#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j4e n MET 1 N 0.00 0.00 -0.33 1.43 0.00 -1.26 -4.78 117.12 112.18 2j4e n MET 1 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 57.70 57.90 2j4e n MET 1 Cb 0.00 -0.44 0.41 0.00 0.00 0.00 0.00 33.22 33.19 2j4e n MET 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2j4e h ALA 2 N 0.00 1.77 -0.43 -5.12 0.00 -1.99 -1.16 119.26 112.34 2j4e h ALA 2 Ca 0.00 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2j4e h ALA 2 Cb 0.68 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2j4e h ALA 2 CO 0.00 -0.44 0.26 0.00 0.00 0.00 0.00 179.25 179.07 2j4e h ALA 3 N 1.79 0.55 -0.51 0.00 0.00 -1.93 -2.57 119.26 116.59 2j4e h ALA 3 Ca 0.67 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.59 2j4e h ALA 3 Cb 1.40 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 2j4e h ALA 3 CO -0.56 0.03 0.18 0.77 0.00 0.00 0.00 179.25 179.67 2j4e h SER 4 N 0.57 0.18 0.20 0.00 0.02 -1.52 -2.98 113.55 110.03 2j4e h SER 4 Ca 0.15 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2j4e h SER 4 Cb -0.01 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2j4e h SER 4 CO -0.03 0.13 -0.05 0.18 -1.14 0.00 0.00 176.83 175.92 2j4e n LEU 5 N -5.00 0.47 -4.73 5.07 4.77 -1.08 -4.86 117.00 111.63 2j4e n LEU 5 Ca 0.06 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 2j4e n LEU 5 Cb 0.21 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2j4e n LEU 5 CO 0.24 0.08 1.26 0.54 -1.33 0.00 0.00 177.39 178.18 2j4e s VAL 6 N -2.25 2.25 -1.61 4.08 0.11 -0.99 -2.17 120.40 119.81 2j4e s VAL 6 Ca 0.36 0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.61 2j4e s VAL 6 Cb 0.21 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.93 2j4e s VAL 6 CO 0.42 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.82 2j4e n GLY 7 N 3.01 0.67 3.62 6.54 0.00 -1.06 -4.99 105.19 112.98 2j4e n GLY 7 Ca 0.11 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 2j4e n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j4e s LYS 8 N -4.14 2.20 -0.10 1.61 -0.14 -0.92 -4.88 119.74 113.37 2j4e s LYS 8 Ca 0.00 -1.46 -0.24 0.00 -1.36 0.00 0.00 55.97 52.92 2j4e s LYS 8 Cb 0.00 -2.11 -0.03 0.00 -1.68 0.00 0.00 37.83 34.01 2j4e s LYS 8 CO 0.00 0.36 0.74 0.21 -0.76 0.00 0.00 175.35 175.90 2j4e s LYS 9 N -3.61 4.39 -0.19 1.68 2.20 -1.26 -0.91 119.74 122.05 2j4e s LYS 9 Ca 0.31 0.91 0.01 0.00 -0.36 0.00 0.00 55.97 56.84 2j4e s LYS 9 Cb -0.06 -3.49 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2j4e s LYS 9 CO 0.19 -0.05 -0.11 0.42 -0.36 0.00 0.00 175.35 175.44 2j4e s ILE 10 N 1.20 1.59 -0.43 5.43 1.01 0.20 -4.63 121.20 125.57 2j4e s ILE 10 Ca 0.38 -0.91 -0.29 0.00 0.00 0.00 0.00 60.65 59.83 2j4e s ILE 10 Cb -0.17 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.67 2j4e s ILE 10 CO 0.17 0.23 1.30 -0.69 0.00 0.00 0.00 174.94 175.94 2j4e s VAL 11 N 1.43 4.03 -0.48 2.92 1.01 -0.90 -2.77 120.40 125.64 2j4e s VAL 11 Ca 0.00 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.76 2j4e s VAL 11 Cb -0.15 -4.36 0.03 0.00 0.00 0.00 0.00 36.38 31.90 2j4e s VAL 11 CO -0.09 -0.84 1.09 0.12 0.00 0.00 0.00 175.10 175.38 2j4e s PHE 12 N 5.00 2.82 -0.42 5.22 5.36 -0.11 -1.24 117.98 134.62 2j4e s PHE 12 Ca 0.56 0.59 -0.17 0.00 -0.96 0.00 0.00 56.93 56.94 2j4e s PHE 12 Cb -0.11 -4.33 0.02 0.00 -0.34 0.00 0.00 43.02 38.26 2j4e s PHE 12 CO 0.32 -1.26 0.44 0.54 -1.46 0.00 0.00 175.22 173.79 2j4e s VAL 13 N 4.31 5.09 -0.16 3.12 0.11 -0.36 -1.85 120.40 130.66 2j4e s VAL 13 Ca 0.44 -0.34 -0.29 0.00 -2.93 0.00 0.00 61.98 58.87 2j4e s VAL 13 Cb -0.08 -4.03 0.09 0.00 -1.53 0.00 0.00 36.38 30.83 2j4e s VAL 13 CO 0.30 -0.42 0.81 0.28 -3.33 0.00 0.00 175.10 172.75 2j4e s THR 14 N 2.14 0.00 -0.21 5.04 -1.32 -0.90 -4.69 115.64 115.70 2j4e s THR 14 Ca 0.12 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.75 2j4e s THR 14 Cb -0.17 -1.00 0.58 0.00 -1.51 0.00 0.00 72.50 70.40 2j4e s THR 14 CO 0.14 0.00 1.50 0.61 -2.21 0.00 0.00 174.62 174.66 2j4e n GLY 15 N 1.45 4.00 3.07 6.08 0.00 -1.26 -3.87 105.19 114.66 2j4e n GLY 15 Ca -0.15 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 44.48 2j4e n GLY 15 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2j4e s ASN 16 N -1.80 5.04 0.29 1.61 3.84 -1.26 -4.99 114.94 117.67 2j4e s ASN 16 Ca 0.45 -2.19 -0.03 0.00 0.21 0.00 0.00 52.86 51.31 2j4e s ASN 16 Cb 0.37 -1.75 0.41 0.00 -0.55 0.00 0.00 41.25 39.73 2j4e s ASN 16 CO 0.09 -0.46 1.95 0.00 -2.79 0.00 0.00 177.10 175.89 2j4e h ALA 17 N 7.75 1.37 -0.23 1.71 0.00 -1.99 -0.79 119.26 127.07 2j4e h ALA 17 Ca -0.09 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2j4e h ALA 17 Cb 1.02 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2j4e h ALA 17 CO 0.64 0.56 -0.33 0.87 0.00 0.00 0.00 179.25 181.00 2j4e h LYS 18 N 1.13 0.63 -0.62 0.00 1.57 -2.00 -2.79 116.57 114.49 2j4e h LYS 18 Ca 0.30 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2j4e h LYS 18 Cb -0.10 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2j4e h LYS 18 CO -0.06 0.98 0.34 -0.22 -0.57 0.00 0.00 179.45 179.92 2j4e h LYS 19 N 0.33 0.87 -0.71 3.15 3.64 -1.92 -2.93 116.57 119.01 2j4e h LYS 19 Ca 0.03 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2j4e h LYS 19 Cb 0.91 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 2j4e h LYS 19 CO 0.08 0.65 0.46 1.25 -2.27 0.00 0.00 179.45 179.62 2j4e h LEU 20 N 0.85 0.80 -0.81 5.20 5.85 -1.13 -2.70 115.31 123.37 2j4e h LEU 20 Ca 0.22 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.82 2j4e h LEU 20 Cb 0.04 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2j4e h LEU 20 CO -0.04 0.58 -0.23 -0.08 -0.34 0.00 0.00 178.44 178.33 2j4e h GLU 21 N 0.95 0.64 -0.80 1.25 4.57 -1.44 -2.13 114.58 117.61 2j4e h GLU 21 Ca 0.26 -0.25 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 2j4e h GLU 21 Cb -0.09 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.42 2j4e h GLU 21 CO -0.06 0.82 0.42 0.93 -1.18 0.00 0.00 179.01 179.93 2j4e h GLU 22 N 0.57 1.12 -0.11 1.92 5.08 -1.30 -0.51 114.58 121.35 2j4e h GLU 22 Ca 0.08 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2j4e h GLU 22 Cb 0.69 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2j4e h GLU 22 CO 