#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j2u s VAL 17 N 0.00 5.24 0.00 1.39 1.01 0.12 -4.05 120.40 124.11 2j2u s VAL 17 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2j2u s VAL 17 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2j2u s VAL 17 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2j2u n GLY 18 N 3.88 -0.48 7.00 4.51 0.00 -1.26 -1.82 105.19 117.02 2j2u n GLY 18 Ca -0.10 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2j2u n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j2u n GLY 19 N 0.00 -1.33 3.18 -0.02 0.00 -1.26 -4.90 105.19 100.86 2j2u n GLY 19 Ca 0.00 -1.26 -0.11 0.00 0.00 0.00 0.00 46.02 44.65 2j2u n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j2u s GLN 20 N 0.00 0.90 0.37 1.61 -1.52 0.10 -4.96 119.66 116.15 2j2u s GLN 20 Ca 0.00 -1.39 -0.27 0.00 -1.95 0.00 0.00 55.36 51.75 2j2u s GLN 20 Cb 0.00 -0.15 -0.09 0.00 -0.22 0.00 0.00 33.01 32.55 2j2u s GLN 20 CO 0.00 -0.08 1.23 -2.00 -0.25 0.00 0.00 175.29 174.19 2j2u s GLU 21 N -3.88 4.19 -0.04 2.91 2.12 -1.26 -0.32 118.70 122.42 2j2u s GLU 21 Ca 0.16 2.02 -0.30 0.00 0.36 0.00 0.00 54.97 57.20 2j2u s GLU 21 Cb 0.06 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.53 2j2u s GLU 21 CO -0.02 -0.25 1.34 0.00 -0.54 0.00 0.00 175.26 175.79 2j2u s LYS 23 N 2.54 1.60 -0.18 0.00 -0.14 -1.26 -4.88 119.74 117.42 2j2u s LYS 23 Ca 0.61 -0.58 -0.37 0.00 -1.36 0.00 0.00 55.97 54.28 2j2u s LYS 23 Cb -0.29 -2.14 -0.13 0.00 -1.68 0.00 0.00 37.83 33.60 2j2u s LYS 23 CO 0.24 -1.62 1.84 -3.47 -0.76 0.00 0.00 175.35 171.58 2j2u n ASP 24 N -3.12 2.98 0.00 2.83 2.03 -1.26 -1.53 116.55 118.48 2j2u n ASP 24 Ca 0.12 0.99 0.00 0.00 0.52 0.00 0.00 54.79 56.42 2j2u n ASP 24 Cb 0.60 -1.27 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 2j2u n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2j2u n GLY 25 N 4.42 0.80 0.15 0.27 0.00 -1.26 -4.94 105.19 104.64 2j2u n GLY 25 Ca 0.25 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.31 2j2u n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2j2u h GLU 26 N 2.33 0.00 -1.83 1.61 5.08 -1.63 -3.38 114.58 116.75 2j2u h GLU 26 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 2j2u h GLU 26 Cb 0.02 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.87 2j2u h GLU 26 CO 0.00 0.40 -1.06 0.00 -1.00 0.00 0.00 179.01 177.35 2j2u n PRO 28 N 0.06 0.21 -0.03 0.00 -0.04 -1.26 -2.46 135.00 131.49 2j2u n PRO 28 Ca 0.24 0.38 0.13 0.00 -0.04 0.00 0.00 63.50 64.20 2j2u n PRO 28 Cb 0.64 -1.86 0.55 0.00 -0.04 0.00 0.00 33.50 32.78 2j2u n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2j2u n TRP 29 N -2.26 0.07 -2.42 0.54 2.14 -1.06 -1.97 117.44 112.48 2j2u n TRP 29 Ca 0.03 -0.04 -0.41 0.00 2.07 0.00 0.00 57.50 59.15 2j2u n TRP 29 Cb 0.28 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.74 2j2u n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2j2u s GLN 30 N -1.93 4.54 0.17 -2.67 2.00 -1.03 -0.10 119.66 120.64 2j2u s GLN 30 Ca 0.36 1.83 0.09 0.00 -2.00 0.00 0.00 55.36 55.65 2j2u s GLN 30 Cb 0.19 -3.23 -0.04 0.00 0.80 0.00 0.00 33.01 30.72 2j2u s GLN 30 CO 0.30 0.01 -0.19 0.00 -0.50 0.00 0.00 175.29 174.91 2j2u s ALA 31 N -0.37 2.08 -0.08 1.58 0.00 -0.11 -4.41 121.76 120.45 2j2u s ALA 31 Ca 0.50 -1.50 0.02 0.00 0.00 0.00 0.00 51.96 50.98 2j2u s ALA 31 Cb -0.32 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 22.61 2j2u s ALA 31 CO 0.38 0.27 -0.14 -1.17 0.00 0.00 0.00 175.76 175.10 2j2u s LEU 32 N -2.64 1.67 -0.13 0.00 2.96 -0.05 -1.22 118.68 119.27 2j2u s LEU 32 Ca 0.16 -0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 53.55 2j2u s LEU 32 Cb -0.06 -0.93 -0.04 0.00 0.50 0.00 0.00 46.19 45.65 2j2u s LEU 32 CO 0.07 0.03 0.43 -0.76 -1.32 0.00 0.00 176.35 174.80 2j2u s LEU 33 N 0.76 4.27 -0.02 -0.68 1.43 0.15 -0.12 118.68 124.47 2j2u s LEU 33 Ca -0.12 0.73 0.07 0.00 -1.03 0.00 0.00 54.13 53.78 2j2u s LEU 33 Cb -0.16 -2.61 -0.02 0.00 0.03 0.00 0.00 46.19 43.44 2j2u s LEU 33 CO 0.03 0.02 -0.22 0.27 0.23 0.00 0.00 176.35 176.68 2j2u s ILE 34 N 0.60 1.73 0.33 -0.59 -4.36 -0.31 -1.62 121.20 116.97 2j2u s ILE 34 Ca 0.23 -0.93 -0.05 0.00 -0.26 0.00 0.00 60.65 59.64 2j2u s ILE 34 Cb -0.15 -1.44 0.07 0.00 1.25 0.00 0.00 42.46 42.20 2j2u s ILE 34 CO 0.09 0.49 0.45 -0.46 0.24 0.00 0.00 174.94 175.74 2j2u n ASN 35 N 2.58 0.06 -0.34 4.36 0.23 -0.10 -1.85 115.26 120.20 2j2u n ASN 35 Ca -0.16 -1.18 0.10 0.00 -0.53 0.00 0.00 54.58 52.81 2j2u n ASN 35 Cb 0.52 -0.34 0.29 0.00 -2.08 0.00 0.00 39.78 38.18 2j2u n ASN 35 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2j2u h GLU 36 N 0.00 0.85 0.00 -3.83 5.08 -1.90 0.41 114.58 115.19 2j2u h GLU 36 Ca -0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2j2u h GLU 36 Cb 0.41 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2j2u h GLU 36 CO 0.10 0.56 0.00 0.39 -1.00 0.00 0.00 179.01 179.07 2j2u n GLU 37 N -4.64 1.00 -3.20 2.33 1.02 -1.26 -4.88 120.64 111.00 2j2u n GLU 37 Ca 0.20 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 57.11 2j2u n GLU 37 Cb 0.44 -1.04 0.02 0.00 -0.02 0.00 0.00 31.44 30.84 2j2u n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2j2u n ASN 38 N -0.54 -4.95 -4.70 1.62 3.02 0.14 -4.98 115.26 104.87 2j2u n ASN 38 Ca 0.02 -0.34 -0.35 0.00 -0.03 0.00 0.00 54.58 53.87 2j2u n ASN 38 Cb 0.01 -4.03 -0.09 0.00 -0.61 0.00 0.00 39.78 35.06 2j2u n ASN 38 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2j2u s GLU 39 N -5.87 3.72 0.29 3.52 2.02 -1.26 -4.78 118.70 116.34 2j2u s GLU 39 Ca 0.36 -0.30 -0.29 0.00 0.02 0.00 0.00 54.97 54.75 2j2u s GLU 39 Cb -0.18 -3.16 -0.10 0.00 0.10 0.00 0.00 34.13 30.80 2j2u s GLU 39 CO 0.44 0.45 1.28 0.20 0.02 0.00 0.00 175.26 177.65 2j2u s GLY 40 N -0.12 2.84 0.00 -1.39 0.00 -1.26 -0.93 107.32 106.46 2j2u s GLY 40 Ca 0.07 1.17 0.00 0.00 0.00 0.00 0.00 44.72 45.97 2j2u s GLY 40 CO 0.01 1.91 0.00 1.97 0.00 0.00 0.00 173.10 176.99 2j2u n PHE 41 N 1.39 0.00 -3.66 1.90 -1.74 -0.64 -4.93 117.46 109.77 2j2u n PHE 41 Ca 0.02 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.81 2j2u n PHE 41 Cb 0.42 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.40 2j2u n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2j2u n GLY 43 N -0.38 2.28 3.82 0.00 0.00 0.48 -0.67 105.19 110.72 2j2u n GLY 43 Ca -0.11 -2.25 -0.07 0.00 0.00 0.00 0.00 46.02 43.59 2j2u n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2j2u s GLY 44 N -4.29 -0.14 -0.08 -0.02 0.00 -0.36 -3.58 107.32 98.86 2j2u s GLY 44 Ca 0.46 -0.21 0.04 0.00 0.00 0.00 0.00 44.72 45.01 2j2u s GLY 44 CO 0.29 -0.06 -0.23 -1.59 0.00 0.00 0.00 173.10 171.51 2j2u s THR 45 N -3.86 1.91 -0.06 0.90 2.01 0.22 -0.93 115.64 115.83 2j2u s THR 45 Ca 0.10 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.85 2j2u s THR 45 Cb -0.05 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 2j2u s THR 45 CO 0.05 0.53 1.40 -0.63 -0.69 0.00 0.00 174.62 175.28 2j2u s ILE 46 N 0.22 3.90 -0.11 1.82 1.01 0.85 -0.78 121.20 128.11 2j2u s ILE 46 Ca -0.13 1.19 0.17 0.00 0.00 0.00 0.00 60.65 61.87 2j2u s ILE 46 Cb -0.16 -3.76 -0.25 0.00 0.01 0.00 0.00 42.46 38.29 2j2u s ILE 46 CO 0.07 -0.05 0.21 0.18 0.00 0.00 0.00 174.94 175.35 2j2u n LEU 47 N 6.07 0.00 0.00 2.97 4.77 -0.19 -1.70 117.00 128.93 2j2u n LEU 47 Ca 0.14 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.11 2j2u n LEU 47 Cb 0.44 0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.80 2j2u n LEU 47 CO 0.58 0.25 0.77 -1.54 -1.33 0.00 0.00 177.39 176.12 2j2u n SER 48 N -2.45 -1.41 0.26 -1.43 3.41 -1.16 -4.74 113.62 106.10 2j2u