#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j9b s PHE 2 N 0.00 3.07 0.12 2.61 0.08 -1.26 -5.01 117.98 117.58 2j9b s PHE 2 Ca 0.00 -1.46 -0.20 0.00 0.12 0.00 0.00 56.93 55.39 2j9b s PHE 2 Cb 0.00 -2.08 -0.08 0.00 -0.57 0.00 0.00 43.02 40.29 2j9b s PHE 2 CO 0.00 -0.70 1.76 -0.56 -0.10 0.00 0.00 175.22 175.62 2j9b h GLN 3 N 8.04 0.25 -6.30 0.44 3.07 -2.02 -3.44 115.11 115.16 2j9b h GLN 3 Ca -0.33 -0.02 -0.58 0.00 0.09 0.00 0.00 58.65 57.81 2j9b h GLN 3 Cb 1.11 -0.06 -0.21 0.00 0.08 0.00 0.00 27.48 28.40 2j9b h GLN 3 CO 0.58 0.18 -0.83 -1.59 0.09 0.00 0.00 178.83 177.26 2j9b s LYS 4 N -6.12 1.20 0.46 0.06 -2.85 -1.26 -5.05 119.74 106.17 2j9b s LYS 4 Ca -0.13 -1.23 0.14 0.00 -1.00 0.00 0.00 55.97 53.75 2j9b s LYS 4 Cb 0.08 -1.49 1.08 0.00 -2.06 0.00 0.00 37.83 35.44 2j9b s LYS 4 CO 0.69 0.34 2.04 -1.00 0.10 0.00 0.00 175.35 177.52 2j9b h PRO 5 N 3.95 0.30 -0.62 1.78 0.13 -1.85 -0.42 132.00 135.27 2j9b h PRO 5 Ca -0.47 -0.02 0.09 0.00 -0.87 0.00 0.00 66.00 64.74 2j9b h PRO 5 Cb 1.18 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2j9b h PRO 5 CO 0.41 0.20 0.42 0.78 -0.23 0.00 0.00 178.00 179.57 2j9b h GLY 6 N 0.31 0.66 1.06 1.56 0.00 -1.67 -1.82 103.07 103.17 2j9b h GLY 6 Ca 0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 2j9b h GLY 6 CO -0.04 0.12 0.22 -0.55 0.00 0.00 0.00 176.54 176.30 2j9b h ASP 7 N 0.48 1.10 -0.63 0.19 3.32 -1.37 -0.62 116.42 118.89 2j9b h ASP 7 Ca 0.28 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 2j9b h ASP 7 Cb 0.49 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2j9b h ASP 7 CO -0.08 1.02 0.37 0.00 -1.72 0.00 0.00 179.24 178.83 2j9b h ALA 8 N 1.12 0.80 -0.09 3.45 0.00 -1.36 -1.30 119.26 121.87 2j9b h ALA 8 Ca 0.24 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2j9b h ALA 8 Cb 0.32 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2j9b h ALA 8 CO -0.01 0.28 0.02 0.82 0.00 0.00 0.00 179.25 180.37 2j9b h ILE 9 N 0.85 1.19 -0.65 0.00 2.04 -1.14 -1.03 117.51 118.77 2j9b h ILE 9 Ca 0.22 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2j9b h ILE 9 Cb -0.01 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2j9b h ILE 9 CO -0.04 0.17 0.30 -0.33 0.00 0.00 0.00 178.15 178.25 2j9b h GLU 10 N -0.05 0.92 0.04 2.37 5.08 -1.04 -1.54 114.58 120.35 2j9b h GLU 10 Ca 0.03 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2j9b h GLU 10 Cb 0.24 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2j9b h GLU 10 CO 0.00 0.72 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.79 2j9b h TYR 11 N 0.91 -0.05 -0.42 4.33 3.20 -1.03 -1.05 116.97 122.87 2j9b h TYR 11 Ca 0.22 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.99 2j9b h TYR 11 Cb 0.11 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2j9b h TYR 11 CO 0.01 0.10 -0.13 0.07 -1.64 0.00 0.00 178.16 176.57 2j9b h ARG 12 N -0.18 0.83 -0.44 1.82 0.11 -0.94 -0.60 114.38 114.98 2j9b h ARG 12 Ca -0.01 -0.33 0.06 0.00 0.10 0.00 0.00 59.98 59.80 2j9b h ARG 12 Cb 0.16 -0.04 -0.05 0.00 1.11 0.00 0.00 29.97 31.15 2j9b h ARG 12 CO 0.01 0.96 0.15 1.96 0.10 0.00 0.00 179.97 183.15 2j9b h GLN 13 N 0.65 0.30 -0.43 0.08 4.20 -1.29 -0.86 115.11 117.77 2j9b h GLN 13 Ca 0.10 