.91 4.32 0.31 -2.67 2.00 -0.78 -0.16 119.66 120.77 1v3x s GLN 30 Ca 0.35 2.07 0.11 0.00 -2.00 0.00 0.00 55.36 55.88 1v3x s GLN 30 Cb 0.18 -3.25 -0.06 0.00 0.80 0.00 0.00 33.01 30.68 1v3x s GLN 30 CO 0.28 -0.43 -0.13 0.00 -0.50 0.00 0.00 175.29 174.51 1v3x s ALA 31 N 1.10 2.90 -0.06 1.58 0.00 -0.36 -4.24 121.76 122.67 1v3x s ALA 31 Ca 0.64 -1.96 -0.00 0.00 0.00 0.00 0.00 51.96 50.64 1v3x s ALA 31 Cb -0.37 -0.21 0.03 0.00 0.00 0.00 0.00 23.12 22.57 1v3x s ALA 31 CO 0.30 0.18 -0.02 -1.17 0.00 0.00 0.00 175.76 175.06 1v3x s LEU 32 N -3.58 0.90 -0.14 0.00 2.96 0.34 -1.12 118.68 118.06 1v3x s LEU 32 Ca 0.31 -0.11 -0.26 0.00 -0.22 0.00 0.00 54.13 53.85 1v3x s LEU 32 Cb -0.02 -0.45 -0.02 0.00 0.50 0.00 0.00 46.19 46.20 1v3x s LEU 32 CO 0.16 -0.14 0.87 -0.76 -1.32 0.00 0.00 176.35 175.17 1v3x s LEU 33 N 1.55 4.21 -0.05 -0.68 1.43 0.09 -0.63 118.68 124.60 1v3x s LEU 33 Ca -0.01 1.28 0.04 0.00 -1.03 0.00 0.00 54.13 54.41 1v3x s LEU 33 Cb -0.13 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1v3x s LEU 33 CO -0.03 -0.38 -0.17 0.27 0.23 0.00 0.00 176.35 176.26 1v3x s ILE 34 N 1.95 2.80 0.88 -0.59 -4.36 0.78 -1.56 121.20 121.11 1v3x s ILE 34 Ca 0.41 -0.81 -0.14 0.00 -0.26 0.00 0.00 60.65 59.85 1v3x s ILE 34 Cb -0.17 -2.08 0.14 0.00 1.25 0.00 0.00 42.46 41.59 1v3x s ILE 34 CO 0.15 0.58 1.24 0.54 0.24 0.00 0.00 174.94 177.69 1v3x s ASN 35 N -0.55 3.85 0.57 4.36 2.20 -0.29 -1.00 114.94 124.09 1v3x s ASN 35 Ca 0.08 0.56 0.28 0.00 -0.94 0.00 0.00 52.86 52.83 1v3x s ASN 35 Cb -0.11 -0.85 1.51 0.00 -2.00 0.00 0.00 41.25 39.80 1v3x s ASN 35 CO 0.01 -2.30 1.98 -0.33 -2.94 0.00 0.00 177.10 173.52 1v3x h GLU 36 N -1.34 0.00 0.00 3.55 5.08 -1.90 0.93 114.58 120.91 1v3x h GLU 36 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1v3x h GLU 36 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1v3x h GLU 36 CO 0.53 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.93 1v3x n GLU 37 N -3.91 0.89 -2.88 2.33 1.02 -1.26 -4.90 120.64 111.93 1v3x n GLU 37 Ca 0.07 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 57.03 1v3x n GLU 37 Cb 0.56 -1.39 0.03 0.00 -0.02 0.00 0.00 31.44 30.62 1v3x n GLU 37 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1v3x n ASN 38 N -0.89 -5.27 -4.27 1.62 5.15 0.32 -5.00 115.26 106.92 1v3x n ASN 38 Ca 0.17 -0.24 -0.32 0.00 -0.60 0.00 0.00 54.58 53.59 1v3x n ASN 38 Cb 0.08 -4.11 -0.16 0.00 -0.53 0.00 0.00 39.78 35.06 1v3x n ASN 38 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1v3x s GLU 39 N -5.48 2.82 0.14 1.20 8.01 -1.25 -4.86 118.70 119.29 1v3x s GLU 39 Ca 0.25 -0.86 -0.31 0.00 0.01 0.00 0.00 54.97 54.05 1v3x s GLU 39 Cb -0.11 -2.27 -0.10 0.00 -4.31 0.00 0.00 34.13 27.34 1v3x s GLU 39 CO 0.31 0.30 1.67 0.20 0.01 0.00 0.00 175.26 177.75 1v3x s GLY 40 N 0.06 1.45 -0.00 -1.39 0.00 -1.26 -1.13 107.32 105.04 1v3x s GLY 40 Ca -0.10 1.39 0.03 0.00 0.00 0.00 0.00 44.72 46.05 1v3x s GLY 40 CO 0.06 2.84 0.11 1.97 0.00 0.00 0.00 173.10 178.08 1v3x n PHE 41 N 4.70 0.00 -3.71 1.90 1.16 -0.60 -4.94 117.46 115.97 1v3x n PHE 41 Ca 0.15 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.65 1v3x n PHE 41 Cb 0.38 -0.04 -0.02 0.00 -1.61 0.00 0.00 39.48 38.19 1v3x n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1v3x s GLY 43 N -2.86 1.94 0.30 0.00 0.00 0.12 -0.73 107.32 106.10 1v3x s GLY 43 Ca 0.08 -1.85 -0.11 0.00 0.00 0.00 0.00 44.72 42.85 1v3x s GLY 43 CO -0.00 -1.66 0.55 -0.32 0.00 0.00 0.00 173.10 171.67 1v3x s GLY 44 N -4.43 0.74 -0.09 0.20 0.00 -0.27 -3.42 107.32 100.05 1v3x s GLY 44 Ca 0.54 -1.01 0.04 0.00 0.00 0.00 0.00 44.72 44.30 1v3x s GLY 44 CO 0.33 -0.65 -0.23 -1.59 0.00 0.00 0.00 173.10 170.96 1v3x s THR 45 N -3.44 2.17 -0.02 0.90 2.01 0.18 -1.22 115.64 116.23 1v3x s THR 45 Ca 0.23 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 1v3x s THR 45 Cb -0.02 -1.82 -0.05 0.00 0.01 0.00 0.00 72.50 70.62 1v3x s THR 45 CO 0.13 0.56 1.37 -0.63 -0.69 0.00 0.00 174.62 175.36 1v3x s ILE 46 N 0.14 3.82 -0.11 1.82 1.01 0.78 -0.61 121.20 128.04 1v3x s ILE 46 Ca -0.12 1.18 0.11 0.00 0.00 0.00 0.00 60.65 61.82 1v3x s ILE 46 Cb -0.16 -3.76 -0.16 0.00 0.01 0.00 0.00 42.46 38.40 1v3x s ILE 46 CO 0.07 -0.01 0.07 0.18 0.00 0.00 0.00 174.94 175.24 1v3x n LEU 47 N 5.50 0.00 -3.84 2.97 4.77 -0.25 -1.50 117.00 124.66 1v3x n LEU 47 Ca 0.13 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.08 1v3x n LEU 47 Cb 0.44 0.27 0.01 0.00 -2.33 0.00 0.00 43.42 41.81 1v3x n LEU 47 CO 0.58 0.27 0.83 -0.94 -1.33 0.00 0.00 177.39 176.80 1v3x s SER 48 N -4.41 -0.04 0.52 -1.43 1.04 -1.16 -4.73 113.70 103.49 1v3x s SER 48 Ca -0.06 -0.54 0.24 0.00 0.48 0.00 0.00 55.95 56.07 1v3x s SER 48 Cb 0.04 0.45 1.37 0.00 0.10 0.00 0.00 66.02 67.98 1v3x s SER 48 CO 0.51 -0.88 2.00 1.05 0.98 0.00 0.00 173.24 176.90 1v3x h GLU 49 N 2.00 0.02 0.00 4.02 4.11 -1.98 -2.85 114.58 119.90 1v3x h GLU 49 Ca -0.27 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 1v3x h GLU 49 Cb 1.22 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1v3x h GLU 49 CO 0.33 0.01 -0.98 1.19 0.07 0.00 0.00 179.01 179.63 1v3x n PHE 50 N -4.40 0.00 -4.84 2.06 3.72 -1.26 -0.16 117.46 112.58 1v3x n PHE 50 Ca 0.09 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.23 1v3x n PHE 50 Cb 0.56 -0.08 -0.16 0.00 -0.94 0.00 0.00 39.48 38.86 1v3x n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1v3x s TYR 51 N -2.66 1.68 -0.08 1.38 1.51 -1.08 -0.54 117.35 117.56 1v3x s TYR 51 Ca 0.03 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.71 1v3x s TYR 51 Cb 0.12 -1.12 -0.01 0.00 -0.11 0.00 0.00 41.96 40.84 1v3x s TYR 51 CO 0.67 -0.13 -0.24 0.42 -1.11 0.00 0.00 175.55 175.16 1v3x s ILE 52 N -0.09 2.07 -0.09 2.71 -1.09 -0.43 -1.09 121.20 123.19 1v3x s ILE 52 Ca -0.01 -1.04 -0.14 0.00 -2.23 0.00 0.00 60.65 57.23 1v3x s ILE 52 Cb -0.10 -1.76 -0.05 0.00 -1.58 0.00 0.00 42.46 38.97 1v3x s ILE 52 CO 0.01 0.57 0.36 -0.22 -1.23 0.00 0.00 174.94 174.43 1v3x s LEU 53 N 0.06 4.35 0.00 2.97 2.96 0.22 -0.57 118.68 128.66 1v3x s LEU 53 Ca -0.10 0.73 -0.01 0.00 -0.22 0.00 0.00 54.13 54.53 1v3x s LEU 53 Cb -0.16 -2.48 0.00 0.00 0.50 0.00 0.00 46.19 44.05 1v3x s LEU 53 CO 0.06 0.19 0.11 1.07 -1.32 0.00 0.00 176.35 176.46 1v3x n THR 54 N 2.80 0.00 -3.75 3.68 5.66 -0.17 0.52 114.28 123.02 1v3x n THR 54 Ca -0.12 -0.35 -0.36 0.00 -3.05 0.00 0.00 64.05 60.16 1v3x n THR 54 Cb 0.52 0.23 -0.07 0.00 -1.55 0.00 0.00 70.33 69.46 1v3x n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1v3x s ALA 55 N -1.76 3.76 0.37 1.79 0.00 -1.26 -1.02 121.76 123.65 1v3x s ALA 55 Ca 0.06 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.50 1v3x s ALA 55 Cb -0.00 -2.13 0.81 0.00 0.00 0.00 0.00 23.12 21.80 1v3x s ALA 55 CO 0.04 0.39 1.94 0.00 0.00 0.00 0.00 175.76 178.13 1v3x h ALA 56 N 5.74 1.79 0.00 0.00 0.00 -1.74 -1.34 119.26 123.72 1v3x h ALA 56 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1v3x h ALA 56 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1v3x h ALA 56 CO 0.67 0.07 0.00 -2.39 0.00 0.00 0.00 179.25 177.60 1v3x n HIS 57 N -4.49 0.59 0.14 0.00 1.44 -1.26 -1.86 115.22 109.77 1v3x n HIS 57 Ca 0.12 0.26 0.01 0.00 -2.01 0.00 0.00 57.72 56.09 1v3x n HIS 57 Cb 0.30 -0.92 0.12 0.00 0.12 0.00 0.00 29.99 29.61 1v3x n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1v3x