n SER 48 Ca -0.18 -1.66 0.10 0.00 -0.26 0.00 0.00 58.87 56.87 2j2u n SER 48 Cb 0.83 2.27 0.68 0.00 -0.26 0.00 0.00 64.21 67.73 2j2u n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2j2u h GLU 49 N 0.00 0.00 0.00 4.33 4.11 -1.98 -3.03 114.58 118.00 2j2u h GLU 49 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.20 2j2u h GLU 49 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2j2u h GLU 49 CO 0.31 0.10 -0.85 1.19 0.07 0.00 0.00 179.01 179.83 2j2u n PHE 50 N -4.03 0.00 -5.25 2.06 3.72 -1.26 0.77 117.46 113.48 2j2u n PHE 50 Ca -0.02 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 2j2u n PHE 50 Cb 0.19 -0.08 -0.16 0.00 -0.94 0.00 0.00 39.48 38.49 2j2u n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2j2u s TYR 51 N -2.33 2.29 -0.04 1.38 2.02 -1.15 -0.05 117.35 119.49 2j2u s TYR 51 Ca 0.02 -0.53 0.07 0.00 -0.37 0.00 0.00 57.07 56.25 2j2u s TYR 51 Cb 0.09 -1.49 -0.01 0.00 -0.40 0.00 0.00 41.96 40.14 2j2u s TYR 51 CO 0.49 -0.11 -0.24 0.42 -1.57 0.00 0.00 175.55 174.54 2j2u s ILE 52 N -0.41 1.91 -0.11 2.71 -1.09 -0.33 -1.02 121.20 122.86 2j2u s ILE 52 Ca 0.04 -1.01 -0.12 0.00 -2.23 0.00 0.00 60.65 57.33 2j2u s ILE 52 Cb -0.11 -1.60 -0.05 0.00 -1.58 0.00 0.00 42.46 39.12 2j2u s ILE 52 CO 0.01 0.54 0.28 -0.22 -1.23 0.00 0.00 174.94 174.31 2j2u s LEU 53 N -0.36 4.34 0.00 2.97 2.96 0.04 -0.21 118.68 128.43 2j2u s LEU 53 Ca 0.03 0.61 -0.03 0.00 -0.22 0.00 0.00 54.13 54.52 2j2u s LEU 53 Cb -0.11 -2.34 0.01 0.00 0.50 0.00 0.00 46.19 44.25 2j2u s LEU 53 CO 0.01 0.24 0.37 1.07 -1.32 0.00 0.00 176.35 176.72 2j2u n THR 54 N 2.69 0.00 -3.35 3.68 5.66 -0.10 -0.61 114.28 122.25 2j2u n THR 54 Ca -0.15 -1.12 -0.38 0.00 -3.05 0.00 0.00 64.05 59.35 2j2u n THR 54 Cb 0.53 0.73 -0.06 0.00 -1.55 0.00 0.00 70.33 69.98 2j2u n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2j2u s ALA 55 N -2.28 3.61 0.34 1.79 0.00 -1.26 -0.79 121.76 123.18 2j2u s ALA 55 Ca 0.18 -0.07 0.05 0.00 0.00 0.00 0.00 51.96 52.12 2j2u s ALA 55 Cb -0.01 -2.56 0.70 0.00 0.00 0.00 0.00 23.12 21.25 2j2u s ALA 55 CO 0.13 0.38 1.93 0.00 0.00 0.00 0.00 175.76 178.20 2j2u h ALA 56 N 4.84 1.68 0.00 0.00 0.00 -1.69 -2.56 119.26 121.52 2j2u h ALA 56 Ca -0.49 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 2j2u h ALA 56 Cb 1.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2j2u h ALA 56 CO 0.64 0.17 -0.16 1.12 0.00 0.00 0.00 179.25 181.02 2j2u h HIS 57 N 0.81 0.00 0.00 0.00 2.07 -1.92 -2.21 115.15 113.90 2j2u h HIS 57 Ca 0.36 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.87 2j2u h HIS 57 Cb 0.35 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.33 2j2u h HIS 57 CO -0.00 0.16 -0.07 0.00 -3.07 0.00 0.00 177.93 174.95 2j2u n LEU 59 N -3.80 0.00 -0.55 0.00 4.77 -0.83 -2.04 117.00 114.55 2j2u n LEU 59 Ca -0.02 0.18 0.07 0.00 -0.03 0.00 0.00 56.01 56.21 2j2u n LEU 59 Cb 0.17 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.13 2j2u n LEU 59 CO 0.30 -0.08 0.44 -1.22 -1.33 0.00 0.00 177.39 175.50 2j2u n TYR 60 N -1.18 0.00 0.95 -1.77 4.01 -1.12 -4.49 117.16 113.57 2j2u n TYR 60 Ca 0.10 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.96 2j2u n TYR 60 Cb 0.11 0.00 0.31 0.00 -0.31 0.00 0.00 39.34 39.44 2j2u n TYR 60 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2j2u n GLN 61 N 0.65 2.05 -3.59 -0.72 6.02 -0.87 -4.87 117.38 116.04 2j2u n GLN 61 Ca 0.08 -1.57 -0.12 0.00 -0.01 0.00 0.00 57.00 55.39 2j2u n GLN 61 Cb 0.36 -1.45 -0.06 0.00 1.02 0.00 0.00 30.24 30.11 2j2u n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2j2u s ALA 61 N -1.76 -1.89 -0.02 -1.58 0.00 -1.26 -5.06 121.76 110.19 2j2u s ALA 61 Ca 0.34 1.69 -0.17 0.00 0.00 0.00 0.00 51.96 53.83 2j2u s ALA 61 Cb 0.20 -0.87 -0.33 0.00 0.00 0.00 0.00 23.12 22.12 2j2u s ALA 61 CO 0.29 -0.30 0.86 0.87 0.00 0.00 0.00 175.76 177.48 2j2u h LYS 62 N 3.52 0.42 -4.91 0.00 1.57 -1.89 -3.46 116.57 111.82 2j2u h LYS 62 Ca -0.25 -0.71 -0.43 0.00 -1.87 0.00 0.00 60.65 57.39 2j2u h LYS 62 Cb 1.16 0.27 -0.29 0.00 0.08 0.00 0.00 32.23 33.45 2j2u h LYS 62 CO 0.22 1.34 -0.79 1.03 -0.57 0.00 0.00 179.45 180.68 2j2u s ARG 63 N -2.53 0.91 0.10 3.15 0.52 -1.26 -5.14 118.95 114.70 2j2u s ARG 63 Ca -0.13 -0.39 -0.12 0.00 -0.52 0.00 0.00 55.73 54.58 2j2u s ARG 63 Cb 0.03 -0.88 0.01 0.00 0.52 0.00 0.00 34.95 34.64 2j2u s ARG 63 CO 0.88 0.22 0.28 -0.59 0.02 0.00 0.00 175.30 176.11 2j2u s PHE 64 N -0.20 -0.01 0.38 -0.53 -0.71 -1.26 -3.84 117.98 111.81 2j2u s PHE 64 Ca 0.03 -0.36 0.04 0.00 -1.04 0.00 0.00 56.93 55.61 2j2u s PHE 64 Cb -0.05 0.08 -0.06 0.00 -1.21 0.00 0.00 43.02 41.78 2j2u s PHE 64 CO -0.00 -0.60 0.05 0.15 -1.34 0.00 0.00 175.22 173.47 2j2u s LYS 65 N -3.74 1.85 -0.11 1.99 1.02 -0.77 -4.46 119.74 115.52 2j2u s LYS 65 Ca 0.03 -2.07 0.02 0.00 0.02 0.00 0.00 55.97 53.98 2j2u s LYS 65 Cb 0.03 -1.15 -0.01 0.00 -0.52 0.00 0.00 37.83 36.19 2j2u s LYS 65 CO -0.11 -0.21 -0.19 0.08 -0.92 0.00 0.00 175.35 174.00 2j2u s VAL 66 N -3.06 2.50 -0.12 3.17 1.01 0.26 -1.16 120.40 123.01 2j2u s VAL 66 Ca 0.31 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 2j2u s VAL 66 Cb 0.07 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 2j2u s VAL 66 CO 0.15 0.55 0.03 -0.60 0.00 0.00 0.00 175.10 175.22 2j2u s ARG 67 N 0.32 3.32 0.13 2.72 3.52 0.83 -0.24 118.95 129.55 2j2u s ARG 67 Ca -0.15 -0.36 0.06 0.00 -0.13 0.00 0.00 55.73 55.15 2j2u s ARG 67 Cb -0.17 -2.95 -0.04 0.00 -1.56 0.00 0.00 34.95 30.23 2j2u s ARG 67 CO 0.07 0.58 -0.14 0.14 -0.81 0.00 0.00 175.30 175.14 2j2u s VAL 68 N -0.53 1.38 0.00 7.11 -7.23 -0.68 -0.87 120.40 119.58 2j2u s VAL 68 Ca 0.10 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 2j2u s VAL 68 Cb -0.12 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.24 2j2u s VAL 68 CO 0.02 -0.42 0.00 0.61 -0.31 0.00 0.00 175.10 175.00 2j2u n GLY 69 N 0.47 2.27 3.73 2.32 0.00 -1.25 -2.19 105.19 110.54 2j2u n GLY 69 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 2j2u n GLY 69 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j2u s ASP 70 N -3.25 6.50 -0.02 1.61 1.01 -1.26 -4.91 116.67 116.35 2j2u s ASP 70 Ca 0.00 0.59 0.19 0.00 0.71 0.00 0.00 52.55 54.04 2j2u s ASP 70 Cb 0.00 -2.21 -0.28 0.00 1.01 0.00 0.00 42.92 41.44 2j2u s ASP 70 CO 0.00 0.08 0.49 0.54 0.21 0.00 0.00 175.17 176.49 2j2u n ARG 71 N 3.56 0.64 -3.84 8.23 1.74 -1.26 -4.86 116.66 120.86 2j2u n ARG 71 Ca -0.11 -0.14 -0.29 0.00 -0.77 0.00 0.00 57.85 56.54 2j2u n ARG 71 Cb 0.52 -1.44 -0.16 0.00 -1.02 0.00 0.00 32.46 30.36 2j2u n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2j2u s ASN 72 N -3.92 3.41 0.00 0.55 2.47 -1.26 -0.56 114.94 115.63 2j2u s ASN 72 Ca -0.04 -1.01 0.11 0.00 0.42 0.00 0.00 52.86 52.34 2j2u s ASN 72 Cb 0.13 -0.90 0.52 0.00 -1.45 0.00 0.00 41.25 39.54 2j2u s ASN 72 CO 0.79 -0.27 1.29 0.35 -3.72 0.00 0.00 177.10 175.54 2j2u n THR 73 N 4.85 0.95 -0.04 -5.21 -2.24 -0.03 -2.67 114.28 109.89 2j2u n THR 73 Ca -0.11 0.24 -0.04 0.00 -2.27 0.00 0.00 64.05 61.87 2j2u n THR 73 Cb 0.45 -1.05 -0.14 0.00 -2.10 0.00 0.00 70.33 67.49 2j2u n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2j2u n GLU 74 N -1.38 0.66 -4.07 -0.78 1.02 -1.26 -4.84 120.64 109.99 2j2u n GLU 74 Ca 0.04 0.07 -0.32 0.00 -0.02 0.00 0.00 57.16 56.93 2j2u n GLU 74 Cb 0.10 -1.63 -0.15 0.00 -0.02 0.00 0.00 31.44 29.74 2j2u n GLU 74 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2j2u s GLN 75 N -2.77 2.41 0.88 3.49 -0.21 -1.09 -5.26 119.66 117.11 2j2u s GLN 75 Ca -0.07 -1.10 -0.10 0.00 0.02 0.00 0.00 55.36 54.11 2j2u s GLN 75 Cb 0.08 -2.71 0.12 0.00 1.00 0.00 0.00 