0.05 0.84 -0.05 0.28 -1.00 0.00 0.00 179.01 179.13 2j4e h VAL 23 N 1.12 1.32 -0.16 3.13 2.07 -1.18 -0.45 116.25 122.10 2j4e h VAL 23 Ca 0.28 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2j4e h VAL 23 Cb 0.06 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2j4e h VAL 23 CO -0.04 0.30 0.10 0.58 0.02 0.00 0.00 177.57 178.53 2j4e h VAL 24 N -0.13 1.04 0.03 2.57 2.07 -1.26 0.12 116.25 120.70 2j4e h VAL 24 Ca 0.02 -0.09 -0.21 0.00 0.82 0.00 0.00 66.70 67.25 2j4e h VAL 24 Cb 0.50 0.81 0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2j4e h VAL 24 CO 0.02 0.04 -0.84 1.56 0.02 0.00 0.00 177.57 178.37 2j4e h GLN 25 N 0.22 0.52 -0.11 1.57 1.08 -0.94 -3.37 115.11 114.08 2j4e h GLN 25 Ca 0.06 -0.59 -0.09 0.00 -1.45 0.00 0.00 58.65 56.57 2j4e h GLN 25 Cb -0.02 0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 2j4e h GLN 25 CO -0.01 1.22 -0.30 0.82 -0.95 0.00 0.00 178.83 179.61 2j4e h ILE 26 N 0.07 1.39 -2.22 2.54 2.04 -0.60 -3.35 117.51 117.39 2j4e h ILE 26 Ca -0.11 -1.62 -0.63 0.00 1.00 0.00 0.00 64.86 63.50 2j4e h ILE 26 Cb 1.54 2.15 -0.13 0.00 -0.74 0.00 0.00 36.82 39.64 2j4e h ILE 26 CO 0.16 0.48 0.91 -0.76 0.00 0.00 0.00 178.15 178.93 2j4e s LEU 27 N -8.79 4.21 0.00 1.44 1.43 0.39 -5.02 118.68 112.35 2j4e s LEU 27 Ca -0.14 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.64 2j4e s LEU 27 Cb 0.05 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.80 2j4e s LEU 27 CO 0.78 -1.40 0.00 0.61 0.23 0.00 0.00 176.35 176.57 2j4e n GLY 28 N 5.71 -0.26 0.31 -3.19 0.00 -1.26 -4.67 105.19 101.83 2j4e n GLY 28 Ca 0.13 -1.41 0.18 0.00 0.00 0.00 0.00 46.02 44.92 2j4e n GLY 28 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2j4e h ASP 29 N 0.00 0.00 -2.84 1.61 3.45 -1.94 -3.35 116.42 113.36 2j4e h ASP 29 Ca 0.00 0.00 -0.69 0.00 0.43 0.00 0.00 57.03 56.77 2j4e h ASP 29 Cb 0.00 0.00 -0.19 0.00 -0.56 0.00 0.00 39.33 38.58 2j4e h ASP 29 CO 0.00 0.01 0.34 -0.54 -1.57 0.00 0.00 179.24 177.48 2j4e s LYS 30 N -4.42 3.23 -0.18 3.56 1.02 -1.26 -4.95 119.74 116.73 2j4e s LYS 30 Ca -0.05 -1.43 -0.07 0.00 0.02 0.00 0.00 55.97 54.44 2j4e s LYS 30 Cb 0.14 -4.41 0.08 0.00 -0.52 0.00 0.00 37.83 33.12 2j4e s LYS 30 CO 0.50 -1.62 0.38 0.12 -0.92 0.00 0.00 175.35 173.81 2j4e s PHE 31 N 2.70 -0.68 0.30 3.18 5.36 -1.26 -4.99 117.98 122.60 2j4e s PHE 31 Ca 0.18 1.35 0.07 0.00 -0.96 0.00 0.00 56.93 57.57 2j4e s PHE 31 Cb -0.17 0.21 0.81 0.00 -0.34 0.00 0.00 43.02 43.53 2j4e s PHE 31 CO 0.02 -0.43 1.71 -1.35 -1.46 0.00 0.00 175.22 173.71 2j4e h PRO 32 N 8.09 0.45 -6.74 10.12 0.11 -1.93 -3.42 132.00 138.67 2j4e h PRO 32 Ca -0.18 -0.03 -0.44 0.00 0.11 0.00 0.00 66.00 65.47 2j4e h PRO 32 Cb 1.12 -0.10 0.04 0.00 0.11 0.00 0.00 31.00 32.16 2j4e h PRO 32 CO 0.14 0.30 -0.08 0.00 -0.21 0.00 0.00 178.00 178.15 2j4e s THR 34 N -2.65 3.83 -0.04 0.00 2.01 -0.08 -4.93 115.64 113.76 2j4e s THR 34 Ca 0.55 -0.36 -0.08 0.00 0.31 0.00 0.00 61.69 62.10 2j4e s THR 34 Cb -0.10 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 2j4e s THR 34 CO 0.37 0.45 0.25 -0.76 -0.69 0.00 0.00 174.62 174.25 2j4e s LEU 35 N 0.80 4.40 -0.03 4.42 1.43 -1.26 -0.63 118.68 127.81 2j4e s LEU 35 Ca -0.01 0.61 -0.01 0.00 -1.03 0.00 0.00 54.13 53.70 2j4e s LEU 35 Cb -0.14 -2.43 0.03 0.00 0.03 0.00 0.00 46.19 43.68 2j4e s LEU 35 CO 0.02 0.33 0.04 -0.69 0.23 0.00 0.00 176.35 176.28 2j4e s VAL 36 N -1.15 -0.08 0.45 -1.59 1.01 -1.12 -4.95 120.40 112.98 2j4e s VAL 36 Ca 0.22 0.28 -0.17 0.00 0.00 0.00 0.00 61.98 62.31 2j4e s VAL 36 Cb -0.13 -0.11 -0.09 0.00 0.00 0.00 0.00 36.38 36.05 2j4e s VAL 36 CO 0.11 0.12 0.92 0.00 0.00 0.00 0.00 175.10 176.25 2j4e s ALA 37 N 1.41 3.11 -0.22 5.51 0.00 -1.26 -0.94 121.76 129.38 2j4e s ALA 37 Ca -0.05 0.20 -0.07 0.00 0.00 0.00 0.00 51.96 52.04 2j4e s ALA 37 Cb -0.13 -3.05 0.10 0.00 0.00 0.00 0.00 23.12 20.05 2j4e s ALA 37 CO -0.03 -0.03 0.46 -1.14 0.00 0.00 0.00 175.76 175.02 2j4e s GLN 38 N -3.63 0.37 -0.63 0.00 0.74 -0.77 -4.89 119.66 110.85 2j4e s GLN 38 Ca 0.59 1.08 -0.27 0.00 0.05 0.00 0.00 55.36 56.80 2j4e s GLN 38 Cb -0.10 0.38 0.02 0.00 1.10 0.00 0.00 33.01 34.41 2j4e s GLN 38 CO 0.24 -0.27 1.41 0.15 -0.55 0.00 0.00 175.29 176.26 2j4e s LYS 39 N 2.66 3.20 -0.08 1.67 1.02 -1.25 -2.11 119.74 124.85 2j4e s LYS 39 Ca -0.01 0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.21 2j4e s LYS 39 Cb -0.12 -4.17 0.02 0.00 -0.52 0.00 0.00 37.83 33.04 2j4e s LYS 39 CO -0.14 -2.09 -0.06 0.42 -0.92 0.00 0.00 175.35 172.56 2j4e s ILE 40 N 6.25 0.79 -0.88 2.17 1.01 -1.26 -4.97 121.20 124.30 2j4e s ILE 40 Ca 0.48 -0.20 -0.24 0.00 0.00 0.00 0.00 60.65 60.68 2j4e s ILE 40 Cb -0.10 -0.81 0.05 0.00 0.01 0.00 0.00 42.46 41.61 2j4e s ILE 40 CO 0.21 0.31 1.32 -0.62 0.00 0.00 0.00 174.94 176.16 2j4e s ASP 41 N 1.33 6.37 0.32 3.58 -1.08 -1.26 -4.44 116.67 121.48 2j4e s ASP 41 Ca -0.03 -1.13 -0.25 0.00 -0.52 0.00 0.00 52.55 50.61 2j4e s ASP 41 Cb -0.14 -2.54 -0.10 0.00 -1.46 0.00 0.00 42.92 38.69 2j4e s ASP 41 CO -0.03 -1.57 0.93 -0.76 0.52 0.00 0.00 175.17 174.26 2j4e s LEU 42 N 4.93 4.32 0.10 -1.34 1.43 -1.26 -5.03 118.68 121.82 2j4e s LEU 42 Ca 0.39 1.80 -0.30 0.00 -1.03 0.00 0.00 54.13 54.99 2j4e s LEU 42 Cb -0.05 -4.02 -0.06 0.00 0.03 0.00 0.00 46.19 42.10 2j4e s LEU 42 CO 0.00 -0.08 1.09 -2.16 0.23 0.00 0.00 176.35 175.44 2j4e s PRO 43 N -2.10 4.55 -0.10 1.29 0.04 -1.26 -5.05 135.00 132.37 2j4e s PRO 43 Ca 0.50 1.64 0.01 0.00 0.04 0.00 0.00 61.00 63.19 2j4e s PRO 43 Cb -0.18 -3.35 -0.02 0.00 0.04 0.00 0.00 34.50 30.99 2j4e s PRO 43 CO 0.23 -0.04 -0.13 -1.21 0.04 0.00 0.00 177.00 175.90 2j4e s GLU 44 N 0.41 3.02 0.62 4.56 2.02 -1.26 -4.79 118.70 123.28 2j4e s GLU 44 Ca 0.53 -0.67 -0.14 0.00 0.02 0.00 0.00 54.97 54.71 2j4e s GLU 44 Cb -0.27 -2.55 -0.03 0.00 0.10 0.00 0.00 34.13 31.39 2j4e s GLU 44 CO 0.31 0.40 1.05 0.71 0.02 0.00 0.00 175.26 177.75 2j4e s TYR 45 N -0.15 3.15 0.44 1.61 2.02 -1.26 -5.05 117.35 118.11 2j4e s TYR 45 Ca -0.00 1.46 -0.22 0.00 -0.37 0.00 0.00 57.07 57.94 2j4e s TYR 45 Cb -0.13 -2.91 -0.09 0.00 -0.40 0.00 0.00 41.96 38.42 2j4e s TYR 45 CO 0.03 -1.01 1.03 -0.65 -1.57 0.00 0.00 175.55 173.38 2j4e s GLN 46 N -4.48 4.01 0.00 -0.62 -0.21 -1.26 -4.85 119.66 112.26 2j4e s GLN 46 Ca 0.60 1.38 0.00 0.00 0.02 0.00 0.00 55.36 57.36 2j4e s GLN 46 Cb -0.14 -2.29 0.00 0.00 1.00 0.00 0.00 33.01 31.58 2j4e s GLN 46 CO 0.43 -0.25 0.00 0.41 -2.12 0.00 0.00 175.29 173.76 2j4e n GLY 47 N -0.07 0.27 3.77 3.09 0.00 -1.26 -4.93 105.19 106.06 2j4e n GLY 47 Ca 0.07 -1.