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2j9b h GLN 13 Cb 0.67 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 2j9b h GLN 13 CO 0.05 0.20 0.28 0.77 -0.67 0.00 0.00 178.83 179.46 2j9b h SER 14 N 0.31 0.49 -0.58 1.46 0.02 -0.82 -0.90 113.55 113.53 2j9b h SER 14 Ca 0.21 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 2j9b h SER 14 Cb 0.21 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 2j9b h SER 14 CO -0.22 0.36 0.26 0.00 -1.14 0.00 0.00 176.83 176.08 2j9b h ALA 15 N 1.16 0.75 -0.82 3.77 0.00 -0.79 -1.75 119.26 121.57 2j9b h ALA 15 Ca 0.16 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2j9b h ALA 15 Cb -0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 2j9b h ALA 15 CO -0.03 0.34 0.51 0.74 0.00 0.00 0.00 179.25 180.81 2j9b h PHE 16 N 0.80 1.07 -0.48 0.00 0.04 -0.89 -0.01 116.94 117.46 2j9b h PHE 16 Ca 0.20 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.99 2j9b h PHE 16 Cb 0.16 -0.35 -0.03 0.00 2.20 0.00 0.00 35.95 37.93 2j9b h PHE 16 CO 0.00 0.70 0.30 1.15 -0.60 0.00 0.00 178.31 179.87 2j9b h THR 17 N 1.13 1.09 -0.51 -1.55 2.02 -0.84 0.52 112.91 114.77 2j9b h THR 17 Ca 0.30 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 67.16 2j9b h THR 17 Cb -0.07 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2j9b h THR 17 CO -0.06 0.11 -0.12 -0.07 0.37 0.00 0.00 175.52 175.76 2j9b h LEU 18 N 0.62 0.98 -0.27 2.58 3.38 -0.92 -1.90 115.31 119.79 2j9b h LEU 18 Ca 0.18 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.83 2j9b h LEU 18 Cb -0.04 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 2j9b h LEU 18 CO -0.06 1.11 0.07 0.40 0.09 0.00 0.00 178.44 180.05 2j9b h ILE 19 N 0.84 0.90 -0.89 1.22 2.04 -0.78 -1.67 117.51 119.17 2j9b h ILE 19 Ca 0.13 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 2j9b h ILE 19 Cb 0.68 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 2j9b h ILE 19 CO 0.05 0.03 0.48 0.00 0.00 0.00 0.00 178.15 178.72 2j9b h ALA 20 N 1.18 1.18 0.00 1.87 0.00 -0.66 0.12 119.26 122.96 2j9b h ALA 20 Ca 0.12 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2j9b h ALA 20 Cb 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2j9b h ALA 20 CO -0.15 0.66 -0.00 -0.97 0.00 0.00 0.00 179.25 178.79 2j9b h ASN 21 N 1.25 -0.00 0.11 0.00 -0.73 -1.04 0.04 115.58 115.21 2j9b h ASN 21 Ca 0.31 -0.29 -0.18 0.00 1.87 0.00 0.00 56.30 58.01 2j9b h ASN 21 Cb 0.03 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.62 2j9b h ASN 21 CO -0.05 0.29 -0.67 0.45 -0.37 0.00 0.00 177.43 177.08 2j9b h HIS 22 N -0.30 0.69 -0.74 0.67 3.86 -1.14 -2.43 115.15 115.75 2j9b h HIS 22 Ca -0.00 -0.28 -0.04 0.00 -1.16 0.00 0.00 60.37 58.89 2j9b h HIS 22 Cb 0.30 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 2j9b h HIS 22 CO 0.03 1.04 0.29 0.35 0.86 0.00 0.00 177.93 180.50 2j9b h PHE 23 N 0.37 1.12 -0.27 2.45 3.57 -0.78 -2.51 116.94 120.89 2j9b h PHE 23 Ca -0.02 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 2j9b h PHE 23 Cb 1.25 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2j9b h PHE 23 CO 0.05 0.85 0.11 0.78 -2.23 0.00 0.00 178.31 177.87 2j9b h GLY 24 N 1.12 0.40 1.15 2.40 0.00 -0.62 0.37 103.07 107.88 2j9b h GLY 24 Ca 0.25 -0.17 -0.10 0.00 0.00 0.00 0.00 47.33 47.30 2j9b h GLY 24 CO -0.02 0.17 -0.06 3.21 0.00 0.00 0.00 176.54 179.84 2j9b h ARG 25 N 0.37 1.01 -0.25 4.80 3.08 -1.00 -0.44 114.38 121.95 2j9b h ARG 25 Ca 0.10 -0.34 -0.05 0.00 0.07 0.00 0.00 59.98 59.75 2j9b h ARG 25 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2j9b h ARG 25 CO -0.01 1.02 -0.05 0.28 -1.07 0.00 0.00 179.97 180.15 2j9b h VAL 26 N 0.91 1.28 -0.92 2.04 2.07 -1.17 -2.96 116.25 117.49 2j9b h VAL 26 Ca 0.15 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.70 2j9b h VAL 26 Cb 0.61 1.45 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 2j9b h VAL 26 CO 0.04 0.32 0.60 0.00 0.02 0.00 0.00 177.57 178.55 2j9b h ALA 27 N 0.77 1.48 -0.80 1.67 0.00 -0.81 -0.97 119.26 120.61 2j9b h ALA 27 Ca 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2j9b h ALA 27 Cb 0.50 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2j9b h ALA 27 CO 0.02 0.38 0.39 0.00 0.00 0.00 0.00 179.25 180.05 2j9b h ALA 28 N 1.50 1.19 -0.50 0.00 0.00 -0.94 -0.15 119.26 120.35 2j9b h ALA 28 Ca 0.39 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2j9b h ALA 28 Cb 0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2j9b h ALA 28 CO -0.15 0.63 -0.06 0.52 0.00 0.00 0.00 179.25 180.19 2j9b h MET 29 N 1.13 0.93 -0.29 0.00 2.86 -1.21 0.47 114.93 118.82 2j9b h MET 29 Ca 0.28 -0.33 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 2j9b h MET 29 Cb 0.10 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 2j9b h MET 29 CO -0.04 0.98 0.04 0.00 1.06 0.00 0.00 176.91 178.96 2j9b h ALA 30 N 0.92 1.53 -0.00 6.32 0.00 -0.59 -1.40 119.26 126.03 2j9b h ALA 30 Ca 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2j9b h ALA 30 Cb 0.60 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2j9b h ALA 30 CO 0.04 0.35 -0.13 1.04 0.00 0.00 0.00 179.25 180.54 2j9b n GLN 31 N -4.34 0.57 -1.62 0.00 6.02 -0.12 -4.93 117.38 112.95 2j9b n GLN 31 Ca 0.01 -0.19 -0.07 0.00 -0.01 0.00 0.00 57.00 56.74 2j9b n GLN 31 Cb 0.19 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.94 2j9b n GLN 31 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2j9b n GLY 32 N 1.32 0.52 0.13 1.08 0.00 -0.53 -4.92 105.19 102.79 2j9b n GLY 32 Ca 0.13 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.57 2j9b n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j9b h LYS 33 N 0.00 0.00 -4.36 1.61 1.79 -1.14 -3.46 116.57 111.01 2j9b h LYS 33 Ca -0.14 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.04 2j9b h LYS 33 Cb 0.74 0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 31.15 2j9b h LYS 33 CO 0.19 0.00 -0.74 0.00 -1.08 0.00 0.00 179.45 177.82 2j9b s ALA 34 N -3.29 0.44 0.53 3.86 0.00 -1.11 -4.98 121.76 117.22 2j9b s ALA 34 Ca 0.03 -0.49 -0.22 0.00 0.00 0.00 0.00 51.96 51.28 2j9b s ALA 34 Cb 0.09 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 2j9b s ALA 34 CO 0.75 0.02 1.39 -2.14 0.00 0.00 0.00 175.76 175.78 2j9b s PRO 35 N -0.89 3.21 0.08 0.00 0.02 -1.26 -4.37 135.00 131.79 2j9b s PRO 35 Ca -0.05 2.31 -0.30 0.00 0.02 0.00 0.00 61.00 62.97 2j9b s PRO 35 Cb -0.06 -2.33 -0.06 0.00 0.02 0.00 0.00 34.50 32.07 2j9b s PRO 35 CO 0.00 -1.16 1.19 0.12 -0.33 0.00 0.00 177.00 176.82 