33.01 31.51 2j2u s GLN 75 CO 0.84 -0.44 1.14 -2.00 -2.12 0.00 0.00 175.29 172.71 2j2u s GLU 76 N 1.22 1.30 -0.04 2.91 2.12 -1.26 -4.63 118.70 120.31 2j2u s GLU 76 Ca -0.03 1.51 0.06 0.00 0.36 0.00 0.00 54.97 56.86 2j2u s GLU 76 Cb -0.17 -1.76 -0.01 0.00 0.26 0.00 0.00 34.13 32.44 2j2u s GLU 76 CO -0.08 -2.41 -0.22 0.00 -0.54 0.00 0.00 175.26 172.01 2j2u s ALA 81 N -2.64 1.90 -0.17 6.30 0.00 -0.93 -5.14 121.76 121.07 2j2u s ALA 81 Ca 0.66 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 51.64 2j2u s ALA 81 Cb -0.22 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.30 2j2u s ALA 81 CO 0.57 0.39 0.02 0.08 0.00 0.00 0.00 175.76 176.81 2j2u s VAL 82 N -0.21 4.37 -0.06 0.00 1.01 -1.26 -1.69 120.40 122.55 2j2u s VAL 82 Ca -0.00 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 61.84 2j2u s VAL 82 Cb -0.12 -2.95 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 2j2u s VAL 82 CO 0.02 0.47 -0.21 -1.00 0.00 0.00 0.00 175.10 174.38 2j2u s HIS 83 N 0.41 2.12 0.43 5.22 3.76 0.66 -4.97 115.29 122.93 2j2u s HIS 83 Ca -0.00 -0.69 -0.14 0.00 -0.15 0.00 0.00 55.06 54.07 2j2u s HIS 83 Cb -0.13 -1.42 -0.08 0.00 1.11 0.00 0.00 32.58 32.06 2j2u s HIS 83 CO 0.02 -0.25 0.85 -1.21 -0.85 0.00 0.00 174.74 173.30 2j2u s GLU 84 N 0.08 3.92 -0.11 1.40 2.02 -1.26 -0.57 118.70 124.18 2j2u s GLU 84 Ca -0.08 0.73 -0.16 0.00 0.02 0.00 0.00 54.97 55.48 2j2u s GLU 84 Cb -0.14 -2.29 -0.05 0.00 0.10 0.00 0.00 34.13 31.75 2j2u s GLU 84 CO 0.04 -0.08 0.41 0.08 0.02 0.00 0.00 175.26 175.73 2j2u s VAL 85 N -2.37 5.19 -0.21 2.63 1.01 -1.26 -1.06 120.40 124.33 2j2u s VAL 85 Ca 0.55 0.82 -0.19 0.00 0.00 0.00 0.00 61.98 63.16 2j2u s VAL 85 Cb -0.10 -3.75 -0.16 0.00 0.00 0.00 0.00 36.38 32.37 2j2u s VAL 85 CO 0.27 0.39 0.08 1.21 0.00 0.00 0.00 175.10 177.05 2j2u n GLU 86 N 3.34 0.56 -4.68 2.72 2.13 0.26 -4.74 120.64 120.23 2j2u n GLU 86 Ca -0.10 0.52 -0.25 0.00 0.66 0.00 0.00 57.16 58.00 2j2u n GLU 86 Cb 0.52 -1.70 -0.16 0.00 0.27 0.00 0.00 31.44 30.37 2j2u n GLU 86 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2j2u s VAL 87 N -2.38 1.23 -0.23 6.31 1.01 -0.98 -5.01 120.40 120.35 2j2u s VAL 87 Ca -0.29 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 2j2u s VAL 87 Cb 0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2j2u s VAL 87 CO 0.53 0.37 0.07 -0.69 0.00 0.00 0.00 175.10 175.38 2j2u s VAL 88 N 0.32 4.46 -0.34 2.92 1.01 -1.26 -1.30 120.40 126.20 2j2u s VAL 88 Ca -0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.73 2j2u s VAL 88 Cb -0.13 -3.06 0.06 0.00 0.00 0.00 0.00 36.38 33.25 2j2u s VAL 88 CO 0.03 0.36 0.09 -0.63 0.00 0.00 0.00 175.10 174.95 2j2u s ILE 89 N 1.31 3.31 -0.05 2.22 1.01 0.80 -5.00 121.20 124.79 2j2u s ILE 89 Ca 0.05 -1.50 -0.01 0.00 0.00 0.00 0.00 60.65 59.19 2j2u s ILE 89 Cb -0.15 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 2j2u s ILE 89 CO 0.04 -0.30 0.02 -0.75 0.00 0.00 0.00 174.94 173.94 2j2u s LYS 90 N 1.27 2.95 0.04 2.79 2.20 -1.26 0.22 119.74 127.94 2j2u s LYS 90 Ca -0.00 -0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 54.83 2j2u s LYS 90 Cb -0.21 -2.78 -0.07 0.00 -1.51 0.00 0.00 37.83 33.27 2j2u s LYS 90 CO -0.01 0.67 1.48 -1.58 -0.36 0.00 0.00 175.35 175.56 2j2u s HIS 91 N -0.99 2.77 0.20 4.03 5.65 -1.02 -4.88 115.29 121.05 2j2u s HIS 91 Ca 0.16 0.68 0.33 0.00 0.25 0.00 0.00 55.06 56.48 2j2u s HIS 91 Cb -0.11 -3.76 1.75 0.00 -1.18 0.00 0.00 32.58 29.27 2j2u s HIS 91 CO 0.06 -2.90 2.02 -2.95 -0.65 0.00 0.00 174.74 170.32 2j2u h ASN 92 N 7.84 0.00 -0.22 9.88 7.08 -1.93 -2.51 115.58 135.71 2j2u h ASN 92 Ca -0.40 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.82 2j2u h ASN 92 Cb 1.19 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.43 2j2u h ASN 92 CO 0.91 0.00 0.00 0.54 -2.08 0.00 0.00 177.43 176.80 2j2u n ARG 93 N -2.70 2.40 -1.64 4.14 1.74 -1.26 -4.98 116.66 114.35 2j2u n ARG 93 Ca -0.02 -2.11 -0.46 0.00 -0.77 0.00 0.00 57.85 54.49 2j2u n ARG 93 Cb 0.09 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.02 2j2u n ARG 93 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2j2u n PHE 94 N 1.41 1.94 -4.61 -1.55 7.35 -0.95 -4.70 117.46 116.35 2j2u n PHE 94 Ca 0.17 0.49 -0.31 0.00 -0.76 0.00 0.00 57.45 57.03 2j2u n PHE 94 Cb 0.60 -2.42 -0.17 0.00 0.35 0.00 0.00 39.48 37.85 2j2u n PHE 94 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2j2u s THR 95 N -0.00 1.88 0.43 -2.13 2.01 -1.02 -4.99 115.64 111.83 2j2u s THR 95 Ca 0.71 -0.87 0.25 0.00 0.31 0.00 0.00 61.69 62.08 2j2u s THR 95 Cb -0.71 -1.68 0.27 0.00 0.01 0.00 0.00 72.50 70.39 2j2u s THR 95 CO 0.49 0.52 2.07 0.11 -0.69 0.00 0.00 174.62 177.12 2j2u h LYS 96 N 7.35 0.00 -0.01 4.92 1.57 -1.93 0.64 116.57 129.11 2j2u h LYS 96 Ca -0.32 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.25 2j2u h LYS 96 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 2j2u h LYS 96 CO 0.53 0.13 -0.89 0.93 -0.57 0.00 0.00 179.45 179.58 2j2u h GLU 97 N 0.00 0.38 -0.00 3.15 5.08 -1.98 -3.37 114.58 117.84 2j2u h GLU 97 Ca -0.00 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2j2u h GLU 97 Cb 0.31 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2j2u h GLU 97 CO 0.02 1.06 -0.05 0.25 -1.00 0.00 0.00 179.01 179.28 2j2u n THR 98 N -3.75 0.00 -1.73 1.13 -2.24 -1.17 -5.00 114.28 101.53 2j2u n THR 98 Ca -0.06 -0.47 -0.18 0.00 -2.27 0.00 0.00 64.05 61.07 2j2u n THR 98 Cb 0.81 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.98 2j2u n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2j2u n TYR 99 N -0.91 -0.21 -2.46 4.78 0.53 0.21 -4.97 117.16 114.13 2j2u n TYR 99 Ca 0.00 0.00 -0.34 0.00 -1.02 0.00 0.00 57.90 56.54 2j2u n TYR 99 Cb 0.02 -3.19 -0.02 0.00 -1.03 0.00 0.00 39.34 35.11 2j2u n TYR 99 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 2j2u s ASP 100 N -2.66 6.17 -1.40 7.72 2.15 -1.25 -3.23 116.67 124.17 2j2u s ASP 100 Ca 0.00 2.01 -0.09 0.00 0.43 0.00 0.00 52.55 54.90 2j2u s ASP 100 Cb 0.00 -2.57 0.01 0.00 -0.30 0.00 0.00 42.92 40.07 2j2u s ASP 100 CO 0.00 -0.90 1.09 0.49 -0.17 0.00 0.00 175.17 175.67 2j2u n PHE 101 N -1.04 -2.72 -2.45 -5.34 3.72 -1.26 -2.42 117.46 105.95 2j2u n PHE 101 Ca 0.10 0.94 -0.43 0.00 -0.05 0.00 0.00 57.45 58.01 2j2u n PHE 101 Cb 0.52 -4.89 0.00 0.00 -0.94 0.00 0.00 39.48 34.16 2j2u n PHE 101 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2j2u n ASP 102 N -2.93 4.77 -3.71 4.37 2.03 -1.20 -4.14 116.55 115.74 2j2u n ASP 102 Ca -0.01 -2.91 -0.14 0.00 0.52 0.00 0.00 54.79 52.25 2j2u n ASP 102 Cb 0.57 -1.71 -0.09 0.00 -0.72 0.00 0.00 41.12 39.16 2j2u n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2j2u s ILE 103 N 3.71 0.01 0.01 5.18 2.07 -1.26 -3.99 121.20 126.93 2j2u s ILE 103 Ca 0.51 -0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.58 2j2u s ILE 103 Cb 0.05 -0.67 0.01 0.00 0.13 0.00 0.00 42.46 41.99 2j2u s ILE 103 CO 0.04 -0.03 0.23 0.00 -1.91 0.00 0.00 174.94 173.26 2j2u s ALA 104 N -0.05 -0.51 -0.08 1.50 0.00 0.03 -2.43 121.76 120.22 2j2u s ALA 104 Ca -0.02 -0.03 0.04 0.00 0.00 0.00 0.00 51.96 51.95 2j2u s ALA 104 Cb -0.03 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2j2u s ALA 104 CO 0.02 -0.29 -0.21 0.08 0.00 0.00 0.00 175.76 175.36 2j2u s VAL 105 N -1.87 2.42 -0.15 0.00 1.01 0.13 -0.92 120.40 121.02 2j2u s VAL 105 Ca -0.10 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 2j2u s VAL 105 Cb -0.04 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 2j2u s VAL 105 CO 0.00 0.56 -0.00 -0.76 0.00 0.00 0.00 175.10 174.90 2j2u s LEU 106 N -0.04 3.47 -0.22 3.92 1.43 0.71 -0.14 118.68 