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 2j4e n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j4e s GLU 48 N -2.00 4.63 0.32 1.61 0.41 -1.26 -4.90 118.70 117.51 2j4e s GLU 48 Ca 0.00 1.42 0.09 0.00 -0.41 0.00 0.00 54.97 56.06 2j4e s GLU 48 Cb 0.00 -2.94 0.93 0.00 -1.78 0.00 0.00 34.13 30.35 2j4e s GLU 48 CO 0.00 0.31 1.63 -1.35 -0.49 0.00 0.00 175.26 175.36 2j4e h PRO 49 N 3.43 0.18 -0.06 0.39 0.11 -1.99 -1.40 132.00 132.66 2j4e h PRO 49 Ca -0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2j4e h PRO 49 Cb 1.20 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2j4e h PRO 49 CO 0.66 0.12 -0.01 -0.44 -0.21 0.00 0.00 178.00 178.12 2j4e h ASP 50 N 0.19 0.11 0.32 -2.05 5.19 -2.00 -2.83 116.42 115.35 2j4e h ASP 50 Ca 0.66 -0.35 -0.04 0.00 -0.62 0.00 0.00 57.03 56.68 2j4e h ASP 50 Cb 1.48 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.95 2j4e h ASP 50 CO -0.69 0.44 -0.20 -0.08 -3.12 0.00 0.00 179.24 175.58 2j4e h GLU 51 N -0.21 0.00 -0.37 3.56 4.57 -1.68 -1.27 114.58 119.18 2j4e h GLU 51 Ca 0.02 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.12 2j4e h GLU 51 Cb 0.39 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 2j4e h GLU 51 CO 0.01 0.20 -0.09 0.82 -1.18 0.00 0.00 179.01 178.77 2j4e h ILE 52 N 0.00 1.28 -0.12 2.32 2.04 -1.34 -2.84 117.51 118.85 2j4e h ILE 52 Ca -0.00 -1.15 -0.10 0.00 1.00 0.00 0.00 64.86 64.60 2j4e h ILE 52 Cb 0.42 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 2j4e h ILE 52 CO 0.03 0.38 -0.32 0.28 0.00 0.00 0.00 178.15 178.52 2j4e h SER 53 N 0.51 0.48 -0.65 1.72 0.02 -1.14 -0.43 113.55 114.06 2j4e h SER 53 Ca 0.09 -0.59 0.09 0.00 -0.84 0.00 0.00 61.79 60.54 2j4e h SER 53 Cb 0.60 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 2j4e h SER 53 CO 0.04 0.98 0.29 0.40 -1.14 0.00 0.00 176.83 177.40 2j4e h ILE 54 N 0.01 0.83 -0.30 3.27 2.04 -1.35 0.94 117.51 122.94 2j4e h ILE 54 Ca -0.01 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2j4e h ILE 54 Cb 0.93 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2j4e h ILE 54 CO 0.07 0.09 -0.03 1.56 0.00 0.00 0.00 178.15 179.84 2j4e h GLN 55 N 0.51 0.56 -0.97 2.37 1.08 -1.48 -1.87 115.11 115.30 2j4e h GLN 55 Ca 0.32 -0.19 0.02 0.00 -1.45 0.00 0.00 58.65 57.35 2j4e h GLN 55 Cb 0.35 -0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 27.69 2j4e h GLN 55 CO -0.27 0.72 0.64 -0.22 -0.95 0.00 0.00 178.83 178.75 2j4e h LYS 56 N 0.34 1.24 -0.20 1.46 3.64 -0.52 0.03 116.57 122.56 2j4e h LYS 56 Ca 0.08 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2j4e h LYS 56 Cb 0.50 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2j4e h LYS 56 CO 0.02 0.82 -0.04 0.00 -2.27 0.00 0.00 179.45 177.98 2j4e h GLN 58 N 0.11 0.42 -0.40 0.00 4.20 -0.96 0.69 115.11 119.16 2j4e h GLN 58 Ca 0.05 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.61 2j4e h GLN 58 Cb 0.48 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2j4e h GLN 58 CO 0.02 0.33 -0.20 1.49 -0.67 0.00 0.00 178.83 179.80 2j4e h GLU 59 N 0.43 0.78 -0.15 1.46 4.57 -0.85 -2.23 114.58 118.57 2j4e h GLU 59 Ca 0.11 -0.30 -0.02 0.00 -1.18 0.00 0.00 59.36 57.97 2j4e h GLU 59 Cb 0.04 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2j4e h GLU 59 CO -0.02 0.91 0.02 0.00 -1.18 0.00 0.00 179.01 178.74 2j4e h ALA 60 N 1.09 0.21 -0.83 2.92 0.00 -0.32 -2.96 119.26 119.37 2j4e h ALA 60 Ca 0.10 -0.17 0.15 0.00 0.00 0.00 0.00 54.91 54.99 2j4e h ALA 60 Cb 0.70 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.34 2j4e h ALA 60 CO 0.05 -0.12 0.40 0.28 0.00 0.00 0.00 179.25 179.86 2j4e h VAL 61 N 0.03 0.68 0.00 0.00 2.07 -0.82 0.53 116.25 118.74 2j4e h VAL 61 Ca 0.05 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2j4e h VAL 61 Cb 0.33 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2j4e h VAL 61 CO 0.00 0.10 0.00 0.54 0.02 0.00 0.00 177.57 178.24 2j4e n ARG 62 N -4.92 0.01 -0.12 1.57 1.74 -0.85 -1.21 116.66 112.88 2j4e n ARG 62 Ca 0.17 0.11 -0.20 0.00 -0.77 0.00 0.00 57.85 57.15 2j4e n ARG 62 Cb 0.45 -1.51 -0.09 0.00 -1.02 0.00 0.00 32.46 30.29 2j4e n ARG 62 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2j4e n GLN 63 N -1.53 0.53 0.05 5.56 6.02 -0.23 -4.74 117.38 123.05 2j4e n GLN 63 Ca 0.06 0.17 -0.15 0.00 -0.01 0.00 0.00 57.00 57.07 2j4e n GLN 63 Cb 0.28 -1.40 -0.14 0.00 1.02 0.00 0.00 30.24 30.00 2j4e n GLN 63 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2j4e h VAL 64 N -0.41 1.16 0.00 5.09 2.07 -0.10 -3.48 116.25 120.58 2j4e h VAL 64 Ca -0.55 -2.83 0.00 0.00 0.82 0.00 0.00 66.70 64.14 2j4e h VAL 64 Cb 1.65 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 34.15 2j4e h VAL 64 CO -0.22 0.80 0.00 0.00 0.02 0.00 0.00 177.57 178.18 2j4e n GLN 65 N -3.41 0.00 0.00 1.57 10.64 -0.35 -4.95 117.38 120.88 2j4e n GLN 65 Ca -0.15 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.02 2j4e n GLN 65 Cb 1.04 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.42 2j4e n GLN 65 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2j4e n GLY 66 N 0.00 -1.00 3.77 2.61 0.00 -1.26 -4.99 105.19 104.32 2j4e n GLY 66 Ca 0.00 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.99 2j4e n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j4e s PRO 67 N -1.56 4.29 0.04 1.61 0.04 -1.24 -4.82 135.00 133.36 2j4e s PRO 67 Ca 0.00 1.91 -0.10 0.00 0.04 0.00 0.00 61.00 62.84 2j4e s PRO 67 Cb 0.00 -2.91 0.01 0.00 0.04 0.00 0.00 34.50 31.64 2j4e s PRO 67 CO 0.00 -0.13 0.22 0.54 0.04 0.00 0.00 177.00 177.66 2j4e s VAL 68 N -1.29 0.10 -0.01 -0.36 0.11 -0.66 -2.11 120.40 116.19 2j4e s VAL 68 Ca 0.52 -0.84 0.02 0.00 -2.93 0.00 0.00 61.98 58.74 2j4e s VAL 68 Cb -0.33 -0.91 -0.00 0.00 -1.53 0.00 0.00 36.38 33.61 2j4e s VAL 68 CO 0.42 -0.46 -0.06 -0.22 -3.33 0.00 0.00 175.10 171.45 2j4e s LEU 69 N -2.06 1.95 0.19 2.54 2.96 -0.37 -2.03 118.68 121.85 2j4e s LEU 69 Ca -0.05 -0.11 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2j4e