h LEU 59 N 0.00 0.00 -1.01 0.00 3.38 -1.49 0.08 115.31 116.27 1v3x h LEU 59 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1v3x h LEU 59 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1v3x h LEU 59 CO 0.08 0.00 -0.10 -1.22 0.09 0.00 0.00 178.44 177.29 1v3x n TYR 60 N -2.48 0.00 1.32 1.13 4.02 -1.18 -4.15 117.16 115.82 1v3x n TYR 60 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.03 1v3x n TYR 60 Cb 0.16 -0.03 0.62 0.00 -0.02 0.00 0.00 39.34 40.07 1v3x n TYR 60 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1v3x n GLN 61 N 0.15 0.45 -3.64 -0.72 1.13 0.01 -4.89 117.38 109.88 1v3x n GLN 61 Ca 0.16 -0.11 -0.06 0.00 -1.94 0.00 0.00 57.00 55.05 1v3x n GLN 61 Cb 0.40 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 29.19 1v3x n GLN 61 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1v3x s ALA 61 N -2.62 -2.10 -0.00 -1.58 0.00 -1.26 -5.07 121.76 109.13 1v3x s ALA 61 Ca 0.25 1.77 -0.20 0.00 0.00 0.00 0.00 51.96 53.77 1v3x s ALA 61 Cb 0.20 -1.56 -0.23 0.00 0.00 0.00 0.00 23.12 21.53 1v3x s ALA 61 CO 0.50 -0.18 1.10 0.87 0.00 0.00 0.00 175.76 178.05 1v3x h LYS 62 N 3.48 0.38 -5.61 0.00 1.57 -1.90 -3.44 116.57 111.06 1v3x h LYS 62 Ca -0.26 -0.39 -0.63 0.00 -1.87 0.00 0.00 60.65 57.49 1v3x h LYS 62 Cb 1.19 0.11 -0.32 0.00 0.08 0.00 0.00 32.23 33.29 1v3x h LYS 62 CO 0.16 1.06 -0.86 0.50 -0.57 0.00 0.00 179.45 179.74 1v3x s ARG 63 N -3.26 2.28 0.18 3.15 3.52 -1.26 -5.13 118.95 118.43 1v3x s ARG 63 Ca -0.14 -0.77 -0.12 0.00 -0.13 0.00 0.00 55.73 54.57 1v3x s ARG 63 Cb 0.03 -1.91 0.01 0.00 -1.56 0.00 0.00 34.95 31.52 1v3x s ARG 63 CO 0.81 0.29 0.38 -0.59 -0.81 0.00 0.00 175.30 175.38 1v3x s PHE 64 N -0.00 0.20 0.42 5.12 -0.12 -1.26 -3.81 117.98 118.53 1v3x s PHE 64 Ca -0.06 -0.56 0.04 0.00 -0.05 0.00 0.00 56.93 56.30 1v3x s PHE 64 Cb -0.13 0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 1v3x s PHE 64 CO 0.04 -0.80 0.06 0.15 -0.05 0.00 0.00 175.22 174.61 1v3x s LYS 65 N -3.93 1.95 -0.15 1.99 1.02 -0.17 -4.47 119.74 115.97 1v3x s LYS 65 Ca 0.14 -2.17 0.00 0.00 0.02 0.00 0.00 55.97 53.96 1v3x s LYS 65 Cb 0.02 -1.11 -0.00 0.00 -0.52 0.00 0.00 37.83 36.21 1v3x s LYS 65 CO -0.01 -0.30 -0.15 0.08 -0.92 0.00 0.00 175.35 174.05 1v3x s VAL 66 N -3.05 2.74 -0.18 3.17 1.01 -0.43 -0.15 120.40 123.51 1v3x s VAL 66 Ca 0.23 -0.75 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1v3x s VAL 66 Cb 0.05 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1v3x s VAL 66 CO 0.12 0.51 0.07 -0.60 0.00 0.00 0.00 175.10 175.21 1v3x s ARG 67 N 0.76 3.97 0.32 2.72 3.52 0.20 0.14 118.95 130.58 1v3x s ARG 67 Ca -0.06 -0.32 0.10 0.00 -0.13 0.00 0.00 55.73 55.32 1v3x s ARG 67 Cb -0.15 -3.23 -0.06 0.00 -1.56 0.00 0.00 34.95 29.95 1v3x s ARG 67 CO 0.01 0.31 -0.09 0.14 -0.81 0.00 0.00 175.30 174.85 1v3x s VAL 68 N 0.29 2.47 -0.05 7.11 -7.23 -0.48 -0.50 120.40 122.01 1v3x s VAL 68 Ca 0.04 -2.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.03 1v3x s VAL 68 Cb -0.12 -2.61 0.00 0.00 0.56 0.00 0.00 36.38 34.21 1v3x s VAL 68 CO -0.00 -0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1v3x n GLY 69 N -0.80 0.43 3.88 2.32 0.00 -1.25 -1.73 105.19 108.05 1v3x n GLY 69 Ca -0.05 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1v3x n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1v3x s ASP 70 N -2.11 6.47 0.00 1.61 2.15 -1.26 -3.94 116.67 119.59 1v3x s ASP 70 Ca 0.00 0.54 0.00 0.00 0.43 0.00 0.00 52.55 53.52 1v3x s ASP 70 Cb 0.00 -2.09 0.00 0.00 -0.30 0.00 0.00 42.92 40.53 1v3x s ASP 70 CO 0.00 0.34 0.00 0.54 -0.17 0.00 0.00 175.17 175.88 1v3x n ARG 71 N 1.63 2.72 -3.56 4.34 1.74 -1.26 -4.85 116.66 117.43 1v3x n ARG 71 Ca -0.16 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.68 1v3x n ARG 71 Cb 0.54 -0.73 -0.15 0.00 -1.02 0.00 0.00 32.46 31.10 1v3x n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1v3x s ASN 72 N -1.29 2.14 0.06 0.55 3.84 -1.26 -0.20 114.94 118.78 1v3x s ASN 72 Ca 0.00 -0.57 0.22 0.00 0.21 0.00 0.00 52.86 52.72 1v3x s ASN 72 Cb 0.00 -0.03 0.90 0.00 -0.55 0.00 0.00 41.25 41.57 1v3x s ASN 72 CO 0.00 -0.35 1.69 0.35 -2.79 0.00 0.00 177.10 175.99 1v3x n THR 73 N 5.29 0.60 0.21 -5.21 -2.24 -0.05 -2.67 114.28 110.22 1v3x n THR 73 Ca -0.06 0.11 0.11 0.00 -2.27 0.00 0.00 64.05 61.93 1v3x n THR 73 Cb 0.48 -0.81 0.20 0.00 -2.10 0.00 0.00 70.33 68.10 1v3x n THR 73 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1v3x h GLU 74 N 0.00 0.00 -4.83 -0.78 3.07 -1.96 -3.47 114.58 106.61 1v3x h GLU 74 Ca 0.00 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.54 1v3x h GLU 74 Cb 0.40 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 28.10 1v3x h GLU 74 CO 0.00 0.09 -0.75 -0.65 -1.40 0.00 0.00 179.01 176.30 1v3x s GLN 75 N -3.22 0.63 -0.44 2.33 1.11 -1.09 -5.11 119.66 113.86 1v3x s GLN 75 Ca 0.06 -0.83 -0.24 0.00 0.01 0.00 0.00 55.36 54.36 1v3x s GLN 75 Cb 0.06 -0.47 0.02 0.00 -1.01 0.00 0.00 33.01 31.61 1v3x s GLN 75 CO 0.67 0.09 0.84 -1.21 0.01 0.00 0.00 175.29 175.69 1v3x s GLU 76 N -1.66 3.49 0.06 2.91 8.01 -1.26 -4.76 118.70 125.49 1v3x s GLU 76 Ca -0.07 0.05 0.23 0.00 0.01 0.00 0.00 54.97 55.19 1v3x s GLU 76 Cb -0.10 -3.92 0.17 0.00 -4.31 0.00 0.00 34.13 25.97 1v3x s GLU 76 CO 0.01 -1.13 1.14 0.39 0.01 0.00 0.00 175.26 175.69 1v3x n GLU 77 N 6.85 0.26 0.00 1.61 1.02 -1.26 -4.97 120.64 124.15 1v3x n GLU 77 Ca 0.04 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1v3x n GLU 77 Cb 0.48 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1v3x n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1v3x n GLY 78 N 1.37 3.11 0.00 0.62 0.00 -1.26 -4.87 105.19 104.17 1v3x n GLY 78 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.19 1v3x n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v3x n GLY 79 N -0.81 -1.27 3.77 -0.02 0.00 -1.26 -4.94 105.19 100.67 1v3x n GLY 79 Ca 0.00 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 1v3x n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1v3x s GLU 80 N -2.57 3.92 -0.06 1.61 8.01 -1.25 -4.54 118.70 123.82 1v3x s GLU 80 Ca 0.29 1.76 -0.02 0.00 0.01 0.00 0.00 54.97 57.00 1v3x s GLU 80 Cb 0.20 -2.52 0.04 0.00 -4.31 0.00 0.00 34.13 27.54 1v3x s GLU 80 CO 0.46 -0.41 0.12 0.00 0.01 0.00 0.00 175.26 175.44 1v3x s ALA 81 N -1.52 -0.16 -0.03 5.21 0.00 -0.70 -5.00 121.76 119.57 1v3x s ALA 81 Ca 0.60 0.57 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 1v3x s ALA 81 Cb -0.28 -0.46 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1v3x s ALA 81 CO 0.35 -0.20 0.52 0.08 0.00 0.00 0.00 175.76 176.50 1v3x s VAL 82 N 1.32 5.00 -0.10 0.00 1.01 -1.26 -1.38 120.40 124.99 1v3x s VAL 82 Ca -0.07 1.07 0.02 0.00 0.00 0.00 0.00 61.98 63.00 1v3x s VAL 82 Cb -0.12 -3.85 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1v3x s VAL 82 CO -0.05 0.44 -0.15 -1.00 0.00 0.00 0.00 175.10 174.34 1v3x s HIS 83 N -0.24 1.89 0.39 5.22 3.76 0.12 -5.00 115.29 121.43 1v3x s HIS 83 Ca 0.28 -0.83 -0.26 0.00 -0.15 0.00 0.00 55.06 54.09 1v3x s HIS 83 Cb -0.17 -1.36 -0.09 0.00 1.11 0.00 0.00 32.58 32.07 1v3x s HIS 83 CO 0.15 -0.42 1.26 -1.21 -0.85 0.00 0.00 174.74 173.67 1v3x s GLU 84 N 0.84 4.05 -0.08 1.40 2.02 -1.26 -1.32 118.70 124.35 1v3x s GLU 84 Ca -0.10 2.06 -0.22 0.00 0.02 0.00 0.00 54.97 56.73 1v3x s GLU 84 Cb -0.15 -2.78 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 1v3x s GLU 84 CO 0.01 -0.39 0.63 0.08 0.02 0.00 0.00 175.26 175.61 1v3x s VAL 85 N -1.29 5.09 -0.23 2.63 1.01 -1.26 -1.08 120.40 125.27 1v3x s VAL 85 Ca 0.56 1.30 -0.12 0.00 0.00 0.00 0.00 61.98 63.72 1v3x s VAL 85 Cb -0.36 -3.97 -0.17 0.00 0.00 0.00 0.00 36.38 31.88 1v3x s VAL 85 CO 0.46 0.27 -0.07 1.21 0.00 0.00 0.00 175.10 176.97 1v3x n GLU 86 N 3.74 0.62 -4.41 2.72 2.13 0.47 -4.75 120.64 121.16 1v3x n GLU 86 Ca -0.03 0.32 -0.21 0.00 0.66 0.00 0.00 57.16 57.90 1v3x n GLU 86 Cb 0.51 -1.60 -0.16 0.00 0.27 0.00 0.00 31.44 30.47 1v3x n GLU 86 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1v3x s VAL 87 N -2.48 0.83 -0.27 6.31 1.01 -0.91 -4.99 120.40 119.89 1v3x s VAL 87 Ca -0.33 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 1v3x s VAL 87 Cb 0.10 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1v3x s VAL 87 CO 0.58 0.26 0.14 -0.69 0.00 0.00 0.00 175.10 175.39 1v3x s VAL 88 N 0.30 4.80 -0.56 2.92 1.01 -1.26 -0.59 120.40 127.01 1v3x s VAL 88 Ca -0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.80 1v3x s VAL 88 Cb -0.10 -3.30 0.15 0.00 0.00 0.00 0.00 36.38 33.12 1v3x s VAL 88 CO 0.01 0.25 0.40 -0.63 0.00 0.00 0.00 175.10 175.13 1v3x s ILE 89 N 1.68 3.98 0.13 2.22 1.01 0.67 -5.02 121.20 125.87 1v3x s ILE 89 Ca 0.06 -2.40 -0.23 0.00 0.00 0.00 0.00 60.65 58.08 1v3x s ILE 89 Cb -0.16 -3.61 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 1v3x s ILE 89 CO 0.07 -0.83 0.71 -0.75 0.00 0.00 0.00 174.94 174.14 1v3x s LYS 90 N 0.60 4.45 0.12 2.79 2.20 -1.26 -1.15 119.74 127.48 1v3x s LYS 90 Ca 0.12 1.02 -0.31 0.00 -0.36 0.00 0.00 55.97 56.44 1v3x s LYS 90 Cb -0.21 -3.26 -0.09 0.00 -1.51 0.00 0.00 37.83 32.76 1v3x s LYS 90 CO -0.03 0.59 1.62 -1.58 -0.36 0.00 0.00 175.35 175.58 1v3x s HIS 91 N -1.12 2.72 0.43 4.03 5.65 -0.57 -4.86 115.29 121.56 1v3x s HIS 91 Ca 0.33 0.46 0.25 0.00 0.25 0.00 0.00 55.06 56.36 1v3x s HIS 91 Cb -0.22 -3.95 1.39 0.00 -1.18 0.00 0.00 32.58 28.62 1v3x s HIS 91 CO 0.24 -3.67 2.07 -2.95 -0.65 0.00 0.00 174.74 169.77 1v3x h ASN 92 N 7.61 0.00 -0.18 9.88 -1.07 -1.92 -2.59 115.58 127.31 1v3x h ASN 92 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.94 1v3x h ASN 92 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 1v3x h ASN 92 CO 0.92 0.13 0.00 0.54 0.07 0.00 0.00 177.43 179.09 1v3x n ARG 93 N -3.76 1.60 -1.87 4.14 1.74 -1.26 -4.93 116.66 112.32 1v3x n ARG 93 Ca -0.02 -0.91 -0.41 0.00 -0.77 0.00 0.00 57.85 55.74 1v3x n ARG 93 Cb 0.23 -1.32 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1v3x n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1v3x s PHE 94 N -1.77 2.81 -0.13 -1.55 5.36 -0.98 -4.64 117.98 117.08 1v3x s PHE 94 Ca 0.27 0.97 -0.00 0.00 -0.96 0.00 0.00 56.93 57.21 1v3x s PHE 94 Cb 0.14 -3.97 0.03 0.00 -0.34 0.00 0.00 43.02 38.88 1v3x s PHE 94 CO 0.21 -3.11 -0.08 0.99 -1.46 0.00 0.00 175.22 171.78 1v3x s THR 95 N -0.32 1.12 0.42 0.12 2.01 -0.93 -5.00 115.64 113.06 1v3x s THR 95 Ca 0.59 -0.41 0.34 0.00 0.31 0.00 0.00 61.69 62.52 1v3x s THR 95 Cb -0.45 -1.16 0.36 0.00 0.01 0.00 0.00 72.50 71.26 1v3x s THR 95 CO 0.50 0.32 2.15 0.07 -0.69 0.00 0.00 174.62 176.97 1v3x h LYS 96 N 8.15 0.00 0.13 4.92 -0.00 -1.95 0.27 116.57 128.09 1v3x h LYS 96 Ca -0.29 0.00 -0.30 0.00 -0.00 0.00 0.00 60.65 60.06 1v3x h LYS 96 Cb 1.13 0.00 0.03 0.00 -0.00 0.00 0.00 32.23 33.38 1v3x h LYS 96 CO 0.42 0.05 -1.26 1.05 -0.00 0.00 0.00 179.45 179.71 1v3x h GLU 97 N 0.00 0.58 -0.00 0.07 9.09 -1.97 -3.32 114.58 119.04 1v3x h GLU 97 Ca -0.00 -0.80 0.00 0.00 0.05 0.00 0.00 59.36 58.61 1v3x h GLU 97 Cb 0.27 0.27 0.00 0.00 -1.65 0.00 0.00 28.75 27.64 1v3x h GLU 97 CO 0.01 1.36 -0.53 0.25 0.05 0.00 0.00 179.01 180.15 1v3x n THR 98 N -3.76 0.00 -2.08 -1.06 -2.24 -1.18 -4.97 114.28 98.99 1v3x n THR 98 Ca -0.13 -0.23 -0.17 0.00 -2.27 0.00 0.00 64.05 61.24 1v3x n THR 98 Cb 1.00 1.08 -0.03 0.00 -2.10 0.00 0.00 70.33 70.27 1v3x n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1v3x n TYR 99 N -0.83 -0.83 -1.74 4.78 4.02 0.94 -4.98 117.16 118.52 1v3x n TYR 99 Ca 0.04 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.60 1v3x n TYR 99 Cb 0.27 -3.26 0.05 0.00 -0.02 0.00 0.00 39.34 36.38 1v3x n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1v3x s ASP 100 N -2.18 4.98 -1.40 7.72 2.15 -1.19 -3.49 116.67 123.26 1v3x s ASP 100 Ca 0.00 2.09 -0.02 0.00 0.43 0.00 0.00 52.55 55.05 1v3x s ASP 100 Cb 0.00 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 40.07 1v3x s ASP 100 CO 0.00 -1.72 0.56 0.49 -0.17 0.00 0.00 175.17 174.33 1v3x n PHE 101 N -2.37 -1.77 -2.60 -5.34 3.72 -1.26 -2.19 117.46 105.64 1v3x n PHE 101 Ca 0.11 0.79 -0.43 0.00 -0.05 0.00 0.00 57.45 57.87 1v3x n PHE 101 Cb 0.51 -3.92 0.00 0.00 -0.94 0.00 0.00 39.48 35.14 1v3x n PHE 101 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1v3x n ASP 102 N -2.98 4.97 -3.69 4.37 2.03 -1.23 -4.23 116.55 115.80 1v3x n ASP 102 Ca -0.27 -2.97 -0.11 0.00 0.52 0.00 0.00 54.79 51.97 1v3x n ASP 102 Cb 0.66 -1.62 -0.09 0.00 -0.72 0.00 0.00 41.12 39.35 1v3x n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1v3x s ILE 103 N 2.33 -0.01 0.01 5.18 2.07 -1.26 -4.23 121.20 125.29 1v3x s ILE 103 Ca 0.46 0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.69 1v3x s ILE 103 Cb 0.03 -0.72 -0.00 0.00 0.13 0.00 0.00 42.46 41.90 1v3x s ILE 103 CO 0.02 0.02 0.09 0.00 -1.91 0.00 0.00 174.94 173.15 1v3x s ALA 104 N 1.00 -0.20 -0.03 1.50 0.00 -0.19 -1.52 121.76 122.32 1v3x s ALA 104 Ca -0.06 -0.27 0.07 0.00 0.00 0.00 0.00 51.96 51.70 1v3x s ALA 104 Cb -0.06 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1v3x s ALA 104 CO -0.09 -0.20 -0.25 0.08 0.00 0.00 0.00 175.76 175.30 1v3x s VAL 105 N -1.43 2.02 -0.18 0.00 1.01 -0.30 -0.99 120.40 120.53 1v3x s VAL 105 Ca -0.15 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 60.73 1v3x s VAL 105 Cb -0.08 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1v3x s VAL 105 CO 0.01 0.57 -0.06 -0.76 0.00 0.00 0.00 175.10 174.85 1v3x s LEU 106 N -0.44 2.96 -0.21 3.92 1.43 0.27 -0.24 118.68 126.37 1v3x s LEU 106 Ca 0.05 -0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 1v3x s LEU 106 Cb -0.11 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 1v3x s LEU 106 CO 0.01 0.09 0.17 -0.60 0.23 0.00 0.00 176.35 176.25 1v3x s ARG 107 N 0.82 4.16 0.25 1.70 3.52 0.24 -1.32 118.95 128.33 1v3x s ARG 107 Ca -0.02 -0.18 -0.17 0.00 -0.13 0.00 0.00 55.73 55.23 1v3x s ARG 107 Cb -0.15 -3.46 -0.08 0.00 -1.56 0.00 0.00 34.95 29.70 1v3x s ARG 107 CO 0.01 0.21 0.71 -0.51 -0.81 0.00 0.00 175.30 174.91 1v3x s LEU 108 N 0.62 4.23 0.11 -0.88 1.02 0.30 -0.40 118.68 123.69 1v3x s LEU 108 Ca 0.09 1.32 -0.26 0.00 0.02 0.00 0.00 54.13 55.30 1v3x s LEU 108 Cb -0.12 -3.75 -0.07 0.00 0.02 0.00 0.00 46.19 42.26 1v3x s LEU 108 CO 0.01 -0.06 1.65 0.07 0.02 0.00 0.00 176.35 178.04 1v3x h LYS 109 N 2.95 -0.39 -6.49 1.70 -0.00 -1.40 -3.43 116.57 109.52 1v3x h LYS 109 Ca -0.48 0.03 -0.68 0.00 -0.00 0.00 0.00 60.65 59.51 1v3x h LYS 109 Cb 1.19 0.09 -0.21 0.00 -0.00 0.00 0.00 32.23 33.29 1v3x h LYS 109 CO 0.65 -0.26 -0.78 0.95 -0.00 0.00 0.00 179.45 180.01 1v3x s THR 110 N -6.08 2.97 0.46 0.07 -4.23 -1.26 -5.03 115.64 102.54 1v3x s THR 110 Ca -0.15 -1.04 -0.23 