127.81 2j2u s LEU 106 Ca -0.06 -0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 52.94 2j2u s LEU 106 Cb -0.15 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 2j2u s LEU 106 CO 0.05 0.21 0.09 -0.60 0.23 0.00 0.00 176.35 176.33 2j2u s ARG 107 N 0.15 3.93 0.47 1.70 3.52 -0.42 -1.18 118.95 127.11 2j2u s ARG 107 Ca 0.01 -0.35 -0.08 0.00 -0.13 0.00 0.00 55.73 55.17 2j2u s ARG 107 Cb -0.13 -3.34 -0.05 0.00 -1.56 0.00 0.00 34.95 29.87 2j2u s ARG 107 CO 0.02 0.10 0.81 -0.51 -0.81 0.00 0.00 175.30 174.91 2j2u s LEU 108 N 0.88 3.67 0.16 -0.88 1.43 0.93 -0.57 118.68 124.29 2j2u s LEU 108 Ca 0.05 1.07 -0.08 0.00 -1.03 0.00 0.00 54.13 54.14 2j2u s LEU 108 Cb -0.13 -4.01 0.01 0.00 0.03 0.00 0.00 46.19 42.09 2j2u s LEU 108 CO 0.03 -0.54 1.46 0.11 0.23 0.00 0.00 176.35 177.64 2j2u h LYS 109 N 0.59 0.76 -6.41 1.70 1.57 -1.39 -3.41 116.57 109.98 2j2u h LYS 109 Ca -0.47 -0.46 -0.64 0.00 -1.87 0.00 0.00 60.65 57.22 2j2u h LYS 109 Cb 1.20 0.04 -0.26 0.00 0.08 0.00 0.00 32.23 33.29 2j2u h LYS 109 CO 0.63 1.09 -0.86 0.95 -0.57 0.00 0.00 179.45 180.68 2j2u s THR 110 N -4.14 1.90 0.50 -0.16 -4.23 -1.26 -5.02 115.64 103.23 2j2u s THR 110 Ca -0.09 -1.32 -0.20 0.00 -1.18 0.00 0.00 61.69 58.89 2j2u s THR 110 Cb 0.11 -1.65 -0.07 0.00 1.34 0.00 0.00 72.50 72.23 2j2u s THR 110 CO 0.87 0.26 1.08 -2.16 -0.54 0.00 0.00 174.62 174.13 2j2u s PRO 111 N -1.28 3.65 0.16 3.99 0.04 -1.26 -4.86 135.00 135.45 2j2u s PRO 111 Ca 0.10 1.50 -0.30 0.00 0.04 0.00 0.00 61.00 62.34 2j2u s PRO 111 Cb -0.09 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 2j2u s PRO 111 CO 0.02 -0.58 1.09 0.42 0.04 0.00 0.00 177.00 177.99 2j2u s ILE 112 N -1.84 3.95 -0.27 0.56 1.01 0.23 -4.99 121.20 119.85 2j2u s ILE 112 Ca 0.68 1.65 -0.19 0.00 0.00 0.00 0.00 60.65 62.79 2j2u s ILE 112 Cb -0.21 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.19 2j2u s ILE 112 CO 0.24 0.27 0.59 -0.89 0.00 0.00 0.00 174.94 175.15 2j2u s THR 113 N -0.10 5.00 0.33 2.92 2.01 -1.26 -4.75 115.64 119.78 2j2u s THR 113 Ca 0.50 0.96 -0.26 0.00 0.31 0.00 0.00 61.69 63.19 2j2u s THR 113 Cb -0.29 -3.92 -0.10 0.00 0.01 0.00 0.00 72.50 68.21 2j2u s THR 113 CO 0.34 -0.01 0.99 -0.36 -0.69 0.00 0.00 174.62 174.89 2j2u s PHE 114 N 2.47 3.62 0.08 4.92 0.08 -1.26 -4.90 117.98 122.98 2j2u s PHE 114 Ca 0.24 1.76 -0.13 0.00 0.12 0.00 0.00 56.93 58.92 2j2u s PHE 114 Cb -0.15 -3.02 0.04 0.00 -0.57 0.00 0.00 43.02 39.32 2j2u s PHE 114 CO 0.10 -0.04 0.61 2.89 -0.10 0.00 0.00 175.22 178.67 2j2u n ARG 115 N 0.59 0.30 -1.63 0.44 1.85 -0.05 -5.00 116.66 113.16 2j2u n ARG 115 Ca 0.02 -0.74 -0.48 0.00 -1.00 0.00 0.00 57.85 55.65 2j2u n ARG 115 Cb 0.49 1.03 -0.05 0.00 -1.05 0.00 0.00 32.46 32.88 2j2u n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 2j2u n MET 116 N -0.43 1.70 -0.95 2.89 0.00 -1.26 -0.52 117.12 118.55 2j2u n MET 116 Ca -0.00 0.61 0.00 0.00 -0.00 0.00 0.00 57.70 58.31 2j2u n MET 116 Cb 0.33 -2.30 0.00 0.00 0.00 0.00 0.00 33.22 31.24 2j2u n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2j2u n ASN 117 N 2.82 -3.39 -3.54 6.12 3.02 -1.26 -4.97 115.26 114.06 2j2u n ASN 117 Ca 0.17 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.45 2j2u n ASN 117 Cb 0.25 -1.65 -0.15 0.00 -0.61 0.00 0.00 39.78 37.63 2j2u n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2j2u s VAL 118 N -1.81 -0.12 -0.01 2.41 1.01 0.32 -3.93 120.40 118.28 2j2u s VAL 118 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 2j2u s VAL 118 Cb 0.00 -0.86 0.06 0.00 0.00 0.00 0.00 36.38 35.59 2j2u s VAL 118 CO 0.00 -0.56 0.62 0.00 0.00 0.00 0.00 175.10 175.16 2j2u s ALA 119 N 2.15 -1.60 0.50 5.51 0.00 -0.83 -0.87 121.76 126.61 2j2u s ALA 119 Ca 0.07 1.04 -0.14 0.00 0.00 0.00 0.00 51.96 52.93 2j2u s ALA 119 Cb -0.16 0.16 -0.07 0.00 0.00 0.00 0.00 23.12 23.05 2j2u s ALA 119 CO -0.28 -0.42 0.93 -1.25 0.00 0.00 0.00 175.76 174.74 2j2u s PRO 120 N -1.67 3.86 0.40 0.00 0.04 -1.26 -2.56 135.00 133.82 2j2u s PRO 120 Ca -0.09 0.79 -0.08 0.00 0.04 0.00 0.00 61.00 61.66 2j2u s PRO 120 Cb -0.01 -2.20 -0.06 0.00 0.04 0.00 0.00 34.50 32.28 2j2u s PRO 120 CO 0.05 -0.24 0.74 0.00 0.04 0.00 0.00 177.00 177.59 2j2u s ALA 121 N -2.63 3.40 0.20 8.56 0.00 -0.69 -4.86 121.76 125.74 2j2u s ALA 121 Ca 0.56 -0.33 -0.23 0.00 0.00 0.00 0.00 51.96 51.96 2j2u s ALA 121 Cb -0.10 -2.61 -0.08 0.00 0.00 0.00 0.00 23.12 20.32 2j2u s ALA 121 CO 0.34 -0.05 0.76 0.00 0.00 0.00 0.00 175.76 176.82 2j2u s LEU 123 N -1.52 4.24 0.61 0.00 1.43 -1.26 -0.64 118.68 121.54 2j2u s LEU 123 Ca 0.39 0.85 -0.05 0.00 -1.03 0.00 0.00 54.13 54.29 2j2u s LEU 123 Cb -0.20 -2.78 0.03 0.00 0.03 0.00 0.00 46.19 43.26 2j2u s LEU 123 CO 0.24 -0.09 0.91 -2.16 0.23 0.00 0.00 176.35 175.48 2j2u s PRO 124 N 1.00 2.63 0.34 1.29 0.04 -1.26 -4.99 135.00 134.05 2j2u s PRO 124 Ca 0.28 -0.24 -0.26 0.00 0.04 0.00 0.00 61.00 60.82 2j2u s PRO 124 Cb -0.16 -2.29 -0.09 0.00 0.04 0.00 0.00 34.50 32.00 2j2u s PRO 124 CO 0.11 -0.86 1.02 -1.21 0.04 0.00 0.00 177.00 176.11 2j2u s GLU 124 N -5.01 4.43 0.09 4.56 2.02 -1.26 -4.95 118.70 118.58 2j2u s GLU 124 Ca 0.56 1.51 -0.27 0.00 0.02 0.00 0.00 54.97 56.80 2j2u s GLU 124 Cb -0.11 -2.80 -0.13 0.00 0.10 0.00 0.00 34.13 31.19 2j2u s GLU 124 CO 0.43 0.10 1.68 -0.09 0.02 0.00 0.00 175.26 177.40 2j2u h ARG 125 N 3.08 -0.37 -0.64 1.61 2.43 -1.97 -1.64 114.38 116.88 2j2u h ARG 125 Ca -0.47 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 58.63 2j2u h ARG 125 Cb 1.21 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 2j2u h ARG 125 CO 0.64 -0.25 0.05 0.38 -1.51 0.00 0.00 179.97 179.29 2j2u h ASP 126 N -0.38 1.06 -0.68 -3.80 2.03 -1.96 -1.56 116.42 111.12 2j2u h ASP 126 Ca -0.01 -0.28 -0.05 0.00 -0.73 0.00 0.00 57.03 55.96 2j2u h ASP 126 Cb 0.34 -0.28 -0.03 0.00 -0.83 0.00 0.00 39.33 38.53 2j2u h ASP 126 CO -0.01 1.08 0.23 -0.25 -1.03 0.00 0.00 179.24 179.26 2j2u h TRP 127 N 1.00 1.07 -0.39 4.15 7.01 -1.97 -0.81 115.95 126.01 2j2u h TRP 127 Ca 0.19 -0.10 0.03 0.00 2.11 0.00 0.00 58.89 61.12 2j2u h TRP 127 Cb 0.51 -0.31 -0.03 0.00 -2.10 0.00 0.00 29.16 27.22 2j2u h TRP 127 CO 0.04 0.85 0.19 0.00 -2.79 0.00 0.00 178.44 176.73 2j2u h ALA 128 N 1.10 0.48 -0.54 2.65 0.00 -0.95 0.34 119.26 122.34 2j2u h ALA 128 Ca 0.22 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2j2u h ALA 128 Cb 0.27 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2j2u h ALA 128 CO -0.01 -0.17 0.13 0.93 0.00 0.00 0.00 179.25 180.12 2j2u h GLU 129 N 0.39 0.86 0.00 0.00 5.08 -0.96 0.42 114.58 120.38 2j2u h GLU 129 Ca 0.17 -0.21 -0.15 0.00 -1.00 0.00 0.00 59.36 58.17 2j2u h GLU 129 Cb 0.08 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2j2u h GLU 129 CO -0.12 0.82 -0.95 0.66 -1.00 0.00 0.00 179.01 178.42 2j2u h SER 130 N 0.76 0.00 0.00 1.42 4.64 -0.88 -3.37 113.55 116.12 2j2u h SER 130 Ca 0.17 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.38 2j2u h SER 130 Cb 0.35 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2j2u h SER 130 CO 0.00 0.59 -1.40 0.41 -0.87 0.00 0.00 176.83 175.56 2j2u n THR 131 N -3.10 0.40 -0.10 2.95 -1.04 0.12 -4.51 114.28 109.01 2j2u n THR 131 Ca -0.03 -0.20 -0.23 0.00 -2.04 0.00 0.00 64.05 61.54 2j2u n THR 131 Cb 0.80 -0.81 -0.12 0.00 -1.82 0.00 0.00 70.33 68.39 2j2u n THR 131 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2j2u n LEU 131 N -2.44 2.01 0.12 -4.42 4.77 -0.12 -3.95 117.00 112.97 2j2u n LEU 131 Ca -0.11 0.36 0.11 0.00 -0.03 0.00 0.00 56.01 56.34 2j2u n LEU 131 Cb 0.66 -0.96 0.48 0.00 -2.33 0.00 0.00 43.42 41.28 2j2u n LEU 131 CO 0.10 0.43 0.82 0.23 -1.33 