s LEU 69 Cb -0.01 -0.32 -0.04 0.00 0.50 0.00 0.00 46.19 46.32 2j4e s LEU 69 CO -0.04 0.06 0.08 0.68 -1.32 0.00 0.00 176.35 175.82 2j4e s VAL 70 N -0.05 0.24 -0.05 1.68 -7.23 -0.69 -1.23 120.40 113.08 2j4e s VAL 70 Ca 0.01 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 57.92 2j4e s VAL 70 Cb -0.03 -2.33 0.06 0.00 0.56 0.00 0.00 36.38 34.64 2j4e s VAL 70 CO -0.00 -0.21 0.64 -1.83 -0.31 0.00 0.00 175.10 173.38 2j4e s GLU 71 N -4.06 1.01 0.10 4.82 4.04 -1.26 -1.02 118.70 122.32 2j4e s GLU 71 Ca 0.32 0.21 0.08 0.00 0.04 0.00 0.00 54.97 55.62 2j4e s GLU 71 Cb 0.07 0.48 -0.03 0.00 0.02 0.00 0.00 34.13 34.66 2j4e s GLU 71 CO 0.08 -0.31 -0.20 -0.51 -1.84 0.00 0.00 175.26 172.48 2j4e s ASP 72 N -1.19 2.41 -0.17 0.83 1.01 -0.91 -5.01 116.67 113.64 2j4e s ASP 72 Ca -0.11 -0.69 -0.01 0.00 0.71 0.00 0.00 52.55 52.45 2j4e s ASP 72 Cb -0.01 -0.13 0.05 0.00 1.01 0.00 0.00 42.92 43.85 2j4e s ASP 72 CO 0.09 0.03 -0.01 -0.89 0.21 0.00 0.00 175.17 174.61 2j4e s THR 73 N -1.23 0.80 -0.03 -1.27 2.01 -1.26 -1.59 115.64 113.06 2j4e s THR 73 Ca 0.06 -0.56 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 2j4e s THR 73 Cb -0.10 -1.13 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 2j4e s THR 73 CO 0.04 -0.02 0.34 0.00 -0.69 0.00 0.00 174.62 174.29 2j4e s LEU 75 N -1.03 3.75 -0.23 0.00 2.96 -1.14 -0.58 118.68 122.41 2j4e s LEU 75 Ca 0.21 -0.92 -0.01 0.00 -0.22 0.00 0.00 54.13 53.20 2j4e s LEU 75 Cb -0.15 -1.79 0.02 0.00 0.50 0.00 0.00 46.19 44.76 2j4e s LEU 75 CO 0.11 -0.21 -0.09 0.00 -1.32 0.00 0.00 176.35 174.84 2j4e s PHE 77 N 1.34 3.47 0.26 0.00 0.08 -0.40 -0.70 117.98 122.02 2j4e s PHE 77 Ca 0.02 0.80 0.02 0.00 0.12 0.00 0.00 56.93 57.89 2j4e s PHE 77 Cb -0.16 -2.54 0.33 0.00 -0.57 0.00 0.00 43.02 40.08 2j4e s PHE 77 CO -0.06 0.11 1.65 -0.91 -0.10 0.00 0.00 175.22 175.91 2j4e h ASN 78 N 6.92 0.47 -0.48 1.36 -0.26 -1.58 0.13 115.58 122.14 2j4e h ASN 78 Ca -0.39 -0.19 0.06 0.00 -0.56 0.00 0.00 56.30 55.21 2j4e h ASN 78 Cb 1.17 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 38.27 2j4e h ASN 78 CO 0.75 0.80 0.32 0.00 -1.06 0.00 0.00 177.43 178.25 2j4e h ALA 79 N 1.22 1.94 -0.88 -0.83 0.00 -1.76 -2.23 119.26 116.72 2j4e h ALA 79 Ca 0.04 -0.02 -0.39 0.00 0.00 0.00 0.00 54.91 54.55 2j4e h ALA 79 Cb 0.83 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.29 2j4e h ALA 79 CO 0.07 -0.02 0.49 1.28 0.00 0.00 0.00 179.25 181.06 2j4e n LEU 80 N -4.47 6.46 -0.19 0.00 4.77 -0.94 -4.92 117.00 117.71 2j4e n LEU 80 Ca 0.06 -3.45 -0.02 0.00 -0.03 0.00 0.00 56.01 52.57 2j4e n LEU 80 Cb 0.25 -0.80 -0.01 0.00 -2.33 0.00 0.00 43.42 40.53 2j4e n LEU 80 CO 0.34 0.95 -0.02 0.61 -1.33 0.00 0.00 177.39 177.94 2j4e n GLY 81 N -0.72 0.44 0.00 -0.72 0.00 -0.84 -2.00 105.19 101.35 2j4e n GLY 81 Ca 0.52 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2j4e n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j4e n GLY 82 N -0.87 0.35 3.86 -0.02 0.00 0.41 -4.98 105.19 103.94 2j4e n GLY 82 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 2j4e n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j4e s LEU 83 N 0.00 3.06 0.32 0.99 1.43 -0.85 -2.67 118.68 120.96 2j4e s LEU 83 Ca 0.00 1.33 0.25 0.00 -1.03 0.00 0.00 54.13 54.68 2j4e s LEU 83 Cb 0.00 -4.24 1.11 0.00 0.03 0.00 0.00 46.19 43.08 2j4e s LEU 83 CO 0.00 -1.18 1.76 1.55 0.23 0.00 0.00 176.35 178.71 2j4e h PRO 84 N -0.54 0.00 0.00 1.29 0.13 -1.87 -1.05 132.00 129.97 2j4e h PRO 84 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2j4e h PRO 84 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2j4e h PRO 84 CO 0.62 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2j4e n GLY 85 N -0.25 3.47 0.00 1.56 0.00 -0.23 -1.18 105.19 108.57 2j4e n GLY 85 Ca 0.01 0.22 0.09 0.00 0.00 0.00 0.00 46.02 46.35 2j4e n GLY 85 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2j4e n PRO 86 N 14.00 0.26 -0.88 1.61 -0.04 -1.26 -2.40 135.00 146.29 2j4e n PRO 86 Ca 0.00 0.11 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 2j4e n PRO 86 Cb 0.00 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.33 2j4e n PRO 86 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2j4e n TYR 87 N -1.30 2.04 0.07 0.54 4.01 -0.33 -4.62 117.16 117.57 2j4e n TYR 87 Ca 0.09 -0.86 0.00 0.00 -0.16 0.00 0.00 57.90 56.97 2j4e n TYR 87 Cb 0.16 -0.53 0.31 0.00 -0.31 0.00 0.00 39.34 38.97 2j4e n TYR 87 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 2j4e h ILE 88 N 3.46 1.21 -0.88 -0.72 6.09 -1.59 -2.59 117.51 122.49 2j4e h ILE 88 Ca 0.06 -0.95 0.16 0.00 -1.37 0.00 0.00 64.86 62.76 2j4e h ILE 88 Cb 2.01 1.21 -0.07 0.00 0.47 0.00 0.00 36.82 40.44 2j4e h ILE 88 CO 0.52 0.30 0.57 0.50 -3.07 0.00 0.00 178.15 176.97 2j4e h LYS 89 N 0.33 0.60 0.06 2.19 3.64 -1.87 -0.42 116.57 121.10 2j4e h LYS 89 Ca 0.06 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2j4e h LYS 89 Cb 0.46 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2j4e h LYS 89 CO 0.03 0.40 -0.40 -1.49 -2.27 0.00 0.00 179.45 175.71 2j4e h TRP 90 N 0.62 0.23 -0.70 1.91 4.06 -1.83 -2.55 115.95 117.68 2j4e h TRP 90 Ca 0.45 -0.17 0.05 0.00 2.06 0.00 0.00 58.89 61.29 2j4e h TRP 90 Cb 0.82 -0.01 -0.05 0.00 -1.00 0.00 0.00 29.16 28.92 2j4e h TRP 90 CO -0.00 1.16 0.41 0.74 -3.56 0.00 0.00 178.44 177.18 2j4e h PHE 91 N -0.73 0.75 -0.46 0.49 0.04 -1.44 -2.05 116.94 113.54 2j4e h PHE 91 Ca -0.08 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.69 2j4e h PHE 91 Cb 1.29 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 39.18 2j4e h PHE 91 CO 0.24 0.38 0.16 1.25 -0.60 0.00 0.00 178.31 179.74 2j4e h LEU 92 N 0.76 0.60 -1.04 1.54 5.85 -1.15 0.11 115.31 121.98 2j4e h LEU 92 Ca 0.31 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.85 2j4e h LEU 92 Cb 0.16 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2j4e h LEU 92 CO -0.17 0.56 -0.46 -0.08 -0.34 0.00 0.00 178.44 177.96 2j4e h GLU 93 N 0.66 0.05 0.00 1.25 4.81 -0.97 -2.50 114.58 117.88 2j4e h GLU 93 Ca 0.16 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2j4e h GLU 93 Cb 0.