0.00 -1.18 0.00 0.00 61.69 59.09 1v3x s THR 110 Cb 0.08 -2.24 -0.07 0.00 1.34 0.00 0.00 72.50 71.61 1v3x s THR 110 CO 0.66 0.39 1.22 -2.16 -0.54 0.00 0.00 174.62 174.19 1v3x s PRO 111 N -1.31 3.70 0.13 3.99 0.04 -1.26 -4.89 135.00 135.40 1v3x s PRO 111 Ca 0.15 1.93 -0.30 0.00 0.04 0.00 0.00 61.00 62.82 1v3x s PRO 111 Cb -0.11 -2.46 -0.07 0.00 0.04 0.00 0.00 34.50 31.91 1v3x s PRO 111 CO 0.05 -0.64 1.09 0.42 0.04 0.00 0.00 177.00 177.95 1v3x s ILE 112 N -1.44 4.06 -0.41 0.56 1.01 0.77 -5.00 121.20 120.75 1v3x s ILE 112 Ca 0.63 1.68 -0.19 0.00 0.00 0.00 0.00 60.65 62.78 1v3x s ILE 112 Cb -0.33 -4.08 0.02 0.00 0.01 0.00 0.00 42.46 38.09 1v3x s ILE 112 CO 0.40 0.24 0.53 -0.89 0.00 0.00 0.00 174.94 175.23 1v3x s THR 113 N 0.12 4.97 0.42 2.92 2.01 -1.26 -4.71 115.64 120.11 1v3x s THR 113 Ca 0.51 -0.03 -0.25 0.00 0.31 0.00 0.00 61.69 62.23 1v3x s THR 113 Cb -0.28 -4.09 -0.08 0.00 0.01 0.00 0.00 72.50 68.06 1v3x s THR 113 CO 0.33 -0.45 1.28 -0.36 -0.69 0.00 0.00 174.62 174.73 1v3x s PHE 114 N 2.46 2.82 0.00 4.92 0.08 -1.26 -4.92 117.98 122.07 1v3x s PHE 114 Ca 0.17 1.44 0.00 0.00 0.12 0.00 0.00 56.93 58.66 1v3x s PHE 114 Cb -0.16 -3.62 0.00 0.00 -0.57 0.00 0.00 43.02 38.68 1v3x s PHE 114 CO 0.16 -2.00 0.00 2.89 -0.10 0.00 0.00 175.22 176.17 1v3x n ARG 115 N -0.01 0.00 -1.69 0.44 1.85 -0.38 -5.00 116.66 111.87 1v3x n ARG 115 Ca 0.05 0.00 -0.44 0.00 -1.00 0.00 0.00 57.85 56.46 1v3x n ARG 115 Cb 0.44 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.84 1v3x n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1v3x n MET 116 N 0.00 2.13 -0.83 2.89 0.00 -1.26 -0.67 117.12 119.37 1v3x n MET 116 Ca 0.00 0.75 0.00 0.00 -0.00 0.00 0.00 57.70 58.45 1v3x n MET 116 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 33.22 30.83 1v3x n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1v3x n ASN 117 N 1.62 -3.22 -3.70 6.12 3.02 -1.26 -4.96 115.26 112.88 1v3x n ASN 117 Ca 0.09 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.36 1v3x n ASN 117 Cb 0.34 -2.61 -0.16 0.00 -0.61 0.00 0.00 39.78 36.73 1v3x n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1v3x s VAL 118 N -1.31 0.45 -0.11 2.41 1.01 0.15 -3.78 120.40 119.21 1v3x s VAL 118 Ca 0.00 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 1v3x s VAL 118 Cb 0.00 -1.08 0.12 0.00 0.00 0.00 0.00 36.38 35.42 1v3x s VAL 118 CO 0.00 -0.35 0.94 0.00 0.00 0.00 0.00 175.10 175.70 1v3x s ALA 119 N 1.88 -1.89 0.42 5.51 0.00 -0.79 -1.25 121.76 125.64 1v3x s ALA 119 Ca 0.02 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 1v3x s ALA 119 Cb -0.17 -0.35 -0.06 0.00 0.00 0.00 0.00 23.12 22.53 1v3x s ALA 119 CO -0.14 -0.41 0.80 -1.25 0.00 0.00 0.00 175.76 174.76 1v3x s PRO 120 N -1.64 3.79 0.37 0.00 0.04 -1.26 -2.24 135.00 134.06 1v3x s PRO 120 Ca -0.01 0.52 -0.09 0.00 0.04 0.00 0.00 61.00 61.47 1v3x s PRO 120 Cb -0.01 -2.35 -0.06 0.00 0.04 0.00 0.00 34.50 32.12 1v3x s PRO 120 CO -0.00 -0.08 0.71 0.00 0.04 0.00 0.00 177.00 177.66 1v3x s ALA 121 N -2.43 3.43 0.23 8.56 0.00 -0.56 -4.84 121.76 126.15 1v3x s ALA 121 Ca 0.52 -0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.88 1v3x s ALA 121 Cb -0.10 -2.59 -0.09 0.00 0.00 0.00 0.00 23.12 20.34 1v3x s ALA 121 CO 0.32 0.06 0.91 0.00 0.00 0.00 0.00 175.76 177.05 1v3x s LEU 123 N -1.21 4.28 0.60 0.00 1.43 -1.26 -0.34 118.68 122.19 1v3x s LEU 123 Ca 0.40 1.40 -0.04 0.00 -1.03 0.00 0.00 54.13 54.87 1v3x s LEU 123 Cb -0.25 -3.37 0.03 0.00 0.03 0.00 0.00 46.19 42.62 1v3x s LEU 123 CO 0.31 -0.30 0.88 -2.16 0.23 0.00 0.00 176.35 175.31 1v3x s PRO 124 N 1.47 2.66 0.28 1.29 0.04 -1.26 -4.98 135.00 134.49 1v3x s PRO 124 Ca 0.44 -0.27 -0.23 0.00 0.04 0.00 0.00 61.00 60.99 1v3x s PRO 124 Cb -0.19 -2.31 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 1v3x s PRO 124 CO 0.20 -0.81 0.84 -1.21 0.04 0.00 0.00 177.00 176.06 1v3x s GLU 124 N -4.97 4.40 0.07 4.56 2.02 -1.26 -4.98 118.70 118.53 1v3x s GLU 124 Ca 0.56 1.09 -0.30 0.00 0.02 0.00 0.00 54.97 56.34 1v3x s GLU 124 Cb -0.10 -2.79 -0.14 0.00 0.10 0.00 0.00 34.13 31.19 1v3x s GLU 124 CO 0.43 0.31 1.46 -0.09 0.02 0.00 0.00 175.26 177.39 1v3x h ARG 125 N 3.18 -0.79 -0.34 1.61 2.43 -1.98 -1.01 114.38 117.48 1v3x h ARG 125 Ca -0.47 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.77 1v3x h ARG 125 Cb 1.19 0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.89 1v3x h ARG 125 CO 0.65 -0.53 0.18 -0.44 -1.51 0.00 0.00 179.97 178.32 1v3x h ASP 126 N -0.82 0.28 -0.52 -3.80 3.32 -1.95 -0.58 116.42 112.34 1v3x h ASP 126 Ca -0.05 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1v3x h ASP 126 Cb 0.72 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 1v3x h ASP 126 CO -0.07 0.21 0.30 -0.25 -1.72 0.00 0.00 179.24 177.71 1v3x h TRP 127 N 0.37 0.70 -0.75 4.55 7.01 -1.99 -2.16 115.95 123.68 1v3x h TRP 127 Ca 0.14 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.11 1v3x h TRP 127 Cb 0.03 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 26.83 1v3x h TRP 127 CO -0.09 0.50 0.38 0.00 -2.79 0.00 0.00 178.44 176.44 1v3x h ALA 128 N 1.14 0.97 -0.07 2.65 0.00 -0.59 0.40 119.26 123.76 1v3x h ALA 128 Ca 0.19 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1v3x h ALA 128 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1v3x h ALA 128 CO -0.03 0.51 -0.74 0.93 0.00 0.00 0.00 179.25 179.92 1v3x h GLU 129 N 1.05 0.38 0.20 0.00 5.08 -1.01 0.61 114.58 120.89 1v3x h GLU 129 Ca 0.26 -0.32 -0.32 0.00 -1.00 0.00 0.00 59.36 57.99 1v3x h GLU 129 Cb 0.09 0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.43 1v3x h GLU 129 CO -0.04 0.96 -1.43 1.03 -1.00 0.00 0.00 179.01 178.54 1v3x h SER 130 N 0.25 0.66 0.00 1.42 0.87 -1.22 -3.36 113.55 112.18 1v3x h SER 130 Ca -0.03 -0.74 -0.23 0.00 -1.23 0.00 0.00 61.79 59.56 1v3x h SER 130 Cb 1.32 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 63.03 1v3x h SER 130 CO 0.13 1.58 -1.75 0.41 -0.53 0.00 0.00 176.83 176.67 1v3x n THR 131 N -3.63 0.79 0.05 2.23 -1.04 0.14 -4.46 114.28 108.35 1v3x n THR 131 Ca -0.15 -0.18 -0.13 0.00 -2.04 0.00 0.00 64.05 61.55 1v3x n THR 131 Cb 1.07 -1.70 -0.09 0.00 -1.82 0.00 0.00 70.33 67.80 1v3x n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1v3x h LEU 131 N -0.51 -0.08 -0.27 -4.42 3.38 -1.10 -3.27 115.31 109.03 1v3x h LEU 131 Ca -0.35 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1v3x h LEU 131 Cb 1.29 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1v3x h LEU 131 CO -0.21 0.21 0.00 0.23 0.09 0.00 0.00 178.44 178.76 1v3x n MET 131 N -5.00 1.19 -0.12 1.13 2.81 0.04 -1.88 117.12 115.29 1v3x n MET 131 Ca -0.08 -0.27 0.08 0.00 -1.81 0.00 0.00 57.70 55.62 1v3x n MET 131 Cb 0.18 -1.49 0.14 0.00 -0.71 0.00 0.00 33.22 31.35 1v3x n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1v3x n THR 132 N -0.66 0.46 -1.38 2.03 -2.24 -1.24 -4.98 114.28 106.27 1v3x n THR 132 Ca 0.22 -0.73 -0.29 0.00 -2.27 0.00 0.00 64.05 60.99 1v3x n THR 132 Cb 0.18 0.96 0.15 0.00 -2.10 0.00 0.00 70.33 69.52 1v3x n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1v3x s GLN 133 N -1.20 0.84 0.12 -0.78 -1.52 -0.79 -4.96 119.66 111.37 1v3x s GLN 133 Ca 0.26 0.38 -0.16 0.00 -1.95 0.00 0.00 55.36 53.90 1v3x s GLN 133 Cb 0.16 -1.80 -0.02 0.00 -0.22 0.00 0.00 33.01 31.13 1v3x s GLN 133 CO 0.22 -2.42 1.62 -0.22 -0.25 0.00 0.00 175.29 174.23 1v3x h LYS 134 N -1.67 0.61 -4.40 2.91 3.64 -1.94 -3.42 116.57 112.31 1v3x h LYS 134 Ca -0.52 -0.15 -0.20 0.00 -1.27 0.00 0.00 60.65 58.51 1v3x h LYS 134 Cb 1.33 -0.08 -0.18 0.00 -0.41 0.00 0.00 32.23 32.90 1v3x h LYS 134 CO 0.60 0.65 -0.70 0.95 -2.27 0.00 0.00 179.45 178.68 1v3x s THR 135 N -5.28 0.42 0.51 1.00 -4.23 -1.26 -1.80 115.64 105.00 1v3x s THR 135 Ca -0.13 -1.50 0.02 0.00 -1.18 0.00 0.00 61.69 58.90 1v3x s THR 135 Cb 0.10 -1.11 -0.01 0.00 1.34 0.00 0.00 72.50 72.81 1v3x s THR 135 CO 0.76 -0.72 0.05 -0.83 -0.54 0.00 0.00 174.62 173.35 1v3x s GLY 136 N -2.36 2.91 -0.12 3.99 0.00 -0.45 -4.72 107.32 106.58 1v3x s GLY 136 Ca 0.00 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.14 1v3x s GLY 136 CO -0.04 -2.16 -0.17 -0.42 0.00 0.00 0.00 173.10 170.31 1v3x s ILE 137 N -2.85 1.63 0.07 0.90 -1.09 0.12 -0.13 121.20 119.84 1v3x s ILE 137 Ca 0.11 -0.72 0.05 0.00 -2.23 0.00 0.00 60.65 57.86 1v3x s ILE 137 Cb 0.02 -1.47 -0.04 0.00 -1.58 0.00 0.00 42.46 39.38 1v3x s ILE 137 CO 0.06 0.47 -0.04 0.54 -1.23 0.00 0.00 174.94 174.73 1v3x s VAL 138 N 0.97 3.75 0.04 2.92 0.11 -0.54 -0.14 120.40 127.52 1v3x s VAL 138 Ca -0.06 -1.00 -0.07 0.00 -2.93 0.00 0.00 61.98 57.92 1v3x s VAL 138 Cb -0.15 -2.74 -0.01 0.00 -1.53 0.00 0.00 36.38 31.96 1v3x s VAL 138 CO -0.02 0.20 0.13 -0.94 -3.33 0.00 0.00 175.10 171.14 1v3x s SER 139 N -2.02 0.13 0.00 3.54 1.04 -1.14 -0.56 113.70 114.69 1v3x s SER 139 Ca 0.22 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1v3x s SER 139 Cb -0.11 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.26 1v3x s SER 139 CO 0.14 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1v3x n GLY 140 N 0.69 0.32 0.87 7.32 0.00 0.32 -4.29 105.19 110.42 1v3x n GLY 140 Ca -0.19 -1.00 0.07 0.00 0.00 0.00 0.00 46.02 44.91 1v3x n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1v3x n PHE 141 N -0.38 0.66 -1.06 1.61 3.01 -1.26 -1.84 117.46 118.19 1v3x n PHE 141 Ca 0.00 -0.31 -0.23 0.00 1.01 0.00 0.00 57.45 57.92 1v3x n PHE 141 Cb 0.00 -0.03 0.19 0.00 -0.01 0.00 0.00 39.48 39.63 1v3x n PHE 141 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1v3x n GLY 142 N 1.12 -2.49 3.68 1.37 0.00 -1.26 -2.05 105.19 105.57 1v3x n GLY 142 Ca 0.15 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 1v3x n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v3x n ARG 143 N -3.96 1.97 0.00 1.61 1.74 0.42 -2.20 116.66 116.24 1v3x n ARG 143 Ca 0.12 0.69 0.13 0.00 -0.77 0.00 0.00 57.85 58.03 1v3x n ARG 143 Cb 0.46 -2.24 0.46 0.00 -1.02 0.00 0.00 32.46 30.12 1v3x n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1v3x n THR 144 N 0.39 0.00 -3.60 0.55 -2.24 -1.21 -1.71 114.28 106.46 1v3x n THR 144 Ca 0.06 -0.10 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 1v3x n THR 144 Cb 0.35 0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 1v3x n THR 144 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1v3x s HIS 145 N -2.49 -0.36 0.29 4.78 0.00 -1.26 -4.42 115.29 111.82 1v3x s HIS 145 Ca 0.26 0.06 -0.05 0.00 -3.00 0.00 0.00 55.06 52.33 1v3x s HIS 145 Cb 0.19 0.55 0.56 0.00 -4.00 0.00 0.00 32.58 29.89 1v3x s HIS 145 CO 0.50 -0.95 1.57 1.49 -1.00 0.00 0.00 174.74 176.35 1v3x h GLU 147 N 2.05 0.01 -0.25 -0.38 4.81 -1.89 -0.02 114.58 118.91 1v3x h GLU 147 Ca -0.29 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1v3x h GLU 147 Cb 1.28 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1v3x h GLU 147 CO 0.34 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 180.26 1v3x n LYS 148 N -5.56 2.22 -1.24 1.92 5.02 -1.26 -4.92 118.16 114.33 1v3x n LYS 148 Ca 0.18 -2.03 -0.30 0.00 -2.02 0.00 0.00 58.31 54.14 1v3x n LYS 148 Cb 0.59 -1.44 0.22 0.00 -0.02 0.00 0.00 35.03 34.38 1v3x n LYS 148 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1v3x s GLY 149 N -1.49 1.61 0.54 0.72 0.00 -0.02 -5.07 107.32 103.61 1v3x s GLY 149 Ca 0.31 -0.89 -0.16 0.00 0.00 0.00 0.00 44.72 43.98 1v3x s GLY 149 CO 0.28 -0.07 1.01 0.50 0.00 0.00 0.00 173.10 174.81 1v3x s ARG 150 N -5.41 3.76 0.77 2.90 0.52 -1.26 -4.81 118.95 115.42 1v3x s ARG 150 Ca 0.70 0.99 -0.14 0.00 -0.52 0.00 0.00 55.73 56.77 1v3x s ARG 150 Cb -0.10 -2.11 0.06 0.00 0.52 0.00 0.00 34.95 33.32 1v3x s ARG 150 CO 0.56 -0.43 1.20 -0.65 0.02 0.00 0.00 175.30 176.00 1v3x s GLN 151 N -4.18 1.88 0.32 3.54 -1.52 -1.26 -3.32 119.66 115.12 1v3x s GLN 151 Ca 0.60 1.74 -0.28 0.00 -1.95 0.00 0.00 55.36 55.47 1v3x s GLN 151 Cb -0.11 -1.81 -0.09 0.00 -0.22 0.00 0.00 33.01 30.78 1v3x s GLN 151 CO 0.35 -2.03 1.09 0.45 -0.25 0.00 0.00 175.29 174.90 1v3x s SER 152 N -2.14 7.09 0.00 5.90 0.15 -0.87 -4.84 113.70 118.99 1v3x s SER 152 Ca 0.73 2.21 0.26 0.00 0.70 0.00 0.00 55.95 59.85 1v3x s SER 152 Cb -0.28 -2.62 0.70 0.00 -1.71 0.00 0.00 66.02 62.11 1v3x s SER 152 CO 0.48 -0.26 1.54 0.35 1.20 0.00 0.00 173.24 176.55 1v3x n THR 153 N 0.79 0.00 -4.66 6.45 -2.24 -1.26 -4.76 114.28 108.60 1v3x n THR 153 Ca 0.01 -0.06 -0.34 0.00 -2.27 0.00 0.00 64.05 61.39 1v3x n THR 153 Cb 0.46 0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.83 1v3x n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1v3x s ARG 154 N -2.75 2.84 0.15 -0.78 1.81 -1.26 -0.87 118.95 118.10 1v3x s ARG 154 Ca 0.18 -0.58 -0.31 0.00 -1.72 0.00 0.00 55.73 53.30 1v3x s ARG 154 Cb 0.18 -2.59 -0.10 0.00 -0.45 0.00 0.00 34.95 32.00 1v3x s ARG 154 CO 0.60 0.59 1.54 -1.17 -0.68 0.00 0.00 175.30 176.17 1v3x s LEU 155 N -0.60 4.37 0.23 2.53 2.96 0.71 -4.65 118.68 124.23 1v3x s LEU 155 Ca 0.09 2.56 0.11 0.00 -0.22 0.00 0.00 54.13 56.67 1v3x s LEU 155 Cb -0.12 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 1v3x s LEU 155 CO 0.02 -0.80 -0.21 -0.54 -1.32 0.00 0.00 176.35 173.50 1v3x s LYS 156 N 1.21 1.54 0.20 1.98 1.02 -0.77 -1.76 119.74 123.16 1v3x s LYS 156 Ca 0.69 -1.62 0.05 0.00 0.02 0.00 0.00 55.97 55.11 1v3x s LYS 156 Cb -0.42 -1.68 -0.05 0.00 -0.52 0.00 0.00 37.83 35.16 1v3x s LYS 156 CO 0.31 0.33 -0.07 0.00 -0.92 0.00 0.00 175.35 175.00 1v3x s MET 157 N -3.12 1.24 -0.26 1.68 0.23 0.57 -0.52 119.30 119.11 1v3x s MET 157 Ca 0.24 -1.58 -0.11 0.00 -1.03 0.00 0.00 55.69 53.21 1v3x s MET 157 Cb -0.06 -0.75 0.10 0.00 -1.53 0.00 0.00 34.83 32.59 1v3x s MET 157 CO 0.11 0.03 0.58 -1.17 -2.03 0.00 0.00 175.02 172.55 1v3x s LEU 158 N -3.26 -0.84 -0.06 0.18 2.96 0.28 -1.28 118.68 116.65 1v3x s LEU 158 Ca 0.23 1.35 -0.30 0.00 -0.22 0.00 0.00 54.13 55.19 1v3x s LEU 158 Cb 0.03 2.02 -0.03 0.00 0.50 0.00 0.00 46.19 48.70 1v3x s LEU 158 CO 0.05 -0.22 1.25 -0.70 -1.32 0.00 0.00 176.35 175.40 1v3x s GLU 159 N 2.25 4.32 -0.15 1.98 2.12 -1.26 -1.47 118.70 126.49 1v3x s GLU 159 Ca -0.07 1.72 -0.00 0.00 0.36 0.00 0.00 54.97 56.98 1v3x s GLU 159 Cb -0.09 -3.60 0.03 0.00 0.26 0.00 0.00 34.13 30.73 1v3x s GLU 159 CO -0.17 -0.51 -0.08 0.14 -0.54 0.00 0.00 175.26 174.09 1v3x s VAL 160 N 2.45 1.25 0.29 3.70 -7.23 0.82 -4.97 120.40 116.71 1v3x s VAL 160 Ca 0.57 -0.59 -0.29 0.00 -1.81 0.00 0.00 61.98 59.86 1v3x s VAL 160 Cb -0.25 -1.32 -0.14 0.00 0.56 0.00 0.00 36.38 35.23 1v3x s VAL 160 CO 0.22 0.26 1.14 -2.65 -0.31 0.00 0.00 175.10 173.76 1v3x n PRO 161 N 4.85 1.61 -2.01 4.82 -0.02 -1.26 -1.34 135.00 141.64 1v3x n PRO 161 Ca -0.13 0.57 -0.41 0.00 -2.02 0.00 0.00 63.50 61.50 1v3x n PRO 161 Cb 0.49 -2.03 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 1v3x n PRO 161 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1v3x s TYR 162 N -0.87 2.98 -0.13 6.00 2.02 -0.74 -1.29 117.35 125.31 1v3x s TYR 162 Ca 0.60 1.14 -0.02 0.00 -0.37 0.00 0.00 57.07 58.42 1v3x s TYR 162 Cb -0.68 -3.81 -0.03 0.00 -0.40 0.00 0.00 41.96 37.05 1v3x s TYR 162 CO 0.59 -2.51 -0.05 0.08 -1.57 0.00 0.00 175.55 172.08 1v3x s VAL 163 N -0.41 3.80 0.01 0.71 1.01 -0.78 -4.90 120.40 119.84 1v3x s VAL 163 Ca 0.56 -0.41 -0.36 0.00 0.00 0.00 0.00 61.98 61.77 1v3x s VAL 163 Cb -0.42 -2.63 -0.15 0.00 0.00 0.00 0.00 36.38 33.19 1v3x s VAL 163 CO 0.48 0.53 1.58 -0.67 0.00 0.00 0.00 175.10 177.02 1v3x n ASP 164 N 3.11 2.52 -0.33 3.32 2.03 -1.26 -4.53 116.55 121.41 1v3x n ASP 164 Ca -0.18 1.08 0.01 0.00 0.52 0.00 0.00 54.79 56.22 1v3x n ASP 164 Cb 0.53 -1.28 0.14 0.00 -0.72 0.00 0.00 41.12 39.79 1v3x n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1v3x h ARG 165 N 6.24 1.02 -0.50 -0.67 2.43 -1.97 0.46 114.38 121.40 1v3x h ARG 165 Ca -0.47 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 1v3x h ARG 165 Cb 1.30 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1v3x h ARG 165 CO 0.87 0.68 0.01 -0.91 -1.51 0.00 0.00 179.97 179.11 1v3x h ASN 166 N 1.05 0.85 -0.93 -3.80 4.21 -1.99 0.36 115.58 115.33 1v3x h ASN 166 Ca 0.39 -0.30 0.00 0.00 1.21 0.00 0.00 56.30 57.59 1v3x h ASN 166 Cb 0.14 -0.23 -0.05 0.00 -1.12 0.00 0.00 38.32 37.06 1v3x h ASN 166 CO -0.16 0.95 0.59 0.28 -1.29 0.00 0.00 177.43 177.79 1v3x h SER 167 N 0.74 1.09 -0.55 5.81 0.02 -1.82 -0.85 113.55 117.99 1v3x h SER 167 Ca 0.14 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1v3x h SER 167 Cb 0.51 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1v3x h SER 167 CO 0.02 0.82 0.30 0.00 -1.14 0.00 0.00 176.83 176.83 1v3x h LYS 169 N 0.74 0.89 -0.33 0.00 1.57 -0.53 -2.65 116.57 116.26 1v3x h LYS 169 Ca 0.19 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1v3x h LYS 169 Cb 0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1v3x h LYS 169 CO -0.03 0.91 0.16 -0.07 -0.57 0.00 0.00 179.45 179.85 1v3x h LEU 170 N 0.81 0.43 -1.31 2.94 3.38 -0.65 -2.52 115.31 118.39 1v3x h LEU 170 Ca 0.14 -0.13 0.33 0.00 0.09 0.00 0.00 57.88 58.32 1v3x h LEU 170 Cb 0.55 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.07 1v3x h LEU 170 CO 0.03 0.44 0.71 0.77 0.09 0.00 0.00 178.44 180.48 1v3x h SER 171 N 0.40 0.40 -2.75 -0.43 4.64 -0.34 -3.45 113.55 112.02 1v3x h SER 171 Ca 0.11 0.12 -0.65 0.00 -0.47 0.00 0.00 61.79 60.90 1v3x h SER 171 Cb 0.12 0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 62.21 1v3x h SER 171 CO -0.01 -0.03 -0.41 -0.55 -0.87 0.00 0.00 176.83 174.95 1v3x s SER 172 N -4.95 6.49 0.00 4.97 0.15 -0.95 -4.87 113.70 114.53 1v3x s SER 172 Ca -0.09 0.59 0.27 0.00 0.70 0.00 0.00 55.95 57.42 1v3x s SER 172 Cb 0.28 -2.12 0.91 0.00 -1.71 0.00 0.00 66.02 63.38 1v3x s SER 172 CO 0.80 0.38 1.67 -1.20 1.20 0.00 0.00 173.24 176.10 1v3x n SER 173 N 1.98 0.56 -4.31 5.45 7.64 -1.26 -4.85 113.62 118.83 1v3x n SER 173 Ca -0.18 -0.44 -0.17 0.00 1.01 0.00 0.00 58.87 59.08 1v3x n SER 173 Cb 0.54 0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.65 1v3x n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1v3x s PHE 174 N -2.69 1.57 0.08 1.43 0.08 -1.26 -5.12 117.98 112.08 1v3x s PHE 174 Ca 0.21 -0.61 -0.34 0.00 0.12 0.00 0.00 56.93 56.31 1v3x s PHE 174 Cb 0.19 -0.75 -0.13 0.00 -0.57 0.00 0.00 43.02 41.76 1v3x s PHE 174 CO 0.55 0.27 1.70 -0.89 -0.10 0.00 0.00 175.22 176.75 1v3x n ILE 175 N -0.21 0.22 -3.53 0.64 -0.00 -1.26 -5.00 119.36 110.22 1v3x n ILE 175 Ca -0.10 -0.04 -0.42 0.00 -0.00 0.00 0.00 62.75 62.20 1v3x n ILE 175 Cb 0.60 -1.71 -0.09 0.00 -0.00 0.00 0.00 39.64 38.43 1v3x n ILE 175 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 1v3x s ILE 176 N 2.08 4.60 0.80 1.39 -1.09 -1.26 -5.05 121.20 122.66 1v3x s ILE 176 Ca 0.83 -1.23 -0.11 0.00 -2.23 0.00 0.00 60.65 57.91 1v3x s ILE 176 Cb -0.66 -3.76 0.08 0.00 -1.58 0.00 0.00 42.46 36.54 1v3x s ILE 176 CO 0.42 -0.50 1.16 0.42 -1.23 0.00 0.00 174.94 175.21 1v3x s THR 177 N 1.51 2.05 -0.09 2.92 -4.23 -1.26 -4.93 115.64 111.61 1v3x s THR 177 Ca 0.03 -0.05 0.20 0.00 -1.18 0.00 0.00 61.69 60.69 1v3x s THR 177 Cb -0.23 -3.00 0.20 0.00 1.34 0.00 0.00 72.50 70.81 1v3x s THR 177 CO 0.04 0.00 1.57 0.06 -0.54 0.00 0.00 174.62 175.75 1v3x h GLN 178 N -1.01 0.00 -0.60 3.99 -0.00 -2.03 -2.32 115.11 113.14 1v3x h GLN 178 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1v3x h GLN 178 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 1v3x h GLN 178 CO 0.63 0.00 0.00 0.09 -0.00 0.00 0.00 178.83 179.55 1v3x n ASN 179 N -2.23 3.35 -4.05 0.06 3.02 -1.26 -4.90 115.26 109.25 1v3x n ASN 179 Ca -0.01 -2.29 -0.11 0.00 -0.03 0.00 0.00 54.58 52.13 1v3x n ASN 179 Cb 0.13 -0.47 -0.11 0.00 -0.61 0.00 0.00 39.78 38.72 1v3x n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1v3x s MET 180 N -1.74 0.51 0.23 3.52 -1.94 -0.87 -0.69 119.30 118.32 1v3x s MET 180 Ca 0.34 -0.83 0.00 0.00 -1.71 0.00 0.00 55.69 53.49 1v3x s MET 180 Cb 0.22 -0.11 -0.04 0.00 2.01 0.00 0.00 34.83 36.91 1v3x s MET 180 CO 0.17 -0.01 0.13 -0.59 -0.01 0.00 0.00 175.02 174.71 1v3x s PHE 181 N -1.95 1.31 0.12 -0.03 -0.71 0.23 -4.73 117.98 112.21 1v3x s PHE 181 Ca -0.07 -1.35 0.09 0.00 -1.04 0.00 0.00 56.93 54.56 1v3x s PHE 181 Cb -0.06 -0.67 -0.04 0.00 -1.21 0.00 0.00 43.02 41.04 1v3x s PHE 181 CO -0.02 -0.58 -0.20 0.00 -1.34 0.00 0.00 175.22 173.09 1v3x s ALA 183 N -1.11 -1.00 0.00 0.00 0.00 -0.18 -1.86 121.76 117.61 1v3x s ALA 183 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1v3x s ALA 183 Cb -0.10 0.79 0.00 0.00 0.00 0.00 0.00 23.12 23.81 1v3x s ALA 183 CO 0.09 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.53 1v3x n GLY 184 N -0.30 0.24 3.13 0.00 0.00 -0.41 -0.31 105.19 107.53 1v3x n GLY 184 Ca -0.13 -2.05 -0.19 0.00 0.00 0.00 0.00 46.02 43.65 1v3x n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1v3x s TYR 185 N 0.00 1.14 0.02 1.61 1.51 -1.26 -4.05 117.35 116.32 1v3x s TYR 185 Ca 0.00 -0.36 -0.12 0.00 -1.01 0.00 0.00 57.07 55.57 1v3x s TYR 185 Cb 0.00 -0.67 -0.07 0.00 -0.11 0.00 0.00 41.96 41.11 1v3x s TYR 185 CO 0.00 0.02 1.19 0.22 -1.11 0.00 0.00 175.55 175.87 1v3x h ASP 185 N 4.88 -0.40 0.00 2.29 3.58 -1.92 -3.42 116.42 121.43 1v3x h ASP 185 Ca -0.38 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.02 1v3x h ASP 185 Cb 1.18 0.11 -0.01 0.00 1.72 0.00 0.00 39.33 42.33 1v3x h ASP 185 CO 0.44 -0.26 -1.35 0.35 -2.88 0.00 0.00 179.24 175.53 1v3x n THR 185 N -3.24 0.29 -1.72 2.25 -2.24 -1.26 -0.38 114.28 107.97 1v3x n THR 185 Ca -0.05 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.11 1v3x n THR 185 Cb 0.17 -0.56 0.01 0.00 -2.10 0.00 0.00 70.33 67.85 1v3x n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1v3x n LYS 186 N -2.08 2.10 -2.81 -0.78 4.81 -1.26 -4.77 118.16 113.37 1v3x n LYS 186 Ca -0.07 0.74 -0.43 0.00 -0.87 0.00 0.00 58.31 57.68 1v3x n LYS 186 Cb 0.55 -2.43 0.01 0.00 0.02 0.00 0.00 35.03 33.18 1v3x n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1v3x n GLN 187 N 0.18 4.02 -3.75 1.64 3.00 -1.26 -4.73 117.38 116.48 1v3x n GLN 187 Ca 0.05 -4.15 -0.14 0.00 -0.01 0.00 0.00 57.00 52.75 1v3x n GLN 