0.00 0.00 177.39 177.63 2j2u n MET 131 N -4.24 0.15 0.00 3.23 2.81 -0.05 -1.60 117.12 117.42 2j2u n MET 131 Ca -0.37 0.49 0.13 0.00 -1.81 0.00 0.00 57.70 56.14 2j2u n MET 131 Cb 0.78 -1.85 0.29 0.00 -0.71 0.00 0.00 33.22 31.72 2j2u n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2j2u n THR 132 N -2.15 0.00 -1.22 2.03 -2.24 -1.26 -4.94 114.28 104.50 2j2u n THR 132 Ca 0.01 -0.39 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 2j2u n THR 132 Cb 0.15 1.05 0.15 0.00 -2.10 0.00 0.00 70.33 69.58 2j2u n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2j2u s GLN 133 N -2.00 0.98 0.15 -0.78 -1.52 -0.63 -4.96 119.66 110.90 2j2u s GLN 133 Ca 0.32 0.68 -0.10 0.00 -1.95 0.00 0.00 55.36 54.31 2j2u s GLN 133 Cb 0.20 -1.79 -0.01 0.00 -0.22 0.00 0.00 33.01 31.19 2j2u s GLN 133 CO 0.32 -2.40 1.52 0.87 -0.25 0.00 0.00 175.29 175.35 2j2u h LYS 134 N -1.66 0.99 -4.24 2.91 1.57 -1.92 -3.42 116.57 110.79 2j2u h LYS 134 Ca -0.51 -0.46 -0.16 0.00 -1.87 0.00 0.00 60.65 57.65 2j2u h LYS 134 Cb 1.30 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.46 2j2u h LYS 134 CO 0.56 1.13 -0.52 0.95 -0.57 0.00 0.00 179.45 181.00 2j2u s THR 135 N -4.57 0.08 0.17 -0.16 -4.23 -1.26 -1.29 115.64 104.38 2j2u s THR 135 Ca -0.11 -1.74 0.02 0.00 -1.18 0.00 0.00 61.69 58.68 2j2u s THR 135 Cb 0.12 -2.03 -0.01 0.00 1.34 0.00 0.00 72.50 71.92 2j2u s THR 135 CO 0.88 -0.34 0.06 0.61 -0.54 0.00 0.00 174.62 175.28 2j2u n GLY 136 N -0.16 3.75 2.94 3.99 0.00 -0.12 -4.69 105.19 110.90 2j2u n GLY 136 Ca -0.05 -2.01 -0.23 0.00 0.00 0.00 0.00 46.02 43.73 2j2u n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j2u s ILE 137 N -2.16 0.84 0.05 -0.61 1.01 0.76 -0.24 121.20 120.85 2j2u s ILE 137 Ca 0.08 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.48 2j2u s ILE 137 Cb 0.00 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 2j2u s ILE 137 CO 0.06 0.30 0.03 0.54 0.00 0.00 0.00 174.94 175.87 2j2u s VAL 138 N 0.97 4.29 0.06 2.92 0.11 -0.47 -1.22 120.40 127.07 2j2u s VAL 138 Ca -0.10 -0.73 -0.05 0.00 -2.93 0.00 0.00 61.98 58.17 2j2u s VAL 138 Cb -0.15 -3.00 -0.02 0.00 -1.53 0.00 0.00 36.38 31.68 2j2u s VAL 138 CO 0.00 0.23 0.09 -0.94 -3.33 0.00 0.00 175.10 171.15 2j2u s SER 139 N -2.03 0.25 0.00 3.54 1.04 -1.08 -1.05 113.70 114.37 2j2u s SER 139 Ca 0.24 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2j2u s SER 139 Cb -0.12 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.26 2j2u s SER 139 CO 0.16 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.38 2j2u n GLY 140 N 0.27 -0.34 1.49 7.32 0.00 -0.48 -4.28 105.19 109.17 2j2u n GLY 140 Ca -0.16 -1.09 0.08 0.00 0.00 0.00 0.00 46.02 44.85 2j2u n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2j2u n PHE 141 N -0.45 1.58 -0.91 1.61 3.72 -1.26 -2.19 117.46 119.56 2j2u n PHE 141 Ca 0.00 -0.75 -0.30 0.00 -0.05 0.00 0.00 57.45 56.35 2j2u n PHE 141 Cb 0.00 -0.39 0.26 0.00 -0.94 0.00 0.00 39.48 38.40 2j2u n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2j2u s GLY 142 N -1.17 1.55 0.55 1.37 0.00 -1.26 -0.74 107.32 107.61 2j2u s GLY 142 Ca 0.49 -1.01 -0.21 0.00 0.00 0.00 0.00 44.72 43.99 2j2u s GLY 142 CO 0.15 -0.05 1.26 0.54 0.00 0.00 0.00 173.10 174.99 2j2u n ARG 143 N -5.05 1.49 0.00 2.90 1.74 0.21 -2.53 116.66 115.43 2j2u n ARG 143 Ca 0.14 0.55 0.12 0.00 -0.77 0.00 0.00 57.85 57.89 2j2u n ARG 143 Cb 0.60 -2.45 0.12 0.00 -1.02 0.00 0.00 32.46 29.71 2j2u n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2j2u n THR 144 N -1.15 0.00 -3.81 0.55 -2.24 -1.26 -0.50 114.28 105.88 2j2u n THR 144 Ca 0.11 -0.30 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 2j2u n THR 144 Cb 0.45 1.12 -0.08 0.00 -2.10 0.00 0.00 70.33 69.72 2j2u n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2j2u s HIS 145 N -2.33 -0.02 0.31 4.78 3.76 -1.26 -4.35 115.29 116.18 2j2u s HIS 145 Ca 0.23 -0.15 0.05 0.00 -0.15 0.00 0.00 55.06 55.04 2j2u s HIS 145 Cb 0.19 0.03 0.68 0.00 1.11 0.00 0.00 32.58 34.59 2j2u s HIS 145 CO 0.48 -0.45 1.84 1.49 -0.85 0.00 0.00 174.74 177.25 2j2u h GLU 147 N 3.41 0.83 -4.72 1.40 4.81 -1.90 -3.28 114.58 115.13 2j2u h GLU 147 Ca -0.32 -0.05 -0.69 0.00 -0.13 0.00 0.00 59.36 58.17 2j2u h GLU 147 Cb 1.19 -0.19 -0.28 0.00 0.63 0.00 0.00 28.75 30.11 2j2u h GLU 147 CO 0.47 0.55 -0.61 0.15 -0.73 0.00 0.00 179.01 178.83 2j2u s LYS 148 N -5.83 2.77 0.00 1.92 1.02 -1.26 -4.95 119.74 113.41 2j2u s LYS 148 Ca -0.11 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 54.81 2j2u s LYS 148 Cb 0.22 -3.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.11 2j2u s LYS 148 CO 0.80 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 175.05 2j2u n GLY 149 N 4.83 -0.50 3.93 -3.33 0.00 -1.24 -4.99 105.19 103.89 2j2u n GLY 149 Ca -0.13 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.64 2j2u n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2j2u s ARG 150 N -2.00 3.07 0.65 1.61 1.70 -1.26 -4.91 118.95 117.81 2j2u s ARG 150 Ca 0.00 -0.16 -0.18 0.00 -0.47 0.00 0.00 55.73 54.92 2j2u s ARG 150 Cb 0.00 -2.40 -0.01 0.00 -0.57 0.00 0.00 34.95 31.97 2j2u s ARG 150 CO 0.00 -0.46 1.25 1.04 -1.08 0.00 0.00 175.30 176.05 2j2u n GLN 151 N -2.34 1.05 -2.60 3.89 1.13 -1.26 -4.20 117.38 113.05 2j2u n GLN 151 Ca 0.03 0.41 -0.39 0.00 -1.94 0.00 0.00 57.00 55.11 2j2u n GLN 151 Cb 0.57 -2.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.39 2j2u n GLN 151 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2j2u s SER 152 N -1.40 7.22 0.08 1.08 0.15 0.08 -4.89 113.70 116.02 2j2u s SER 152 Ca 0.82 2.07 0.25 0.00 0.70 0.00 0.00 55.95 59.79 2j2u s SER 152 Cb -0.38 -2.60 0.50 0.00 -1.71 0.00 0.00 66.02 61.83 2j2u s SER 152 CO 0.41 -0.16 1.43 0.35 1.20 0.00 0.00 173.24 176.47 2j2u n THR 153 N 0.80 0.24 -4.60 6.45 -2.24 -1.26 -4.79 114.28 108.87 2j2u n THR 153 Ca 0.01 -0.17 -0.32 0.00 -2.27 0.00 0.00 64.05 61.30 2j2u n THR 153 Cb 0.47 -0.08 -0.11 0.00 -2.10 0.00 0.00 70.33 68.51 2j2u n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2j2u s ARG 154 N -3.10 2.45 0.05 -0.78 1.81 -1.26 -0.85 118.95 117.27 2j2u s ARG 154 Ca 0.09 -0.76 -0.30 0.00 -1.72 0.00 0.00 55.73 53.03 2j2u s ARG 154 Cb 0.15 -2.41 -0.05 0.00 -0.45 0.00 0.00 34.95 32.18 2j2u s ARG 154 CO 0.69 0.60 1.15 -1.17 -0.68 0.00 0.00 175.30 175.89 2j2u s LEU 155 N -1.25 4.37 0.24 2.53 2.96 0.28 -4.68 118.68 123.13 2j2u s LEU 155 Ca 0.15 1.95 0.11 0.00 -0.22 0.00 0.00 54.13 56.12 2j2u s LEU 155 Cb -0.11 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 2j2u s LEU 155 CO 0.05 -0.42 -0.14 -0.54 -1.32 0.00 0.00 176.35 173.98 2j2u s LYS 156 N 0.99 1.86 0.09 1.98 1.02 -0.93 -0.40 119.74 124.34 2j2u s LYS 156 Ca 0.57 -1.54 0.01 0.00 0.02 0.00 0.00 55.97 55.03 2j2u s LYS 156 Cb -0.28 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.04 2j2u s LYS 156 CO 0.29 0.37 -0.05 0.00 -0.92 0.00 0.00 175.35 175.04 2j2u s MET 157 N -3.24 0.79 -0.15 1.68 0.23 0.56 -1.39 119.30 117.78 2j2u s MET 157 Ca 0.27 -1.31 -0.09 0.00 -1.03 0.00 0.00 55.69 53.53 2j2u s MET 157 Cb -0.07 -0.08 0.05 0.00 -1.53 0.00 0.00 34.83 33.21 2j2u s MET 157 CO 0.15 -0.05 0.37 -1.17 -2.03 0.00 0.00 175.02 172.28 2j2u s LEU 158 N -3.02 0.09 -0.03 0.18 2.96 -0.21 -0.73 118.68 117.92 2j2u s LEU 158 Ca 0.11 0.79 -0.30 0.00 -0.22 0.00 0.00 54.13 54.52 2j2u s LEU 158 Cb 0.06 1.20 -0.03 0.00 0.50 0.00 0.00 46.19 47.92 2j2u s LEU 158 CO -0.06 -0.18 1.02 -0.70 -1.32 0.00 0.00 176.35 175.12 2j2u s GLU 159 N 1.26 4.49 -0.12 1.98 2.12 -1.26 -1.36 118.70 125.80 2j2u s GLU 159 Ca -0.09 1.46 0.01 0.00 0.36 0.00 0.00 54.97 56.71 2j2u s GLU 