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2j4e h GLU 93 CO -0.01 0.50 -1.68 1.63 -0.73 0.00 0.00 179.01 178.72 2j4e n LYS 94 N -3.99 0.51 0.00 1.92 4.76 -0.83 -4.74 118.16 115.79 2j4e n LYS 94 Ca -0.02 -0.14 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 2j4e n LYS 94 Cb 0.49 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 2j4e n LYS 94 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2j4e n LEU 95 N -2.02 0.00 -1.16 -0.35 4.77 0.32 -5.07 117.00 113.49 2j4e n LEU 95 Ca -0.02 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.11 2j4e n LEU 95 Cb 0.48 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.52 2j4e n LEU 95 CO 0.44 0.00 -0.37 0.29 -1.33 0.00 0.00 177.39 176.42 2j4e n LYS 96 N -1.17 -2.52 -0.26 3.23 4.76 -0.94 -2.00 118.16 119.25 2j4e n LYS 96 Ca 0.00 1.89 0.14 0.00 -2.87 0.00 0.00 58.31 57.46 2j4e n LYS 96 Cb 0.13 -3.01 0.41 0.00 -1.84 0.00 0.00 35.03 30.72 2j4e n LYS 96 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2j4e h PRO 97 N -1.12 0.61 -0.31 1.97 0.11 -1.86 -2.41 132.00 128.99 2j4e h PRO 97 Ca -0.07 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 66.07 2j4e h PRO 97 Cb 1.09 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.99 2j4e h PRO 97 CO 0.04 0.40 -0.19 0.93 -0.21 0.00 0.00 178.00 178.98 2j4e h GLU 98 N 0.63 -0.15 0.00 1.05 4.39 -1.95 -2.81 114.58 115.74 2j4e h GLU 98 Ca 0.46 0.01 -0.10 0.00 0.34 0.00 0.00 59.36 60.07 2j4e h GLU 98 Cb 0.83 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2j4e h GLU 98 CO -0.21 -0.10 -0.49 0.78 -1.16 0.00 0.00 179.01 177.84 2j4e h GLY 99 N -0.15 0.00 1.40 -3.84 0.00 -0.98 -2.59 103.07 96.91 2j4e h GLY 99 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 2j4e h GLY 99 CO -0.40 0.00 -0.04 1.41 0.00 0.00 0.00 176.54 177.51 2j4e h LEU 100 N 0.00 0.70 -0.79 3.11 3.38 -1.25 -2.05 115.31 118.40 2j4e h LEU 100 Ca -0.00 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 2j4e h LEU 100 Cb 0.97 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 2j4e h LEU 100 CO 0.06 0.79 -0.52 -0.74 0.09 0.00 0.00 178.44 178.13 2j4e h HIS 101 N 0.67 0.00 0.00 1.13 2.76 -1.27 -2.91 115.15 115.53 2j4e h HIS 101 Ca 0.13 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.20 2j4e h HIS 101 Cb 0.47 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.42 2j4e h HIS 101 CO 0.02 0.52 -0.48 1.96 -1.30 0.00 0.00 177.93 178.65 2j4e h GLN 102 N 0.00 0.00 -0.64 5.26 4.20 -1.06 -3.08 115.11 119.79 2j4e h GLN 102 Ca -0.01 0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.87 2j4e h GLN 102 Cb 1.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.79 2j4e h GLN 102 CO 0.07 0.48 0.45 -0.07 -0.67 0.00 0.00 178.83 179.09 2j4e h LEU 103 N 0.00 0.11 -2.73 1.46 4.07 -1.17 -0.82 115.31 116.22 2j4e h LEU 103 Ca -0.00 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2j4e h LEU 103 Cb 0.87 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.60 2j4e h LEU 103 CO 0.06 0.05 0.00 0.18 -1.08 0.00 0.00 178.44 177.66 2j4e n LEU 104 N -4.39 4.20 -0.04 1.67 4.77 -1.16 -4.49 117.00 117.55 2j4e n LEU 104 Ca 0.12 -2.12 0.06 0.00 -0.03 0.00 0.00 56.01 54.04 2j4e n LEU 104 Cb 0.64 -0.55 0.44 0.00 -2.33 0.00 0.00 43.42 41.61 2j4e n LEU 104 CO 0.36 0.66 1.17 0.00 -1.33 0.00 0.00 177.39 178.26 2j4e h ALA 105 N 3.84 1.78 -0.54 -1.18 0.00 -1.27 -2.37 119.26 119.52 2j4e h ALA 105 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2j4e h ALA 105 Cb 1.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2j4e h ALA 105 CO 0.24 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.06 2j4e n GLY 106 N -1.48 3.02 3.01 0.00 0.00 -1.26 -4.90 105.19 103.58 2j4e n GLY 106 Ca 0.05 -0.85 -0.27 0.00 0.00 0.00 0.00 46.02 44.95 2j4e n GLY 106 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j4e s PHE 107 N -2.07 1.78 0.34 1.61 0.08 -0.89 -5.02 117.98 113.80 2j4e s PHE 107 Ca 0.47 -0.83 0.11 0.00 0.12 0.00 0.00 56.93 56.80 2j4e s PHE 107 Cb 0.32 -1.32 0.61 0.00 -0.57 0.00 0.00 43.02 42.06 2j4e s PHE 107 CO 0.20 -0.46 1.77 1.49 -0.10 0.00 0.00 175.22 178.12 2j4e h GLU 108 N 7.54 0.06 -6.43 0.44 4.81 -1.90 -3.41 114.58 115.69 2j4e h GLU 108 Ca -0.31 -0.03 -0.57 0.00 -0.13 0.00 0.00 59.36 58.32 2j4e h GLU 108 Cb 1.16 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.47 2j4e h GLU 108 CO 0.47 0.46 0.84 0.34 -0.73 0.00 0.00 179.01 180.40 2j4e s ASP 109 N -6.91 6.79 0.00 1.04 2.15 -1.26 -4.90 116.67 113.58 2j4e s ASP 109 Ca -0.03 0.77 0.18 0.00 0.43 0.00 0.00 52.55 53.89 2j4e s ASP 109 Cb 0.14 -2.53 0.37 0.00 -0.30 0.00 0.00 42.92 40.60 2j4e s ASP 109 CO 0.74 -1.02 1.30 0.29 -0.17 0.00 0.00 175.17 176.31 2j4e n LYS 110 N 7.22 2.34 -2.11 4.34 4.76 -1.26 -4.34 118.16 129.11 2j4e n LYS 110 Ca 0.11 -2.11 -0.36 0.00 -2.87 0.00 0.00 58.31 53.08 2j4e n LYS 110 Cb 0.48 -1.41 0.02 0.00 -1.84 0.00 0.00 35.03 32.28 2j4e n LYS 110 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2j4e s SER 111 N -1.19 5.49 0.19 4.39 1.04 -1.26 -0.77 113.70 121.59 2j4e s SER 111 Ca 0.32 2.34 -0.23 0.00 0.48 0.00 0.00 55.95 58.85 2j4e s SER 111 Cb 0.18 -2.60 0.05 0.00 0.10 0.00 0.00 66.02 63.76 2j4e s SER 111 CO 0.25 -1.39 0.77 0.00 0.98 0.00 0.00 173.24 173.85 2j4e s ALA 112 N -1.62 -1.47 0.07 5.32 0.00 -1.04 -1.59 121.76 121.43 2j4e s ALA 112 Ca 0.74 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.84 2j4e s ALA 112 Cb -0.29 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 2j4e s ALA 112 CO 0.32 -0.94 -0.11 1.52 0.00 0.00 0.00 175.76 176.55 2j4e s TYR 113 N -3.65 0.97 -0.20 0.00 -0.85 0.13 -1.35 117.35 112.39 2j4e s TYR 113 Ca 0.08 -0.54 -0.07 0.00 -0.52 0.00 0.00 57.07 56.02 2j4e s TYR 113 Cb -0.03 -0.55 -0.04 0.00 0.38 0.00 0.00 41.96 41.72 2j4e s TYR 113 CO -0.00 -0.01 0.06 0.00 -1.52 0.00 0.00 175.55 174.08 2j4e s ALA 114 N -1.69 3.31 -0.11 9.51 0.00 0.25 -0.82 121.76 132.21 2j4e s ALA 114 Ca -0.02 -0.87 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 2j4e s ALA 114 Cb -0.08 -1.96 -0.03 0.00 0.00 0.00 0.00 23.12 21.05 2j4e s ALA 114 CO 0.01 -0.03 -0.06 -1.17 0.00 0.00 0.00 175.76 174.51 2j4e s LEU 115 N 0.77 3.17 -0.18 0.00 2.96 0.25 -1.41 118.68 124.24 2j4e s LEU 115 Ca 0.03 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.86 2j4e s LEU 115 Cb -0.13 -1.72 0.04 0.00 0.50 0.00 0.00 46.19 44.87 2j4e s LEU 115 CO 0.02 0.27 -0.08 0.00 -1.32 0.00 