187 Cb 0.39 -2.69 -0.15 0.00 0.00 0.00 0.00 30.24 27.79 1v3x n GLN 187 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1v3x s GLU 188 N -1.25 0.05 0.05 -1.09 2.02 -1.26 -4.01 118.70 113.20 1v3x s GLU 188 Ca 0.35 0.32 -0.28 0.00 0.02 0.00 0.00 54.97 55.38 1v3x s GLU 188 Cb 0.04 -0.21 0.09 0.00 0.10 0.00 0.00 34.13 34.16 1v3x s GLU 188 CO 0.05 -0.17 0.96 0.34 0.02 0.00 0.00 175.26 176.45 1v3x s ASP 189 N 1.18 -0.26 0.84 -0.19 2.15 -0.73 -4.36 116.67 115.30 1v3x s ASP 189 Ca -0.09 -0.16 -0.12 0.00 0.43 0.00 0.00 52.55 52.61 1v3x s ASP 189 Cb -0.12 0.40 0.10 0.00 -0.30 0.00 0.00 42.92 42.99 1v3x s ASP 189 CO -0.05 -0.69 1.14 0.00 -0.17 0.00 0.00 175.17 175.40 1v3x s ALA 190 N -3.10 2.27 0.13 3.66 0.00 -1.26 0.67 121.76 124.13 1v3x s ALA 190 Ca 0.09 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 1v3x s ALA 190 Cb -0.01 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.11 1v3x s ALA 190 CO -0.04 -1.88 0.22 0.00 0.00 0.00 0.00 175.76 174.06 1v3x n GLN 192 N -0.20 2.37 0.00 0.00 7.27 -1.26 -1.69 117.38 123.87 1v3x n GLN 192 Ca -0.01 0.85 0.00 0.00 0.07 0.00 0.00 57.00 57.91 1v3x n GLN 192 Cb 0.21 -2.61 0.00 0.00 2.41 0.00 0.00 30.24 30.26 1v3x n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1v3x n GLY 193 N 2.95 1.25 0.17 1.69 0.00 -1.26 -0.43 105.19 109.56 1v3x n GLY 193 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1v3x n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1v3x h ASP 194 N 0.00 0.00 -3.41 1.61 3.45 -1.61 -3.27 116.42 113.18 1v3x h ASP 194 Ca 0.00 -0.01 -0.57 0.00 0.43 0.00 0.00 57.03 56.88 1v3x h ASP 194 Cb 0.00 0.00 0.13 0.00 -0.56 0.00 0.00 39.33 38.90 1v3x h ASP 194 CO 0.00 0.01 0.39 -1.20 -1.57 0.00 0.00 179.24 176.87 1v3x n SER 195 N -2.78 2.15 0.00 6.45 7.64 -1.26 -0.61 113.62 125.21 1v3x n SER 195 Ca 0.04 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.00 1v3x n SER 195 Cb 0.50 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 1v3x n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v3x n GLY 196 N 0.93 2.67 3.68 0.23 0.00 0.32 0.16 105.19 113.18 1v3x n GLY 196 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1v3x n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1v3x s GLY 197 N -2.00 1.58 0.28 -0.02 0.00 0.22 -3.28 107.32 104.10 1v3x s GLY 197 Ca 0.00 -0.60 -0.29 0.00 0.00 0.00 0.00 44.72 43.83 1v3x s GLY 197 CO 0.00 0.09 1.13 -4.14 0.00 0.00 0.00 173.10 170.18 1v3x s PRO 198 N -5.18 4.59 -0.19 2.90 0.02 -1.26 -2.16 135.00 133.73 1v3x s PRO 198 Ca 0.67 1.87 0.01 0.00 0.02 0.00 0.00 61.00 63.57 1v3x s PRO 198 Cb -0.15 -3.17 0.03 0.00 0.02 0.00 0.00 34.50 31.22 1v3x s PRO 198 CO 0.56 0.14 -0.19 -1.58 -0.33 0.00 0.00 177.00 175.61 1v3x s HIS 199 N -1.13 2.81 0.25 6.54 2.46 -0.80 -2.90 115.29 122.52 1v3x s HIS 199 Ca 0.45 -1.71 0.11 0.00 0.47 0.00 0.00 55.06 54.38 1v3x s HIS 199 Cb -0.33 -1.90 -0.05 0.00 -0.13 0.00 0.00 32.58 30.17 1v3x s HIS 199 CO 0.43 -0.81 -0.19 0.14 -2.47 0.00 0.00 174.74 171.83 1v3x s VAL 200 N 1.28 2.31 -0.09 0.89 -7.23 0.81 -1.05 120.40 117.32 1v3x s VAL 200 Ca 0.03 -2.31 0.02 0.00 -1.81 0.00 0.00 61.98 57.91 1v3x s VAL 200 Cb -0.14 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.60 1v3x s VAL 200 CO -0.12 -0.39 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.24 1v3x s THR 201 N -2.47 1.43 0.05 5.32 2.01 -0.12 0.12 115.64 121.98 1v3x s THR 201 Ca 0.27 -0.62 -0.27 0.00 0.31 0.00 0.00 61.69 61.38 1v3x s THR 201 Cb -0.05 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.12 1v3x s THR 201 CO 0.13 0.42 0.85 -0.60 -0.69 0.00 0.00 174.62 174.73 1v3x s ARG 202 N 0.81 4.57 -0.10 4.92 3.52 -1.26 -0.97 118.95 130.43 1v3x s ARG 202 Ca -0.11 1.22 -0.03 0.00 -0.13 0.00 0.00 55.73 56.68 1v3x s ARG 202 Cb -0.16 -3.39 0.05 0.00 -1.56 0.00 0.00 34.95 29.90 1v3x s ARG 202 CO 0.02 0.20 0.14 0.12 -0.81 0.00 0.00 175.30 174.96 1v3x s PHE 203 N 0.17 -0.09 -1.30 5.12 5.36 0.12 -4.88 117.98 122.47 1v3x s PHE 203 Ca 0.43 0.37 -0.18 0.00 -0.96 0.00 0.00 56.93 56.59 1v3x s PHE 203 Cb -0.21 -0.37 0.02 0.00 -0.34 0.00 0.00 43.02 42.11 1v3x s PHE 203 CO 0.25 -0.32 0.52 1.63 -1.46 0.00 0.00 175.22 175.84 1v3x n LYS 204 N 5.31 -1.14 -1.15 10.12 5.02 -1.26 -1.44 118.16 133.62 1v3x n LYS 204 Ca -0.05 0.22 -0.05 0.00 -2.02 0.00 0.00 58.31 56.41 1v3x n LYS 204 Cb 0.50 -3.45 -0.02 0.00 -0.02 0.00 0.00 35.03 32.04 1v3x n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1v3x n ASP 205 N -2.57 -4.99 -4.21 4.39 8.00 -1.26 -4.98 116.55 110.93 1v3x n ASP 205 Ca -0.19 0.13 -0.29 0.00 0.71 0.00 0.00 54.79 55.16 1v3x n ASP 205 Cb 0.62 -2.96 -0.16 0.00 -0.02 0.00 0.00 41.12 38.60 1v3x n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1v3x s THR 206 N -1.75 1.75 -0.24 -3.53 2.01 -0.52 -5.12 115.64 108.24 1v3x s THR 206 Ca 0.00 -0.91 -0.07 0.00 0.31 0.00 0.00 61.69 61.02 1v3x s THR 206 Cb 0.00 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 71.00 1v3x s THR 206 CO 0.00 0.49 0.07 -0.31 -0.69 0.00 0.00 174.62 174.18 1v3x s TYR 207 N -0.16 3.09 -0.12 4.92 1.51 -1.26 0.14 117.35 125.47 1v3x s TYR 207 Ca -0.01 -0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 55.64 1v3x s TYR 207 Cb -0.12 -2.23 -0.03 0.00 -0.11 0.00 0.00 41.96 39.48 1v3x s TYR 207 CO 0.02 -0.33 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.01 1v3x s PHE 208 N 1.53 2.95 0.05 2.71 0.08 -0.15 -1.83 117.98 123.32 1v3x s PHE 208 Ca 0.06 -0.24 -0.30 0.00 0.12 0.00 0.00 56.93 56.57 1v3x s PHE 208 Cb -0.15 -1.84 -0.09 0.00 -0.57 0.00 0.00 43.02 40.37 1v3x s PHE 208 CO 0.04 0.08 1.95 0.28 -0.10 0.00 0.00 175.22 177.47 1v3x n VAL 209 N 3.02 0.71 0.03 -0.44 0.31 0.54 -0.94 118.33 121.55 1v3x n VAL 209 Ca -0.18 -0.13 0.01 0.00 -0.01 0.00 0.00 64.34 64.04 1v3x n VAL 209 Cb 0.53 -2.29 -0.02 0.00 -0.91 0.00 0.00 33.84 31.15 1v3x n VAL 209 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1v3x n THR 210 N 5.41 0.00 -3.88 2.52 -2.24 -0.21 -4.51 114.28 111.37 1v3x n THR 210 Ca 0.20 -0.18 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 1v3x n THR 210 Cb 0.40 0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 69.24 1v3x n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1v3x s GLY 211 N -1.91 0.14 -0.05 3.38 0.00 -0.51 -3.21 107.32 105.16 1v3x s GLY 211 Ca -0.00 -0.52 0.03 0.00 0.00 0.00 0.00 44.72 44.23 1v3x s GLY 211 CO 0.09 -0.25 -0.12 -0.42 0.00 0.00 0.00 173.10 172.40 1v3x s ILE 212 N -3.66 1.08 -0.03 0.90 1.01 -1.10 -1.91 121.20 117.50 1v3x s ILE 212 Ca 0.14 -0.48 -0.32 0.00 0.00 0.00 0.00 60.65 59.99 1v3x s ILE 212 Cb -0.05 -0.97 -0.10 0.00 0.01 0.00 0.00 42.46 41.35 1v3x s ILE 212 CO 0.08 0.33 1.94 0.52 0.00 0.00 0.00 174.94 177.82 1v3x n VAL 213 N 3.53 0.68 0.01 2.92 0.31 -0.92 -0.79 118.33 124.07 1v3x n VAL 213 Ca -0.21 -0.13 -0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1v3x n VAL 213 Cb 0.53 -2.12 -0.00 0.00 -0.91 0.00 0.00 33.84 31.33 1v3x n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1v3x n SER 214 N 7.24 0.36 -3.79 4.52 2.88 -0.86 -0.52 113.62 123.45 1v3x n SER 214 Ca 0.22 0.05 -0.08 0.00 -1.33 0.00 0.00 58.87 57.72 1v3x n SER 214 Cb 0.36 -0.18 -0.02 0.00 -0.75 0.00 0.00 64.21 63.61 1v3x n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1v3x s TRP 215 N -1.33 -0.22 0.19 0.66 1.48 -0.91 -4.88 118.94 113.93 