159 Cb -0.08 -3.48 0.02 0.00 0.26 0.00 0.00 34.13 30.84 2j2u s GLU 159 CO -0.11 -0.19 -0.14 0.14 -0.54 0.00 0.00 175.26 174.43 2j2u s VAL 160 N 1.44 1.45 0.36 3.70 -7.23 0.67 -4.97 120.40 115.82 2j2u s VAL 160 Ca 0.52 -0.59 -0.28 0.00 -1.81 0.00 0.00 61.98 59.81 2j2u s VAL 160 Cb -0.21 -1.34 -0.10 0.00 0.56 0.00 0.00 36.38 35.28 2j2u s VAL 160 CO 0.24 0.43 1.37 -2.84 -0.31 0.00 0.00 175.10 174.00 2j2u s PRO 161 N 1.16 4.18 0.35 4.82 0.02 -1.26 -0.94 135.00 143.34 2j2u s PRO 161 Ca -0.03 2.34 -0.28 0.00 0.02 0.00 0.00 61.00 63.05 2j2u s PRO 161 Cb -0.14 -2.97 -0.10 0.00 0.02 0.00 0.00 34.50 31.31 2j2u s PRO 161 CO -0.04 -0.38 1.33 0.71 -0.33 0.00 0.00 177.00 178.29 2j2u s TYR 162 N -1.15 2.95 -0.13 6.54 2.02 -0.42 -1.06 117.35 126.11 2j2u s TYR 162 Ca 0.52 1.38 -0.03 0.00 -0.37 0.00 0.00 57.07 58.57 2j2u s TYR 162 Cb -0.42 -3.72 -0.03 0.00 -0.40 0.00 0.00 41.96 37.39 2j2u s TYR 162 CO 0.56 -2.04 -0.03 0.08 -1.57 0.00 0.00 175.55 172.54 2j2u s VAL 163 N -1.16 3.96 0.19 0.71 1.01 -0.51 -4.87 120.40 119.75 2j2u s VAL 163 Ca 0.51 -0.35 -0.32 0.00 0.00 0.00 0.00 61.98 61.82 2j2u s VAL 163 Cb -0.40 -2.71 -0.15 0.00 0.00 0.00 0.00 36.38 33.12 2j2u s VAL 163 CO 0.54 0.53 1.16 -0.67 0.00 0.00 0.00 175.10 176.65 2j2u n ASP 164 N 3.09 1.43 -0.30 3.32 2.03 -1.26 -4.54 116.55 120.31 2j2u n ASP 164 Ca -0.18 1.15 -0.01 0.00 0.52 0.00 0.00 54.79 56.27 2j2u n ASP 164 Cb 0.53 -1.24 0.11 0.00 -0.72 0.00 0.00 41.12 39.80 2j2u n ASP 164 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2j2u h ARG 165 N 3.23 0.97 -0.08 -0.67 3.08 -1.98 -0.98 114.38 117.95 2j2u h ARG 165 Ca -0.43 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.54 2j2u h ARG 165 Cb 1.34 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 2j2u h ARG 165 CO 0.69 0.64 -0.04 -0.97 -1.07 0.00 0.00 179.97 179.22 2j2u h ASN 166 N 1.00 0.18 -0.97 7.04 -0.73 -2.00 -1.76 115.58 118.34 2j2u h ASN 166 Ca 0.34 -0.41 0.15 0.00 1.87 0.00 0.00 56.30 58.24 2j2u h ASN 166 Cb 0.06 -0.05 -0.08 0.00 0.27 0.00 0.00 38.32 38.51 2j2u h ASN 166 CO -0.13 0.55 0.61 0.28 -0.37 0.00 0.00 177.43 178.37 2j2u h SER 167 N -0.20 0.79 -0.02 1.15 0.02 -1.91 -0.86 113.55 112.51 2j2u h SER 167 Ca 0.02 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2j2u h SER 167 Cb 0.49 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2j2u h SER 167 CO 0.01 0.38 -0.00 0.00 -1.14 0.00 0.00 176.83 176.07 2j2u h LYS 169 N -0.31 1.12 -0.05 0.00 1.57 -0.91 -1.91 116.57 116.07 2j2u h LYS 169 Ca 0.01 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 2j2u h LYS 169 Cb 0.38 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2j2u h LYS 169 CO 0.00 0.74 -0.20 -0.07 -0.57 0.00 0.00 179.45 179.36 2j2u h LEU 170 N 1.15 0.08 0.00 2.94 3.38 -1.10 -2.87 115.31 118.89 2j2u h LEU 170 Ca 0.31 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2j2u h LEU 170 Cb -0.13 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2j2u h LEU 170 CO -0.07 0.28 -0.31 0.77 0.09 0.00 0.00 178.44 179.21 2j2u h SER 171 N 0.08 0.00 -2.91 -0.43 4.64 -0.81 -3.47 113.55 110.64 2j2u h SER 171 Ca 0.01 -0.09 -0.63 0.00 -0.47 0.00 0.00 61.79 60.61 2j2u h SER 171 Cb 0.40 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.41 2j2u h SER 171 CO 0.03 0.05 -0.41 -0.55 -0.87 0.00 0.00 176.83 175.07 2j2u s SER 172 N -4.57 6.44 0.00 4.97 0.15 -0.97 -4.76 113.70 114.97 2j2u s SER 172 Ca 0.08 0.52 0.28 0.00 0.70 0.00 0.00 55.95 57.54 2j2u s SER 172 Cb 0.12 -2.12 1.15 0.00 -1.71 0.00 0.00 66.02 63.46 2j2u s SER 172 CO 0.66 0.31 1.83 -1.20 1.20 0.00 0.00 173.24 176.04 2j2u n SER 173 N 2.46 0.34 -4.29 5.45 7.64 -1.26 -4.86 113.62 119.09 2j2u n SER 173 Ca -0.17 -0.27 -0.18 0.00 1.01 0.00 0.00 58.87 59.26 2j2u n SER 173 Cb 0.54 -0.13 -0.10 0.00 -1.01 0.00 0.00 64.21 63.50 2j2u n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2j2u s PHE 174 N -2.66 1.53 0.17 1.43 0.40 -1.26 -5.12 117.98 112.46 2j2u s PHE 174 Ca 0.23 -0.60 -0.31 0.00 -0.60 0.00 0.00 56.93 55.65 2j2u s PHE 174 Cb 0.19 -0.75 -0.09 0.00 0.51 0.00 0.00 43.02 42.88 2j2u s PHE 174 CO 0.52 0.23 1.43 -1.50 0.70 0.00 0.00 175.22 176.60 2j2u s ILE 175 N -2.72 2.99 -0.44 0.64 2.07 -1.26 -5.00 121.20 117.49 2j2u s ILE 175 Ca 0.16 0.75 -0.16 0.00 -1.41 0.00 0.00 60.65 59.99 2j2u s ILE 175 Cb -0.02 -3.48 0.04 0.00 0.13 0.00 0.00 42.46 39.13 2j2u s ILE 175 CO 0.04 0.08 0.38 -0.63 -1.91 0.00 0.00 174.94 172.90 2j2u s ILE 176 N 0.70 5.19 0.84 2.00 -1.09 -1.26 -5.05 121.20 122.53 2j2u s ILE 176 Ca 0.63 -0.68 -0.12 0.00 -2.23 0.00 0.00 60.65 58.25 2j2u s ILE 176 Cb -0.39 -4.03 0.12 0.00 -1.58 0.00 0.00 42.46 36.57 2j2u s ILE 176 CO 0.35 -0.44 1.19 0.42 -1.23 0.00 0.00 174.94 175.22 2j2u s THR 177 N 1.84 2.05 -1.35 2.92 -4.23 -1.26 -4.95 115.64 110.66 2j2u s THR 177 Ca 0.07 -0.07 0.18 0.00 -1.18 0.00 0.00 61.69 60.70 2j2u s THR 177 Cb -0.20 -2.98 0.29 0.00 1.34 0.00 0.00 72.50 70.95 2j2u s THR 177 CO 0.10 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 175.75 2j2u n GLN 178 N -3.38 0.22 -0.11 3.99 6.02 -1.26 -2.19 117.38 120.68 2j2u n GLN 178 Ca 0.11 0.12 0.09 0.00 -0.01 0.00 0.00 57.00 57.31 2j2u n GLN 178 Cb 0.60 -1.50 0.31 0.00 1.02 0.00 0.00 30.24 30.67 2j2u n GLN 178 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2j2u n ASN 179 N -1.32 1.63 -4.21 1.08 3.02 -1.26 -4.88 115.26 109.32 2j2u n ASN 179 Ca 0.08 -1.79 -0.15 0.00 -0.03 0.00 0.00 54.58 52.69 2j2u n ASN 179 Cb 0.16 -0.14 -0.11 0.00 -0.61 0.00 0.00 39.78 39.08 2j2u n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2j2u s MET 180 N -1.72 0.95 0.13 3.52 -1.94 -0.93 -0.32 119.30 118.99 2j2u s MET 180 Ca 0.29 -1.27 -0.05 0.00 -1.71 0.00 0.00 55.69 52.95 2j2u s MET 180 Cb 0.15 -0.61 -0.02 0.00 2.01 0.00 0.00 34.83 36.36 2j2u s MET 180 CO 0.22 0.09 0.15 -0.59 -0.01 0.00 0.00 175.02 174.89 2j2u s PHE 181 N -2.72 0.57 0.03 -0.03 -0.12 -0.33 -4.77 117.98 110.61 2j2u s PHE 181 Ca 0.10 -0.96 0.05 0.00 -0.05 0.00 0.00 56.93 56.07 2j2u s PHE 181 Cb -0.01 -0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 2j2u s PHE 181 CO 0.01 -0.59 -0.12 0.00 -0.05 0.00 0.00 175.22 174.47 2j2u s ALA 183 N -0.99 -0.67 0.00 0.00 0.00 -0.58 -1.42 121.76 118.10 2j2u s ALA 183 Ca 0.17 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2j2u s ALA 183 Cb -0.11 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.12 2j2u s ALA 183 CO 0.07 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2j2u n GLY 184 N 1.22 0.92 3.33 0.00 0.00 -0.22 -1.46 105.19 108.99 2j2u n GLY 184 Ca -0.21 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.57 2j2u n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j2u s TYR 185 N -2.57 2.29 0.01 1.61 2.02 -1.26 -4.07 117.35 115.37 2j2u s TYR 185 Ca 0.00 -0.41 -0.19 0.00 -0.37 0.00 0.00 57.07 56.09 2j2u s TYR 185 Cb 0.00 -1.38 -0.24 0.00 -0.40 0.00 0.00 41.96 39.93 2j2u s TYR 185 CO 0.00 0.10 1.08 0.22 -1.57 0.00 0.00 175.55 175.38 2j2u h ASP 185 N 4.90 0.57 0.00 2.29 3.58 -1.94 -3.43 116.42 122.40 2j2u h ASP 185 Ca -0.46 -0.78 -0.16 0.00 0.42 0.00 0.00 57.03 56.05 2j2u h ASP 185 Cb 1.14 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.99 2j2u h ASP 185 CO 0.44 1.28 -1.56 0.35 -2.88 0.00 0.00 179.24 176.87 2j2u n THR 185 N -4.16 0.56 -1.68 2.25 -2.24 -1.26 -1.57 114.28 106.17 2j2u n THR 185 Ca -0.11 -0.17 -0.44 0.00 -2.27 0.00 0.00 64.05 61.06 2j2u n THR 185 Cb 0.72 -1.31 -0.02 0.00 -2.10 0.00 0.00 70.33 67.62 2j2u n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2j2u n LYS 186 N -3.18 2.09 -2.49 -0.78 4.81 -1.26 -4.83 118.16 112.52 2j2u n LYS 186 