0.00 176.35 175.24 2j4e s THR 117 N 1.53 2.57 0.38 0.00 2.01 -0.62 -0.21 115.64 121.29 2j4e s THR 117 Ca 0.00 -1.82 -0.15 0.00 0.31 0.00 0.00 61.69 60.03 2j4e s THR 117 Cb -0.15 -2.64 -0.09 0.00 0.01 0.00 0.00 72.50 69.63 2j4e s THR 117 CO -0.08 -0.29 0.80 -0.36 -0.69 0.00 0.00 174.62 174.00 2j4e s PHE 118 N 1.09 3.39 -0.06 4.92 0.08 0.70 -2.13 117.98 125.97 2j4e s PHE 118 Ca -0.00 1.26 -0.02 0.00 0.12 0.00 0.00 56.93 58.28 2j4e s PHE 118 Cb -0.20 -2.59 0.04 0.00 -0.57 0.00 0.00 43.02 39.70 2j4e s PHE 118 CO -0.05 -0.03 0.12 0.00 -0.10 0.00 0.00 175.22 175.17 2j4e s ALA 119 N -2.17 -0.15 0.02 5.36 0.00 -0.19 -0.95 121.76 123.68 2j4e s ALA 119 Ca 0.55 0.56 0.06 0.00 0.00 0.00 0.00 51.96 53.13 2j4e s ALA 119 Cb -0.10 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 2j4e s ALA 119 CO 0.21 -0.25 -0.19 -1.17 0.00 0.00 0.00 175.76 174.36 2j4e s LEU 120 N 1.45 2.13 0.06 0.00 2.96 -0.50 -1.70 118.68 123.07 2j4e s LEU 120 Ca -0.06 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 2j4e s LEU 120 Cb -0.12 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 2j4e s LEU 120 CO -0.05 0.16 0.12 -0.55 -1.32 0.00 0.00 176.35 174.70 2j4e s SER 121 N -0.94 0.20 -0.20 3.68 0.15 -0.86 -1.64 113.70 114.09 2j4e s SER 121 Ca 0.06 -0.64 -0.11 0.00 0.70 0.00 0.00 55.95 55.96 2j4e s SER 121 Cb -0.08 0.27 -0.20 0.00 -1.71 0.00 0.00 66.02 64.30 2j4e s SER 121 CO 0.01 -0.61 0.07 0.35 1.20 0.00 0.00 173.24 174.27 2j4e n THR 122 N 0.36 1.60 -1.31 6.45 -2.24 -1.26 -1.65 114.28 116.23 2j4e n THR 122 Ca -0.17 -0.39 -0.51 0.00 -2.27 0.00 0.00 64.05 60.71 2j4e n THR 122 Cb 0.60 -1.81 -0.07 0.00 -2.10 0.00 0.00 70.33 66.96 2j4e n THR 122 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2j4e n PRO 128 N -3.90 0.00 -1.89 -0.78 -0.02 -1.26 -3.70 135.00 123.45 2j4e n PRO 128 Ca -0.39 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.67 2j4e n PRO 128 Cb 0.89 -1.30 -0.03 0.00 -0.02 0.00 0.00 33.50 33.05 2j4e n PRO 128 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2j4e s VAL 129 N -0.03 2.42 -0.17 -1.45 1.01 -1.26 -5.02 120.40 115.91 2j4e s VAL 129 Ca 0.79 0.32 -0.04 0.00 0.00 0.00 0.00 61.98 63.06 2j4e s VAL 129 Cb -1.10 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 2j4e s VAL 129 CO 0.50 0.04 -0.04 -0.60 0.00 0.00 0.00 175.10 175.00 2j4e s ARG 130 N 0.43 3.62 -0.04 2.72 3.00 -0.65 -4.95 118.95 123.08 2j4e s ARG 130 Ca 0.67 -0.54 -0.05 0.00 -1.00 0.00 0.00 55.73 54.81 2j4e s ARG 130 Cb -0.45 -2.93 -0.04 0.00 0.00 0.00 0.00 34.95 31.53 2j4e s ARG 130 CO 0.38 0.17 0.19 -0.51 0.00 0.00 0.00 175.30 175.53 2j4e s LEU 131 N 0.55 4.38 -0.12 -0.88 1.43 -1.26 -1.41 118.68 121.37 2j4e s LEU 131 Ca -0.03 0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 53.49 2j4e s LEU 131 Cb -0.14 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.62 2j4e s LEU 131 CO 0.03 0.30 -0.09 -0.36 0.23 0.00 0.00 176.35 176.46 2j4e s PHE 132 N -1.24 1.58 0.06 0.29 0.08 -0.13 -5.00 117.98 113.63 2j4e s PHE 132 Ca 0.24 -0.80 0.08 0.00 0.12 0.00 0.00 56.93 56.56 2j4e s PHE 132 Cb -0.13 -1.28 -0.03 0.00 -0.57 0.00 0.00 43.02 41.01 2j4e s PHE 132 CO 0.14 -0.53 -0.18 1.03 -0.10 0.00 0.00 175.22 175.59 2j4e s ARG 133 N 1.64 1.99 -0.03 0.44 0.52 -1.26 -0.21 118.95 122.03 2j4e s ARG 133 Ca 0.04 -1.04 -0.01 0.00 -0.52 0.00 0.00 55.73 54.20 2j4e s ARG 133 Cb -0.13 -2.17 0.03 0.00 0.52 0.00 0.00 34.95 33.21 2j4e s ARG 133 CO -0.08 0.52 0.06 0.20 0.02 0.00 0.00 175.30 176.02 2j4e s GLY 134 N -1.66 0.10 -0.09 -3.53 0.00 0.71 -4.11 107.32 98.74 2j4e s GLY 134 Ca 0.16 0.36 0.01 0.00 0.00 0.00 0.00 44.72 45.25 2j4e s GLY 134 CO 0.07 0.91 -0.12 -1.60 0.00 0.00 0.00 173.10 172.36 2j4e s ARG 135 N 1.34 1.77 0.07 2.90 3.52 -1.26 -0.01 118.95 127.28 2j4e s ARG 135 Ca -0.06 -0.40 0.09 0.00 -0.13 0.00 0.00 55.73 55.23 2j4e s ARG 135 Cb -0.13 -1.56 -0.03 0.00 -1.56 0.00 0.00 34.95 31.68 2j4e s ARG 135 CO -0.04 -0.07 -0.25 -0.08 -0.81 0.00 0.00 175.30 174.05 2j4e s THR 136 N 1.00 2.29 0.14 4.11 -1.32 -0.50 -4.84 115.64 116.51 2j4e s THR 136 Ca -0.08 -1.46 0.11 0.00 -1.21 0.00 0.00 61.69 59.05 2j4e s THR 136 Cb -0.15 -1.94 -0.04 0.00 -1.51 0.00 0.00 72.50 68.87 2j4e s THR 136 CO -0.01 0.29 -0.26 -0.44 -2.21 0.00 0.00 174.62 171.99 2j4e s SER 137 N -1.50 3.23 0.00 8.08 0.01 -1.26 -0.58 113.70 121.67 2j4e s SER 137 Ca 0.13 -0.76 0.00 0.00 1.31 0.00 0.00 55.95 56.62 2j4e s SER 137 Cb -0.10 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 65.92 2j4e s SER 137 CO 0.04 0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.45 2j4e n GLY 138 N 0.81 2.24 3.38 3.44 0.00 -0.46 0.66 105.19 115.26 2j4e n GLY 138 Ca -0.17 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 2j4e n GLY 138 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2j4e s ARG 139 N 3.11 1.17 -0.17 1.61 3.03 0.06 -2.49 118.95 125.29 2j4e s ARG 139 Ca 0.00 -0.70 -0.16 0.00 2.03 0.00 0.00 55.73 56.90 2j4e s ARG 139 Cb 0.00 0.50 -0.04 0.00 -1.03 0.00 0.00 34.95 34.38 2j4e s ARG 139 CO 0.00 -0.48 0.38 0.42 -1.13 0.00 0.00 175.30 174.50 2j4e s ILE 140 N -3.81 5.23 0.22 4.99 -1.09 0.05 -0.66 121.20 126.13 2j4e s ILE 140 Ca 0.04 0.72 0.03 0.00 -2.23 0.00 0.00 60.65 59.21 2j4e s ILE 140 Cb 0.01 -3.72 -0.05 0.00 -1.58 0.00 0.00 42.46 37.12 2j4e s ILE 140 CO -0.10 0.32 0.01 0.68 -1.23 0.00 0.00 174.94 174.62 2j4e s VAL 141 N 0.84 0.87 0.13 2.92 -7.23 -0.32 -4.92 120.40 112.68 2j4e s VAL 141 Ca 0.20 -2.01 -0.31 0.00 -1.81 0.00 0.00 61.98 58.05 2j4e s VAL 141 Cb -0.14 -2.32 -0.09 0.00 0.56 0.00 0.00 36.38 34.39 2j4e s VAL 141 CO 0.07 -0.32 1.45 0.00 -0.31 0.00 0.00 175.10 175.99 2j4e s ALA 142 N -3.53 3.65 0.03 1.32 0.00 -1.26 -4.42 121.76 117.55 2j4e s ALA 142 Ca 0.28 1.19 -0.34 0.00 0.00 0.00 0.00 51.96 53.10 2j4e s ALA 142 Cb 0.06 -3.57 -0.18 0.00 0.00 0.00 0.00 23.12 19.44 2j4e s ALA 142 CO 0.08 -0.69 0.88 -2.30 0.00 0.00 0.00 175.76 173.73 2j4e n PRO 143 N 4.04 0.00 -3.73 0.00 -0.02 -1.26 -4.87 135.00 129.16 2j4e n PRO 143 Ca 0.12 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.48 2j4e n PRO 143 Cb 0.41 -1.27 -0.11 0.00 -0.02 0.00 0.00 33.50 32.51 2j4e n PRO 143 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2j4e s ARG 144 N -0.16 0.39 0.00 -0.52 0.52 -0.77 -4.98 118.95 113.43 2j4e s ARG 144 Ca 0.78 0.59 0.00 0.00 -0.52 0.00 0.00 55.73 56.57 2j4e s ARG 144 Cb -1.09 0.10 0.00 0.00 0.52 0.00 0.00 34.95 34.48 2j4e s ARG 144 CO 0.51 -0.09 0.00 0.41 0.02 0.00 0.00 175.30 176.15 2j4e n GLY 145 N 3.44 2.69 0.54 -3.53 0.00 -1.26 -4.24 105.19 102.83 2j4e n GLY 145 Ca -0.17 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.09 2j4e n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j4e s GLN 147 N -2.33 1.22 0.00 0.00 -2.07 -1.12 -4.92 119.66 110.45 2j4e s GLN 147 Ca 0.24 -1.93 0.00 0.00 -1.82 0.00 0.00 55.36 51.85 2j4e s GLN 147 Cb 0.19 -2.27 0.00 0.00 -1.09 0.00 0.00 33.01 29.84 2j4e s GLN 147 CO 0.48 -1.15 0.00 -3.47 -1.32 0.00 0.00 175.29 169.83 2j4e n ASP 148 N 3.64 0.00 -4.64 12.60 2.03 -1.26 -4.00 116.55 124.92 2j4e n ASP 148 Ca 0.08 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.96 2j4e n ASP 148 Cb 0.35 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.73 2j4e n ASP 148 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2j4e s PHE 149 N -2.97 2.71 0.00 -0.67 5.99 -1.26 -4.93 117.98 116.86 2j4e s PHE 149 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 56.93 57.83 2j4e s PHE 149 Cb 0.00 -3.83 0.00 0.00 0.00 0.00 0.00 43.02 39.19 2j4e s PHE 149 CO 0.00 -1.72 0.00 0.41 -0.00 0.00 0.00 175.22 173.91 2j4e n GLY 150 N 4.18 2.00 0.70 13.12 0.00 -1.26 -1.18 105.19 122.75 2j4e n GLY 150 Ca 0.15 0.29 0.06 0.00 0.00 0.00 0.00 46.02 46.51 2j4e n GLY 150 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2j4e n TRP 151 N 13.17 0.52 -0.13 1.61 4.27 -1.26 -4.51 117.44 131.10 2j4e n TRP 151 Ca 0.00 -0.25 -0.04 0.00 -3.89 0.00 0.00 57.50 53.32 2j4e n TRP 151 Cb 0.00 -0.02 0.04 0.00 -1.36 0.00 0.00 31.31 29.98 2j4e n TRP 151 CO 0.00 0.00 0.00 -0.44 -2.29 0.00 0.00 177.69 174.96 2j4e h ASP 152 N 2.13 -0.01 -0.60 -0.67 3.32 -1.47 -2.40 116.42 116.73 2j4e h ASP 152 Ca 0.00 0.08 0.17 0.00 0.02 0.00 0.00 57.03 57.30 2j4e h ASP 152 Cb 0.53 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 2j4e h ASP 152 CO 0.01 0.03 0.50 -0.65 -1.72 0.00 0.00 179.24 177.41 2j4e h PRO 153 N 0.21 0.00 -0.64 3.56 0.11 -1.79 -2.39 132.00 131.05 2j4e h PRO 153 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2j4e h PRO 153 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.38 2j4e h PRO 153 CO -0.29 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.50 2j4e s PHE 155 N -1.06 2.66 -0.39 0.00 5.36 -0.90 -1.18 117.98 122.46 2j4e s PHE 155 Ca 0.45 -1.79 -0.14 0.00 -0.96 0.00 0.00 56.93 54.49 2j4e s PHE 155 Cb 0.24 -1.73 0.02 0.00 -0.34 0.00 0.00 43.02 41.20 2j4e s PHE 155 CO 0.31 -0.79 0.27 -1.14 -1.46 0.00 0.00 175.22 172.41 2j4e s GLN 156 N 1.31 2.96 0.54 10.12 0.74 0.17 -1.89 119.66 133.61 2j4e s GLN 156 Ca -0.03 -1.01 -0.19 0.00 0.05 0.00 0.00 55.36 54.17 2j4e s GLN 156 Cb -0.17 -3.89 -0.06 0.00 1.10 0.00 0.00 33.01 29.99 2j4e s GLN 156 CO -0.08 -0.72 1.12 -1.25 -0.55 0.00 0.00 175.29 173.82 2j4e s PRO 157 N 1.64 3.38 0.29 1.67 0.04 -1.26 -0.76 135.00 140.00 2j4e s PRO 157 Ca 0.04 1.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.38 2j4e s PRO 157 Cb -0.19 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.24 2j4e s PRO 157 CO 0.09 -0.82 1.44 -0.51 0.04 0.00 0.00 177.00 177.23 2j4e s ASP 158 N -1.79 6.60 0.00 6.66 -0.00 0.21 -2.88 116.67 125.47 2j4e s ASP 158 Ca 0.72 2.75 0.00 0.00 -0.00 0.00 0.00 52.55 56.03 2j4e s ASP 158 Cb -0.23 -2.64 0.00 0.00 -0.00 0.00 0.00 42.92 40.05 2j4e s ASP 158 CO 0.27 -0.72 0.00 0.61 -0.00 0.00 0.00 175.17 175.33 2j4e n GLY 159 N 1.71 0.28 3.16 0.21 0.00 -1.26 -4.98 105.19 104.31 2j4e n GLY 159 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2j4e n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j4e s TYR 160 N -2.05 1.13 0.06 1.61 1.51 -1.14 -5.04 117.35 113.42 2j4e s TYR 160 Ca 0.00 -0.48 -0.04 0.00 -1.01 0.00 0.00 57.07 55.54 2j4e s TYR 160 Cb 0.00 -0.64 -0.28 0.00 -0.11 0.00 0.00 41.96 40.93 2j4e s TYR 160 CO 0.00 0.04 1.08 0.93 -1.11 0.00 0.00 175.55 176.49 2j4e h GLU 161 N 4.25 0.27 -5.83 -0.62 4.39 -1.98 -3.44 114.58 111.64 2j4e h GLU 161 Ca -0.40 -0.47 -0.63 0.00 0.34 0.00 0.00 59.36 58.20 2j4e h GLU 161 Cb 1.19 0.17 -0.06 0.00 -0.10 0.00 0.00 28.75 29.95 2j4e h GLU 161 CO 0.41 1.20 -0.32 1.14 -1.16 0.00 0.00 179.01 180.29 2j4e s GLN 162 N -2.65 3.77 0.93 2.33 -2.07 -1.26 -5.02 119.66 115.69 2j4e s GLN 162 Ca -0.05 0.18 -0.10 0.00 -1.82 0.00 0.00 55.36 53.57 2j4e s GLN 162 Cb 0.07 -3.23 0.15 0.00 -1.09 0.00 0.00 33.01 28.92 2j4e s GLN 162 CO 0.88 0.68 1.12 0.95 -1.32 0.00 0.00 175.29 177.61 2j4e s THR 163 N -0.92 2.20 0.56 3.63 -4.23 -1.26 -4.47 115.64 111.15 2j4e s THR 163 Ca 0.20 0.07 0.28 0.00 -1.18 0.00 0.00 61.69 61.05 2j4e s THR 163 Cb -0.15 -2.15 0.40 0.00 1.34 0.00 0.00 72.50 71.94 2j4e s THR 163 CO 0.09 -0.09 1.96 1.88 -0.54 0.00 0.00 174.62 177.93 2j4e h TYR 164 N -1.89 0.00 0.00 3.99 0.05 -1.45 0.40 116.97 118.07 2j4e h TYR 164 Ca -0.46 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.28 2j4e h TYR 164 Cb 1.27 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.01 2j4e h TYR 164 CO 0.48 0.00 -0.18 0.00 -1.05 0.00 0.00 178.16 177.41 2j4e h ALA 165 N 1.62 0.96 0.00 3.88 0.00 -1.69 -3.13 119.26 120.91 2j4e h ALA 165 Ca 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2j4e h ALA 165 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2j4e h ALA 165 CO -0.00 0.22 -0.48 0.39 0.00 0.00 0.00 179.25 179.38 2j4e n GLU 166 N -3.25 0.15 -3.33 0.00 1.02 0.13 -2.78 120.64 112.57 2j4e n GLU 166 Ca 0.01 0.05 -0.35 0.00 -0.02 0.00 0.00 57.16 56.86 2j4e n GLU 166 Cb 0.47 -1.60 -0.06 0.00 -0.02 0.00 0.00 31.44 30.22 2j4e n GLU 166 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2j4e s MET 167 N -3.09 3.97 0.69 3.49 -1.94 -1.18 -4.96 119.30 116.28 2j4e s MET 167 Ca 0.09 0.49 -0.16 0.00 -1.71 0.00 0.00 55.69 54.40 2j4e s MET 167 Cb 0.15 -2.85 0.01 0.00 2.01 0.00 0.00 34.83 34.16 2j4e s MET 167 CO 0.69 0.43 1.20 -2.14 -0.01 0.00 0.00 175.02 175.18 2j4e s PRO 168 N -2.17 2.43 0.32 2.03 0.02 -1.26 -4.76 135.00 131.62 2j4e s PRO 168 Ca 0.41 1.75 0.03 0.00 0.02 0.00 0.00 61.00 63.21 2j4e s PRO 168 Cb -0.14 -1.87 0.63 0.00 0.02 0.00 0.00 34.50 33.13 2j4e s PRO 168 CO 0.20 -1.61 1.90 0.87 -0.33 0.00 0.00 177.00 178.03 2j4e h LYS 169 N 0.06 0.88 -0.51 5.54 1.79 -1.97 0.60 116.57 122.97 2j4e h LYS 169 Ca -0.48 -0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.04 2j4e h LYS 169 Cb 1.29 -0.20 -0.10 0.00 -1.58 0.00 0.00 32.23 31.65 2j4e h LYS 169 CO 0.52 0.59 -0.11 0.00 -1.08 0.00 0.00 179.45 179.36 2j4e h ALA 170 N 1.55 0.35 -0.05 3.86 0.00 -1.97 0.23 119.26 123.22 2j4e h ALA 170 Ca 0.40 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.48 2j4e h ALA 170 Cb 0.34 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2j4e h ALA 170 CO -0.16 -0.44 -0.04 1.49 0.00 0.00 0.00 179.25 180.10 2j4e h GLU 171 N 0.01 0.12 0.07 0.00 4.81 -1.39 -2.72 114.58 115.48 2j4e h GLU 171 Ca 0.25 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2j4e h GLU 171 Cb 0.