1v3x s TRP 215 Ca -0.01 -0.19 -0.16 0.00 -1.06 0.00 0.00 56.10 54.68 1v3x s TRP 215 Cb 0.00 0.65 0.02 0.00 -1.16 0.00 0.00 33.47 32.99 1v3x s TRP 215 CO 0.02 -1.15 0.49 0.20 -4.06 0.00 0.00 176.95 172.45 1v3x s GLY 216 N -2.89 -0.01 -0.93 3.67 0.00 -1.26 -1.11 107.32 104.79 1v3x s GLY 216 Ca 0.10 -0.32 -0.19 0.00 0.00 0.00 0.00 44.72 44.30 1v3x s GLY 216 CO 0.03 -0.34 1.17 -0.54 0.00 0.00 0.00 173.10 173.42 1v3x s GLU 217 N -3.89 3.59 3.86 2.90 2.02 -1.26 -4.85 118.70 121.06 1v3x s GLU 217 Ca 0.10 -1.65 0.00 0.00 0.02 0.00 0.00 54.97 53.44 1v3x s GLU 217 Cb -0.00 -4.96 0.00 0.00 0.10 0.00 0.00 34.13 29.27 1v3x s GLU 217 CO -0.02 -1.83 0.00 0.41 0.02 0.00 0.00 175.26 173.84 1v3x n GLY 218 N 5.68 0.40 2.92 -1.39 0.00 -1.26 -4.58 105.19 106.97 1v3x n GLY 218 Ca 0.24 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1v3x n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v3x n ALA 221 N 5.35 -0.34 -1.77 0.00 0.00 -1.26 -4.55 120.51 117.94 1v3x n ALA 221 Ca -0.06 0.19 -0.38 0.00 0.00 0.00 0.00 53.44 53.19 1v3x n ALA 221 Cb 0.50 -1.70 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 1v3x n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1v3x s ARG 222 N -4.04 3.84 0.33 0.00 0.52 -1.26 -4.74 118.95 113.60 1v3x s ARG 222 Ca 0.00 1.90 -0.29 0.00 -0.52 0.00 0.00 55.73 56.83 1v3x s ARG 222 Cb 0.00 -2.55 -0.11 0.00 0.52 0.00 0.00 34.95 32.81 1v3x s ARG 222 CO 0.00 -0.52 1.45 -1.59 0.02 0.00 0.00 175.30 174.66 1v3x s LYS 223 N -2.50 4.21 0.00 3.54 -2.85 -1.26 -1.53 119.74 119.35 1v3x s LYS 223 Ca 0.61 2.42 0.00 0.00 -1.00 0.00 0.00 55.97 58.00 1v3x s LYS 223 Cb -0.32 -3.03 0.00 0.00 -2.06 0.00 0.00 37.83 32.42 1v3x s LYS 223 CO 0.40 -0.43 0.00 0.41 0.10 0.00 0.00 175.35 175.82 1v3x n GLY 223 N 1.18 0.40 3.27 0.59 0.00 0.48 -4.99 105.19 106.12 1v3x n GLY 223 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1v3x n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v3x s LYS 224 N -0.66 1.09 0.36 1.61 -0.14 -0.59 -4.76 119.74 116.66 1v3x s LYS 224 Ca 0.00 -1.15 0.09 0.00 -1.36 0.00 0.00 55.97 53.55 1v3x s LYS 224 Cb 0.00 -1.31 -0.07 0.00 -1.68 0.00 0.00 37.83 34.77 1v3x s LYS 224 CO 0.00 0.30 -0.03 0.71 -0.76 0.00 0.00 175.35 175.57 1v3x s TYR 225 N -1.21 2.47 -0.01 3.18 2.02 -1.26 -4.59 117.35 117.95 1v3x s TYR 225 Ca 0.06 -0.53 -0.29 0.00 -0.37 0.00 0.00 57.07 55.93 1v3x s TYR 225 Cb -0.10 -1.53 -0.03 0.00 -0.40 0.00 0.00 41.96 39.90 1v3x s TYR 225 CO 0.04 0.51 0.95 0.20 -1.57 0.00 0.00 175.55 175.68 1v3x s GLY 226 N -3.67 2.88 -0.15 0.71 0.00 0.57 -4.56 107.32 103.10 1v3x s GLY 226 Ca 0.34 0.50 -0.07 0.00 0.00 0.00 0.00 44.72 45.49 1v3x s GLY 226 CO 0.18 1.63 0.09 -0.42 0.00 0.00 0.00 173.10 174.59 1v3x s ILE 227 N 0.98 5.10 0.06 0.90 -1.09 -0.26 -1.01 121.20 125.88 1v3x s ILE 227 Ca 0.50 0.07 0.05 0.00 -2.23 0.00 0.00 60.65 59.04 1v3x s ILE 227 Cb -0.21 -3.26 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1v3x s ILE 227 CO 0.27 0.53 -0.14 -0.31 -1.23 0.00 0.00 174.94 174.06 1v3x s TYR 228 N -0.26 1.20 0.16 3.97 2.02 0.26 -2.03 117.35 122.67 1v3x s TYR 228 Ca 0.09 -0.43 -0.30 0.00 -0.37 0.00 0.00 57.07 56.06 1v3x s TYR 228 Cb -0.12 -0.68 -0.08 0.00 -0.40 0.00 0.00 41.96 40.68 1v3x s TYR 228 CO 0.01 0.05 1.27 0.99 -1.57 0.00 0.00 175.55 176.29 1v3x s THR 229 N -1.16 3.46 -0.88 -0.71 2.01 0.03 -0.60 115.64 117.79 1v3x s THR 229 Ca -0.01 1.17 -0.22 0.00 0.31 0.00 0.00 61.69 62.94 1v3x s THR 229 Cb -0.09 -3.75 0.08 0.00 0.01 0.00 0.00 72.50 68.75 1v3x s THR 229 CO 0.02 0.16 1.22 -0.75 -0.69 0.00 0.00 174.62 174.57 1v3x s LYS 230 N 0.17 3.45 0.41 4.92 2.20 0.14 -2.70 119.74 128.32 1v3x s LYS 230 Ca 0.57 -1.20 0.14 0.00 -0.36 0.00 0.00 55.97 55.12 1v3x s LYS 230 Cb -0.34 -4.84 1.00 0.00 -1.51 0.00 0.00 37.83 32.14 1v3x s LYS 230 CO 0.35 -1.97 1.89 0.28 -0.36 0.00 0.00 175.35 175.55 1v3x h VAL 231 N 6.19 0.77 0.00 4.02 2.07 -1.87 -1.73 116.25 125.71 1v3x h VAL 231 Ca 0.03 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1v3x h VAL 231 Cb 1.03 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1v3x h VAL 231 CO 1.25 0.09 0.00 0.35 0.02 0.00 0.00 177.57 179.27 1v3x n THR 232 N -4.51 0.95 1.19 2.57 -2.24 -1.26 -0.44 114.28 110.54 1v3x n THR 232 Ca 0.16 0.25 0.13 0.00 -2.27 0.00 0.00 64.05 62.32 1v3x n THR 232 Cb 0.56 -1.05 0.45 0.00 -2.10 0.00 0.00 70.33 68.18 1v3x n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v3x n ALA 233 N -1.58 3.01 -1.19 6.98 0.00 -0.65 -4.14 120.51 122.93 1v3x n ALA 233 Ca 0.03 -0.30 0.07 0.00 0.00 0.00 0.00 53.44 53.24 1v3x n ALA 233 Cb 0.19 -1.24 0.10 0.00 0.00 0.00 0.00 19.45 18.50 1v3x n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1v3x n PHE 234 N -1.11 0.00 -0.06 0.00 3.72 0.41 -4.82 117.46 115.60 1v3x n PHE 234 Ca 0.10 -0.77 -0.09 0.00 -0.05 0.00 0.00 57.45 56.64 1v3x n PHE 234 Cb 0.32 -0.12 0.06 0.00 -0.94 0.00 0.00 39.48 38.80 1v3x n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1v3x h LEU 235 N 0.00 0.77 -0.34 4.37 3.38 -1.70 0.36 115.31 122.15 1v3x h LEU 235 Ca 0.00 -0.33 -0.13 0.00 0.09 0.00 0.00 57.88 57.51 1v3x h LEU 235 Cb 1.05 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1v3x h LEU 235 CO 0.00 1.05 -0.30 0.11 0.09 0.00 0.00 178.44 179.39 1v3x h LYS 236 N 0.60 0.80 -0.39 1.13 1.57 -1.91 -0.94 116.57 117.43 1v3x h LYS 236 Ca 0.06 -0.41 0.02 0.00 -1.87 0.00 0.00 60.65 58.44 1v3x h LYS 236 Cb 0.90 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 1v3x h LYS 236 CO 0.08 1.04 0.23 2.35 -0.57 0.00 0.00 179.45 182.58 1v3x h TRP 237 N 0.57 0.43 -0.30 -1.35 7.01 -1.79 -1.36 115.95 119.17 1v3x h TRP 237 Ca 0.06 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.09 1v3x h TRP 237 Cb 0.88 -0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 27.77 1v3x h TRP 237 CO 0.07 0.26 0.14 0.82 -2.79 0.00 0.00 178.44 176.93 1v3x h ILE 238 N 0.47 0.97 -0.44 2.65 2.04 -0.26 -1.26 117.51 121.68 1v3x h ILE 238 Ca 0.15 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 66.00 1v3x h ILE 238 Cb -0.00 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 36.65 1v3x h ILE 238 CO -0.07 0.05 -0.15 0.44 0.00 0.00 0.00 178.15 178.43 1v3x h ASP 239 N 0.29 -0.52 -0.40 1.72 5.19 -0.81 -1.29 116.42 120.60 1v3x h ASP 239 Ca 0.13 0.14 -0.02 0.00 -0.62 0.00 0.00 57.03 56.66 1v3x h ASP 239 Cb 0.06 0.31 -0.02 0.00 0.18 0.00 0.00 39.33 39.86 1v3x h ASP 239 CO -0.10 -0.18 0.18 0.03 -3.12 0.00 0.00 179.24 176.05 1v3x h ARG 240 N -0.05 0.58 -0.80 3.56 3.08 -1.11 -2.12 114.38 117.52 1v3x h ARG 240 Ca 0.21 -0.09 0.10 0.00 0.07 0.00 0.00 59.98 60.27 1v3x h ARG 240 Cb 0.37 -0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 1v3x h ARG 240 CO -0.48 0.52 0.52 0.77 -1.07 0.00 0.00 179.97 180.24 1v3x h SER 241 N 0.51 0.65 -0.17 7.04 0.02 -0.66 0.00 113.55 120.94 1v3x h SER 241 Ca 0.14 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1v3x h SER 241 Cb 0.14 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1v3x h SER 241 CO -0.02 0.39 0.00 0.23 -1.14 0.00 0.00 176.83 176.29 1v3x n MET 242 N -4.51 1.48 -0.13 3.45 2.81 -0.54 -5.04 117.12 114.65 1v3x n MET 242 Ca 0.14 -0.66 0.00 0.00 -1.81 0.00 0.00 57.70 55.37 1v3x n MET 242 Cb 0.34 -1.21 0.00 0.00 -0.71 0.00 0.00 33.22 31.64 1v3x n MET 242 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11