Ca -0.19 0.74 -0.43 0.00 -0.87 0.00 0.00 58.31 57.57 2j2u n LYS 186 Cb 0.66 -2.37 0.01 0.00 0.02 0.00 0.00 35.03 33.34 2j2u n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2j2u n GLN 187 N 1.56 3.86 -3.76 1.64 1.13 -1.26 -4.69 117.38 115.85 2j2u n GLN 187 Ca 0.09 -3.78 -0.15 0.00 -1.94 0.00 0.00 57.00 51.22 2j2u n GLN 187 Cb 0.33 -2.82 -0.15 0.00 0.11 0.00 0.00 30.24 27.71 2j2u n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2j2u s GLU 188 N -0.46 0.00 0.13 -1.09 2.02 -1.26 -4.34 118.70 113.70 2j2u s GLU 188 Ca 0.38 0.25 -0.26 0.00 0.02 0.00 0.00 54.97 55.36 2j2u s GLU 188 Cb 0.09 -0.22 0.07 0.00 0.10 0.00 0.00 34.13 34.16 2j2u s GLU 188 CO 0.03 -0.17 0.94 0.34 0.02 0.00 0.00 175.26 176.42 2j2u s ASP 189 N 1.10 -0.22 0.96 -0.19 2.15 -0.76 -4.40 116.67 115.31 2j2u s ASP 189 Ca -0.09 -0.33 -0.13 0.00 0.43 0.00 0.00 52.55 52.43 2j2u s ASP 189 Cb -0.12 0.48 0.17 0.00 -0.30 0.00 0.00 42.92 43.14 2j2u s ASP 189 CO -0.04 -0.86 1.14 0.00 -0.17 0.00 0.00 175.17 175.25 2j2u s ALA 190 N -3.27 1.58 0.18 3.66 0.00 -1.26 0.11 121.76 122.75 2j2u s ALA 190 Ca 0.11 -0.61 -0.05 0.00 0.00 0.00 0.00 51.96 51.41 2j2u s ALA 190 Cb -0.01 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 20.12 2j2u s ALA 190 CO -0.00 -2.51 0.33 0.00 0.00 0.00 0.00 175.76 173.58 2j2u n GLN 192 N -0.26 2.52 0.00 0.00 7.27 -1.26 -1.73 117.38 123.92 2j2u n GLN 192 Ca -0.03 0.89 0.00 0.00 0.07 0.00 0.00 57.00 57.93 2j2u n GLN 192 Cb 0.28 -2.64 0.00 0.00 2.41 0.00 0.00 30.24 30.29 2j2u n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2j2u n GLY 193 N 2.05 3.48 0.16 1.69 0.00 -1.26 -0.61 105.19 110.69 2j2u n GLY 193 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.19 2j2u n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2j2u h ASP 194 N 0.00 0.00 -1.73 1.61 3.32 -1.62 -3.29 116.42 114.71 2j2u h ASP 194 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 2j2u h ASP 194 Cb 0.00 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.66 2j2u h ASP 194 CO 0.00 0.20 -0.17 -1.20 -1.72 0.00 0.00 179.24 176.35 2j2u n SER 195 N -3.00 0.09 0.00 6.45 7.64 -1.26 -1.64 113.62 121.90 2j2u n SER 195 Ca 0.01 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2j2u n SER 195 Cb 0.63 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 2j2u n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2j2u n GLY 196 N 1.62 2.08 3.90 0.23 0.00 0.53 -0.38 105.19 113.16 2j2u n GLY 196 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2j2u n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2j2u s GLY 197 N -1.96 1.74 0.23 -0.02 0.00 -0.65 -3.13 107.32 103.53 2j2u s GLY 197 Ca 0.00 -1.11 -0.30 0.00 0.00 0.00 0.00 44.72 43.31 2j2u s GLY 197 CO 0.00 -0.37 1.07 -4.14 0.00 0.00 0.00 173.10 169.66 2j2u s PRO 198 N -5.81 4.66 -0.21 2.90 0.02 -1.26 -1.66 135.00 133.65 2j2u s PRO 198 Ca 0.72 1.70 0.01 0.00 0.02 0.00 0.00 61.00 63.46 2j2u s PRO 198 Cb -0.05 -3.25 0.03 0.00 0.02 0.00 0.00 34.50 31.25 2j2u s PRO 198 CO 0.53 0.22 -0.16 -1.58 -0.33 0.00 0.00 177.00 175.68 2j2u s HIS 199 N -0.78 2.95 0.17 6.54 2.46 -0.72 -2.65 115.29 123.26 2j2u s HIS 199 Ca 0.46 -1.80 0.10 0.00 0.47 0.00 0.00 55.06 54.29 2j2u s HIS 199 Cb -0.30 -1.94 -0.04 0.00 -0.13 0.00 0.00 32.58 30.17 2j2u s HIS 199 CO 0.37 -0.81 -0.22 0.14 -2.47 0.00 0.00 174.74 171.74 2j2u s VAL 200 N 1.25 2.13 -0.06 0.89 -7.23 -0.35 -0.79 120.40 116.23 2j2u s VAL 200 Ca 0.01 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 2j2u s VAL 200 Cb -0.15 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.82 2j2u s VAL 200 CO -0.10 -0.15 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.49 2j2u s THR 201 N -1.68 1.43 0.02 5.32 2.01 -0.24 -0.17 115.64 122.34 2j2u s THR 201 Ca 0.17 -0.68 -0.20 0.00 0.31 0.00 0.00 61.69 61.29 2j2u s THR 201 Cb -0.08 -1.26 -0.06 0.00 0.01 0.00 0.00 72.50 71.12 2j2u s THR 201 CO 0.08 0.42 0.60 -0.60 -0.69 0.00 0.00 174.62 174.43 2j2u s ARG 202 N 0.34 4.30 -0.06 4.92 3.52 -1.26 -1.51 118.95 129.21 2j2u s ARG 202 Ca -0.11 0.76 -0.02 0.00 -0.13 0.00 0.00 55.73 56.23 2j2u s ARG 202 Cb -0.14 -3.31 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2j2u s ARG 202 CO 0.04 0.45 0.03 0.12 -0.81 0.00 0.00 175.30 175.13 2j2u s PHE 203 N -0.47 0.37 -1.32 5.12 5.36 0.84 -4.89 117.98 123.00 2j2u s PHE 203 Ca 0.31 0.03 -0.18 0.00 -0.96 0.00 0.00 56.93 56.13 2j2u s PHE 203 Cb -0.19 -0.65 0.02 0.00 -0.34 0.00 0.00 43.02 41.86 2j2u s PHE 203 CO 0.18 -0.27 0.49 1.63 -1.46 0.00 0.00 175.22 175.79 2j2u n LYS 204 N 5.22 -1.10 -1.55 10.12 5.02 -1.26 -1.32 118.16 133.28 2j2u n LYS 204 Ca -0.05 0.20 -0.19 0.00 -2.02 0.00 0.00 58.31 56.25 2j2u n LYS 204 Cb 0.50 -3.41 -0.08 0.00 -0.02 0.00 0.00 35.03 32.02 2j2u n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2j2u n ASP 205 N -2.57 -5.32 -4.16 4.39 8.00 -1.26 -4.98 116.55 110.66 2j2u n ASP 205 Ca -0.20 0.47 -0.27 0.00 0.71 0.00 0.00 54.79 55.50 2j2u n ASP 205 Cb 0.62 -4.50 -0.16 0.00 -0.02 0.00 0.00 41.12 37.06 2j2u n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2j2u s THR 206 N -2.70 1.57 -0.22 -3.53 2.01 -0.44 -5.12 115.64 107.21 2j2u s THR 206 Ca 0.00 -0.78 -0.08 0.00 0.31 0.00 0.00 61.69 61.14 2j2u s THR 206 Cb 0.00 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 71.12 2j2u s THR 206 CO 0.00 0.45 0.09 -0.31 -0.69 0.00 0.00 174.62 174.16 2j2u s TYR 207 N 0.09 3.19 -0.07 4.92 1.51 -1.26 -0.11 117.35 125.62 2j2u s TYR 207 Ca -0.06 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 55.95 2j2u s TYR 207 Cb -0.13 -2.19 -0.02 0.00 -0.11 0.00 0.00 41.96 39.51 2j2u s TYR 207 CO 0.03 -0.07 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.21 2j2u s PHE 208 N 1.04 2.77 0.02 2.71 0.40 -0.57 -1.85 117.98 122.50 2j2u s PHE 208 Ca 0.05 -0.21 -0.30 0.00 -0.60 0.00 0.00 56.93 55.87 2j2u s PHE 208 Cb -0.14 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.65 2j2u s PHE 208 CO 0.03 0.14 1.33 0.08 0.70 0.00 0.00 175.22 177.51 2j2u s VAL 209 N -0.55 3.81 0.00 -0.44 1.01 0.18 -1.08 120.40 123.33 2j2u s VAL 209 Ca 0.08 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.28 2j2u s VAL 209 Cb -0.12 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2j2u s VAL 209 CO 0.02 0.03 0.00 0.35 0.00 0.00 0.00 175.10 175.49 2j2u n THR 210 N 4.43 0.00 -3.96 3.92 -2.24 0.03 -4.54 114.28 111.91 2j2u n THR 210 Ca 0.12 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.81 2j2u n THR 210 Cb 0.44 0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 68.89 2j2u n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2j2u s GLY 211 N -1.85 0.41 -0.07 3.38 0.00 -0.26 -2.20 107.32 106.73 2j2u s GLY 211 Ca 0.00 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 44.01 2j2u s GLY 211 CO 0.00 -0.55 -0.21 -0.42 0.00 0.00 0.00 173.10 171.92 2j2u s ILE 212 N -3.99 1.80 0.14 0.90 1.01 -0.91 -1.76 121.20 118.39 2j2u s ILE 212 Ca 0.20 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 59.64 2j2u s ILE 212 Cb -0.01 -1.55 -0.10 0.00 0.01 0.00 0.00 42.46 40.80 2j2u s ILE 212 CO 0.07 0.51 1.72 -0.69 0.00 0.00 0.00 174.94 176.55 2j2u s VAL 213 N 0.17 2.52 0.10 2.92 1.01 -0.66 -0.81 120.40 125.65 2j2u s VAL 213 Ca -0.11 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2j2u s VAL 213 Cb -0.15 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2j2u s VAL 213 CO 0.05 0.01 0.00 -0.24 0.00 0.00 0.00 175.10 174.92 2j2u n SER 214 N 4.96 0.84 -3.63 3.32 2.88 -0.73 -0.35 113.62 120.91 2j2u n SER 214 Ca 0.16 0.14 -0.07 0.00 -1.33 0.00 0.00 58.87 57.77 2j2u n SER 214 Cb 0.38 -0.23 -0.01 0.00 -0.75 0.00 