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2j4e h GLU 171 CO -0.51 0.55 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.07 2j4e h LYS 172 N -0.31 -0.09 0.00 1.92 3.64 -0.70 -1.59 116.57 119.44 2j4e h LYS 172 Ca 0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2j4e h LYS 172 Cb 0.53 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2j4e h LYS 172 CO 0.01 -0.05 0.00 -0.91 -2.27 0.00 0.00 179.45 176.23 2j4e h ASN 173 N -0.10 0.00 1.59 4.20 2.35 -0.64 0.20 115.58 123.19 2j4e h ASN 173 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2j4e h ASN 173 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2j4e h ASN 173 CO 0.02 0.00 -0.38 0.00 -1.65 0.00 0.00 177.43 175.42 2j4e h ALA 174 N 2.05 0.81 0.00 -0.83 0.00 -0.95 -3.41 119.26 116.93 2j4e h ALA 174 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2j4e h ALA 174 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2j4e h ALA 174 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 2j4e n VAL 175 N -2.90 0.00 -0.99 0.00 0.24 -0.64 -4.98 118.33 109.06 2j4e n VAL 175 Ca 0.03 -0.25 -0.30 0.00 -2.04 0.00 0.00 64.34 61.78 2j4e n VAL 175 Cb 0.53 1.03 0.17 0.00 -1.47 0.00 0.00 33.84 34.10 2j4e n VAL 175 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2j4e s SER 176 N -0.46 2.82 0.28 -1.34 1.04 -0.03 -4.77 113.70 111.23 2j4e s SER 176 Ca 0.00 1.58 -0.00 0.00 0.48 0.00 0.00 55.95 58.01 2j4e s SER 176 Cb 0.00 -2.23 0.64 0.00 0.10 0.00 0.00 66.02 64.52 2j4e s SER 176 CO 0.00 -3.06 1.66 1.12 0.98 0.00 0.00 173.24 173.93 2j4e h HIS 177 N -1.84 0.32 -0.06 5.02 2.07 -1.88 -1.38 115.15 117.40 2j4e h HIS 177 Ca -0.51 0.05 -0.14 0.00 -2.85 0.00 0.00 60.37 56.91 2j4e h HIS 177 Cb 1.29 -0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.26 2j4e h HIS 177 CO 0.39 -0.18 -0.60 -0.09 -3.07 0.00 0.00 177.93 174.38 2j4e h ARG 178 N 0.22 0.22 0.46 5.12 2.43 -1.91 -2.13 114.38 118.78 2j4e h ARG 178 Ca 0.51 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 2j4e h ARG 178 Cb 0.99 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2j4e h ARG 178 CO -0.62 0.75 -0.24 0.35 -1.51 0.00 0.00 179.97 178.70 2j4e h PHE 179 N 0.16 -0.61 -0.85 2.20 3.57 -1.74 -1.50 116.94 118.17 2j4e h PHE 179 Ca -0.01 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.67 2j4e h PHE 179 Cb 1.10 0.21 -0.11 0.00 2.79 0.00 0.00 35.95 39.93 2j4e h PHE 179 CO 0.02 -0.38 0.35 0.00 -2.23 0.00 0.00 178.31 176.08 2j4e h ARG 180 N -0.64 0.41 -0.24 1.11 2.47 -1.11 -1.09 114.38 115.30 2j4e h ARG 180 Ca -0.06 -0.02 -0.19 0.00 -1.26 0.00 0.00 59.98 58.44 2j4e h ARG 180 Cb 0.50 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 2j4e h ARG 180 CO 0.09 0.27 -0.60 0.00 0.56 0.00 0.00 179.97 180.29 2j4e h ALA 181 N 1.65 0.47 0.00 0.04 0.00 -1.28 -2.97 119.26 117.16 2j4e h ALA 181 Ca 0.50 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2j4e h ALA 181 Cb 0.87 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2j4e h ALA 181 CO -0.48 0.69 -0.05 -0.07 0.00 0.00 0.00 179.25 179.34 2j4e h LEU 182 N 0.60 0.00 -0.31 0.00 3.38 -0.52 -2.38 115.31 116.09 2j4e h LEU 182 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2j4e h LEU 182 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2j4e h LEU 182 CO 0.13 0.05 -0.16 0.25 0.09 0.00 0.00 178.44 178.80 2j4e h LEU 183 N 0.00 0.67 -1.36 1.67 5.85 -1.07 0.80 115.31 121.87 2j4e h LEU 183 Ca -0.00 -0.41 -0.06 0.00 0.84 0.00 0.00 57.88 58.25 2j4e h LEU 183 Cb 0.52 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2j4e h LEU 183 CO 0.01 0.93 -0.19 -0.33 -0.34 0.00 0.00 178.44 178.52 2j4e h GLU 184 N 0.41 0.19 -0.22 1.25 5.08 -1.40 0.17 114.58 120.06 2j4e h GLU 184 Ca 0.07 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 58.18 2j4e h GLU 184 Cb 0.68 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.92 2j4e h GLU 184 CO 0.05 0.38 -0.64 1.25 -1.00 0.00 0.00 179.01 179.05 2j4e h LEU 185 N 0.18 0.95 -0.40 1.33 5.85 -1.16 -2.59 115.31 119.47 2j4e h LEU 185 Ca 0.03 -0.58 -0.18 0.00 0.84 0.00 0.00 57.88 57.99 2j4e h LEU 185 Cb 0.44 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 2j4e h LEU 185 CO 0.03 1.36 -0.65 1.56 -0.34 0.00 0.00 178.44 180.39 2j4e h GLN 186 N 0.58 0.57 -0.77 1.25 4.20 -0.68 -2.87 115.11 117.40 2j4e h GLN 186 Ca -0.02 -0.41 0.17 0.00 0.06 0.00 0.00 58.65 58.45 2j4e h GLN 186 Cb 1.26 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 29.06 2j4e h GLN 186 CO 0.14 1.03 0.52 1.49 -0.67 0.00 0.00 178.83 181.34 2j4e h GLU 187 N 0.42 0.31 -0.76 1.46 4.22 -0.66 -1.89 114.58 117.67 2j4e h GLU 187 Ca -0.02 -0.02 -0.05 0.00 0.08 0.00 0.00 59.36 59.36 2j4e h GLU 187 Cb 1.23 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 2j4e h GLU 187 CO 0.12 0.20 0.30 -0.92 -2.18 0.00 0.00 179.01 176.54 2j4e h TYR 188 N 0.32 1.17 -0.44 0.92 3.20 -1.22 -2.98 116.97 117.94 2j4e h TYR 188 Ca 0.38 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2j4e h TYR 188 Cb 1.02 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.95 2j4e h TYR 188 CO -0.00 0.89 0.00 1.19 -1.64 0.00 0.00 178.16 178.60 2j4e n PHE 189 N -4.31 0.57 0.93 -3.82 3.72 -0.95 -4.84 117.46 108.77 2j4e n PHE 189 Ca 0.07 -0.28 0.07 0.00 -0.05 0.00 0.00 57.45 57.25 2j4e n PHE 189 Cb 0.19 0.00 0.44 0.00 -0.94 0.00 0.00 39.48 39.17 2j4e n PHE 189 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12