0.00 64.21 63.60 2j2u n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2j2u s TRP 215 N -1.83 -0.11 -0.08 0.66 1.48 -0.72 -4.87 118.94 113.47 2j2u s TRP 215 Ca 0.00 -0.39 -0.30 0.00 -1.06 0.00 0.00 56.10 54.35 2j2u s TRP 215 Cb 0.00 0.73 0.12 0.00 -1.16 0.00 0.00 33.47 33.16 2j2u s TRP 215 CO 0.00 -1.28 0.98 0.20 -4.06 0.00 0.00 176.95 172.79 2j2u s GLY 216 N -2.97 -0.37 -0.95 3.67 0.00 -1.26 -0.70 107.32 104.74 2j2u s GLY 216 Ca 0.12 1.43 -0.18 0.00 0.00 0.00 0.00 44.72 46.09 2j2u s GLY 216 CO 0.08 0.58 1.15 -0.54 0.00 0.00 0.00 173.10 174.37 2j2u s GLU 217 N -2.38 3.64 1.93 2.90 2.02 -1.26 -4.87 118.70 120.67 2j2u s GLU 217 Ca 0.04 -1.83 0.00 0.00 0.02 0.00 0.00 54.97 53.20 2j2u s GLU 217 Cb -0.01 -4.93 0.00 0.00 0.10 0.00 0.00 34.13 29.30 2j2u s GLU 217 CO -0.05 -1.77 0.00 0.41 0.02 0.00 0.00 175.26 173.87 2j2u n GLY 219 N 5.39 -1.51 2.94 -1.39 0.00 -1.26 -4.62 105.19 104.74 2j2u n GLY 219 Ca 0.25 -1.31 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 2j2u n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j2u n ALA 221 N 4.28 -1.08 -2.05 0.00 0.00 -1.26 -4.70 120.51 115.70 2j2u n ALA 221 Ca -0.19 0.31 -0.40 0.00 0.00 0.00 0.00 53.44 53.15 2j2u n ALA 221 Cb 0.51 -4.29 -0.05 0.00 0.00 0.00 0.00 19.45 15.61 2j2u n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2j2u s ARG 222 N -5.92 4.68 0.33 0.00 0.52 -1.26 -4.78 118.95 112.53 2j2u s ARG 222 Ca 0.40 1.32 -0.28 0.00 -0.52 0.00 0.00 55.73 56.65 2j2u s ARG 222 Cb -0.18 -3.31 -0.12 0.00 0.52 0.00 0.00 34.95 31.85 2j2u s ARG 222 CO 0.49 0.42 1.32 1.63 0.02 0.00 0.00 175.30 179.17 2j2u n LYS 223 N 2.06 2.16 -0.97 3.54 5.02 -1.26 -1.55 118.16 127.17 2j2u n LYS 223 Ca -0.02 0.76 0.00 0.00 -2.02 0.00 0.00 58.31 57.03 2j2u n LYS 223 Cb 0.49 -2.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.14 2j2u n LYS 223 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j2u n GLY 223 N 0.90 0.41 3.23 0.72 0.00 -0.61 -5.01 105.19 104.82 2j2u n GLY 223 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 2j2u n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j2u s LYS 224 N -0.57 1.06 0.40 1.61 -0.14 -0.59 -4.76 119.74 116.75 2j2u s LYS 224 Ca 0.00 -1.00 0.07 0.00 -1.36 0.00 0.00 55.97 53.69 2j2u s LYS 224 Cb 0.00 -1.19 -0.07 0.00 -1.68 0.00 0.00 37.83 34.88 2j2u s LYS 224 CO 0.00 0.28 0.02 0.71 -0.76 0.00 0.00 175.35 175.60 2j2u s TYR 225 N -1.06 2.52 0.22 3.18 2.02 -1.26 -4.63 117.35 118.33 2j2u s TYR 225 Ca 0.04 -0.63 -0.21 0.00 -0.37 0.00 0.00 57.07 55.90 2j2u s TYR 225 Cb -0.09 -1.74 -0.08 0.00 -0.40 0.00 0.00 41.96 39.64 2j2u s TYR 225 CO 0.03 0.43 0.76 0.20 -1.57 0.00 0.00 175.55 175.40 2j2u s GLY 226 N -3.72 2.69 -0.16 0.71 0.00 -0.53 -4.59 107.32 101.72 2j2u s GLY 226 Ca 0.35 0.24 -0.03 0.00 0.00 0.00 0.00 44.72 45.29 2j2u s GLY 226 CO 0.18 0.64 -0.05 -0.42 0.00 0.00 0.00 173.10 173.46 2j2u s ILE 227 N -1.46 3.76 0.07 0.90 -1.09 0.12 -1.53 121.20 121.97 2j2u s ILE 227 Ca 0.42 -0.40 0.08 0.00 -2.23 0.00 0.00 60.65 58.52 2j2u s ILE 227 Cb -0.18 -2.64 -0.03 0.00 -1.58 0.00 0.00 42.46 38.03 2j2u s ILE 227 CO 0.22 0.49 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.90 2j2u s TYR 228 N 0.42 1.89 0.09 3.97 1.51 0.08 -1.76 117.35 123.55 2j2u s TYR 228 Ca -0.05 -0.39 -0.31 0.00 -1.01 0.00 0.00 57.07 55.31 2j2u s TYR 228 Cb -0.14 -1.09 -0.08 0.00 -0.11 0.00 0.00 41.96 40.54 2j2u s TYR 228 CO 0.03 0.16 1.50 0.99 -1.11 0.00 0.00 175.55 177.12 2j2u s THR 229 N -0.95 3.18 -0.63 -0.71 2.01 0.01 -1.19 115.64 117.37 2j2u s THR 229 Ca 0.08 0.75 -0.28 0.00 0.31 0.00 0.00 61.69 62.55 2j2u s THR 229 Cb -0.09 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 68.96 2j2u s THR 229 CO 0.03 0.03 1.30 -0.75 -0.69 0.00 0.00 174.62 174.54 2j2u s LYS 230 N 1.81 3.32 0.40 4.92 2.20 0.57 -2.14 119.74 130.81 2j2u s LYS 230 Ca 0.68 0.15 0.09 0.00 -0.36 0.00 0.00 55.97 56.53 2j2u s LYS 230 Cb -0.38 -4.11 0.88 0.00 -1.51 0.00 0.00 37.83 32.71 2j2u s LYS 230 CO 0.30 -1.95 1.98 0.28 -0.36 0.00 0.00 175.35 175.60 2j2u h VAL 231 N 6.20 0.98 -0.11 4.02 2.07 -1.76 -2.37 116.25 125.27 2j2u h VAL 231 Ca -0.26 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.08 2j2u h VAL 231 Cb 1.07 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2j2u h VAL 231 CO 1.22 0.11 0.08 0.71 0.02 0.00 0.00 177.57 179.70 2j2u h THR 232 N 0.58 0.97 0.00 2.57 1.35 -1.90 0.46 112.91 116.94 2j2u h THR 232 Ca 0.28 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 66.12 2j2u h THR 232 Cb 0.34 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 2j2u h THR 232 CO -0.09 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 175.19 2j2u h ALA 233 N 1.94 1.00 0.00 6.62 0.00 -1.78 -3.22 119.26 123.82 2j2u h ALA 233 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2j2u h ALA 233 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2j2u h ALA 233 CO -0.00 0.00 -0.15 1.19 0.00 0.00 0.00 179.25 180.29 2j2u n PHE 234 N -2.32 0.00 -0.22 0.00 3.72 0.13 -4.83 117.46 113.94 2j2u n PHE 234 Ca 0.01 -0.60 -0.07 0.00 -0.05 0.00 0.00 57.45 56.74 2j2u n PHE 234 Cb 0.20 -0.10 0.04 0.00 -0.94 0.00 0.00 39.48 38.67 2j2u n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2j2u h LEU 235 N 0.00 0.80 -0.42 4.37 3.38 -1.52 0.13 115.31 122.06 2j2u h LEU 235 Ca 0.00 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 2j2u h LEU 235 Cb 1.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2j2u h LEU 235 CO 0.00 0.69 -0.23 0.11 0.09 0.00 0.00 178.44 179.11 2j2u h LYS 236 N 0.86 0.90 -0.30 1.13 1.57 -1.88 -0.61 116.57 118.24 2j2u h LYS 236 Ca 0.22 -0.40 0.05 0.00 -1.87 0.00 0.00 60.65 58.65 2j2u h LYS 236 Cb 0.09 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 2j2u h LYS 236 CO -0.03 1.05 0.00 2.35 -0.57 0.00 0.00 179.45 182.26 2j2u h TRP 237 N 0.72 -0.01 0.02 -1.35 7.01 -1.81 0.12 115.95 120.65 2j2u h TRP 237 Ca 0.09 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.12 2j2u h TRP 237 Cb 0.80 0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.90 2j2u h TRP 237 CO 0.06 -0.05 -0.05 0.82 -2.79 0.00 0.00 178.44 176.43 2j2u h ILE 238 N 0.09 0.87 -0.45 2.65 2.04 -0.57 0.00 117.51 122.14 2j2u h ILE 238 Ca 0.14 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.08 2j2u h ILE 238 Cb 0.19 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.07 2j2u h ILE 238 CO -0.24 0.00 0.06 0.44 0.00 0.00 0.00 178.15 178.41 2j2u h ASP 239 N -0.10 -0.05 -0.61 1.72 3.32 -0.84 -1.48 116.42 118.37 2j2u h ASP 239 Ca 0.02 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2j2u h ASP 239 Cb 0.12 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 2j2u h ASP 239 CO -0.04 0.01 0.38 0.03 -1.72 0.00 0.00 179.24 177.90 2j2u h ARG 240 N 0.19 0.82 -0.00 3.56 3.08 -0.79 -2.69 114.38 118.55 2j2u h ARG 240 Ca 0.22 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 2j2u h ARG 240 Cb 0.30 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2j2u h ARG 240 CO -0.32 0.57 -0.10 0.77 -1.07 0.00 0.00 179.97 179.83 2j2u h SER 241 N 0.83 0.00 -0.15 7.04 0.02 -0.14 -2.58 113.55 118.58 2j2u h SER 241 Ca 0.22 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2j2u h SER 241 Cb -0.05 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2j2u h SER 241 CO -0.04 0.10 0.00 0.23 -1.14 0.00 0.00 176.83 175.98 2j2u n MET 242 N -4.42 1.41 0.00 3.45 2.81 -0.64 -5.05 117.12 114.69 2j2u n MET 242 Ca -0.03 -0.63 0.01 0.00 -1.81 0.00 0.00 57.70 55.24 2j2u n MET 242 Cb 0.18 -1.23 0.01 0.00 -0.71 0.00 0.00 33.22 31.47 2j2u n MET 242 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11