2j9b s PHE 36 N -1.27 3.45 -0.19 6.54 5.36 -1.26 -4.89 117.98 125.73 2j9b s PHE 36 Ca 0.70 1.34 -0.03 0.00 -0.96 0.00 0.00 56.93 57.98 2j9b s PHE 36 Cb -0.42 -3.40 0.06 0.00 -0.34 0.00 0.00 43.02 38.92 2j9b s PHE 36 CO 0.50 -1.19 0.04 0.34 -1.46 0.00 0.00 175.22 173.45 2j9b s ASP 37 N 0.91 2.86 0.34 6.13 -1.08 -1.26 -5.03 116.67 119.53 2j9b s ASP 37 Ca 0.57 -0.81 0.03 0.00 -0.52 0.00 0.00 52.55 51.83 2j9b s ASP 37 Cb -0.29 -0.56 0.60 0.00 -1.46 0.00 0.00 42.92 41.20 2j9b s ASP 37 CO 0.30 -0.31 1.91 0.00 0.52 0.00 0.00 175.17 177.59 2j9b h ALA 38 N 8.26 1.41 -0.11 3.66 0.00 -1.94 0.91 119.26 131.44 2j9b h ALA 38 Ca -0.16 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2j9b h ALA 38 Cb 1.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2j9b h ALA 38 CO 0.33 0.43 0.02 -0.22 0.00 0.00 0.00 179.25 179.81 2j9b h LYS 39 N 0.61 0.18 -0.38 0.00 3.64 -1.96 -0.09 116.57 118.58 2j9b h LYS 39 Ca 0.14 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 2j9b h LYS 39 Cb 0.22 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2j9b h LYS 39 CO -0.00 0.38 0.00 0.28 -2.27 0.00 0.00 179.45 177.83 2j9b h VAL 40 N -0.05 1.26 -0.61 2.00 2.07 -1.93 -1.12 116.25 117.87 2j9b h VAL 40 Ca 0.03 -0.99 0.08 0.00 0.82 0.00 0.00 66.70 66.64 2j9b h VAL 40 Cb 0.29 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 2j9b h VAL 40 CO 0.00 0.33 0.28 0.00 0.02 0.00 0.00 177.57 178.21 2j9b h ALA 41 N 0.87 0.81 -0.80 1.67 0.00 -0.78 -1.11 119.26 119.93 2j9b h ALA 41 Ca 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2j9b h ALA 41 Cb 0.47 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2j9b h ALA 41 CO 0.02 -0.10 0.43 0.00 0.00 0.00 0.00 179.25 179.60 2j9b h ALA 42 N 1.37 1.02 -0.39 0.00 0.00 -0.74 0.93 119.26 121.46 2j9b h ALA 42 Ca 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2j9b h ALA 42 Cb 0.28 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2j9b h ALA 42 CO -0.24 0.54 0.20 0.93 0.00 0.00 0.00 179.25 180.68 2j9b h GLU 43 N 1.11 0.55 -0.32 0.00 5.08 -0.65 0.07 114.58 120.43 2j9b h GLU 43 Ca 0.28 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.43 2j9b h GLU 43 Cb 0.05 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2j9b h GLU 43 CO -0.04 0.47 -0.36 -0.91 -1.00 0.00 0.00 179.01 177.17 2j9b h ASN 44 N 0.49 0.76 -0.71 1.42 2.35 -0.94 -2.19 115.58 116.77 2j9b h ASN 44 Ca 0.14 -0.33 -0.06 0.00 -0.55 0.00 0.00 56.30 55.49 2j9b h ASN 44 Cb 0.09 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2j9b h ASN 44 CO -0.02 1.05 0.19 0.40 -1.65 0.00 0.00 177.43 177.40 2j9b h ILE 45 N 0.60 1.26 -0.89 2.81 2.04 -0.62 -0.64 117.51 122.07 2j9b h ILE 45 Ca 0.06 -0.94 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 2j9b h ILE 45 Cb 0.89 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 2j9b h ILE 45 CO 0.08 0.36 0.55 0.00 0.00 0.00 0.00 178.15 179.14 2j9b h ALA 46 N 1.09 1.14 -0.33 1.87 0.00 -0.80 0.47 119.26 122.71 2j9b h ALA 46 Ca 0.22 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 2j9b h ALA 46 Cb 0.34 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2j9b h ALA 46 CO -0.00 0.59 -0.41 1.25 0.00 0.00 0.00 179.25 180.67 2j9b h LEU 47 N 1.22 0.93 -0.68 0.00 5.85 -1.11 -1.54 115.31 119.97 2j9b h LEU 47 Ca 0.32 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.57 2j9b h LEU 47 Cb -0.07 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.66 2j9b h LEU 47 CO -0.06 1.24 0.43 0.58 -0.34 0.00 0.00 178.44 180.29 2j9b h VAL 48 N 0.64 1.11 -0.21 1.05 2.07 -0.65 -0.01 116.25 120.25 2j9b h VAL 48 Ca 0.04 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2j9b h VAL 48 Cb 1.01 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2j9b h VAL 48 CO 0.10 0.16 0.12 -1.28 0.02 0.00 0.00 177.57 176.69 2j9b h SER 49 N 0.85 0.25 -0.06 0.57 0.87 -0.73 0.69 113.55 116.00 2j9b h SER 49 Ca 0.27 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.79 2j9b h SER 49 Cb -0.00 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 2j9b h SER 49 CO -0.10 0.23 -0.01 0.74 -0.53 0.00 0.00 176.83 177.16 2j9b h THR 50 N 0.25 0.95 -0.03 2.23 2.02 -0.99 -2.93 112.91 114.40 2j9b h THR 50 Ca 0.07 -0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.18 2j9b h THR 50 Cb 0.03 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2j9b h THR 50 CO -0.01 0.00 -0.34 -0.07 0.37 0.00 0.00 175.52 175.47 2j9b h LEU 51 N 0.00 0.06 -2.39 2.58 3.38 -0.79 -2.95 115.31 115.21 2j9b h LEU 51 Ca 0.03 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2j9b h LEU 51 Cb 0.04 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2j9b h LEU 51 CO -0.06 0.40 -0.01 0.77 0.09 0.00 0.00 178.44 179.63 2j9b h SER 52 N 0.05 0.00 0.24 -0.43 4.64 -0.66 -1.07 113.55 116.32 2j9b h SER 52 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2j9b h SER 52 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2j9b h SER 52 CO 0.05 0.01 -0.06 0.29 -0.87 0.00 0.00 176.83 176.25 2j9b n LYS 53 N -3.18 0.87 -0.12 4.77 5.02 -1.11 -4.44 118.16 119.97 2j9b n LYS 53 Ca -0.02 -0.25 -0.22 0.00 -2.02 0.00 0.00 58.31 55.80 2j9b n LYS 53 Cb 0.16 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.60 2j9b n LYS 53 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2j9b n LEU 54 N -0.85 1.93 0.20 -0.35 4.77 -0.41 -4.64 117.00 117.65 2j9b n LEU 54 Ca 0.17 0.37 0.04 0.00 -0.03 0.00 0.00 56.01 56.56 2j9b n LEU 54 Cb 0.24 -0.83 0.41 0.00 -2.33 0.00 0.00 43.42 40.91 2j9b n LEU 54 CO 0.21 0.27 0.78 1.55 -1.33 0.00 0.00 177.39 178.87 2j9b h PRO 55 N -1.00 0.00 0.00 3.23 0.13 -1.78 -2.51 132.00 130.08 2j9b h PRO 55 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2j9b h PRO 55 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2j9b h PRO 55 CO -0.27 0.31 0.00 1.28 -0.23 0.00 0.00 178.00 179.09 2j9b n LEU 56 N -4.14 0.00 -0.15 1.56 4.77 -1.26 -1.69 117.00 116.10 2j9b n LEU 56 Ca -0.02 0.18 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 2j9b n LEU 56 Cb 0.36 -0.18 0.66 0.00 -2.33 0.00 0.00 43.42 41.93 2j9b n LEU 56 CO 0.38 -0.01 0.92 0.35 -1.33 0.00 0.00 177.39 177.70 2j9b n THR 57 N -1.18 0.00 -1.56 -5.08 -2.24 -0.94 -4.19 114.28 99.08 2j9b n THR 57 Ca 0.17 -0.08 0.06 0.00 -2.27 0.00 0.00 64.05 61.94 2j9b n THR 57 Cb 0.18 -0.08 0.20 0.00 -2.10 0.00 0.00 70.33 68.54 2j9b n THR 57 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j9b n ALA 58 N -0.78 3.56 -2.03 6.98 0.00 -0.68 -4.58 120.51 122.97 2j9b n ALA 58 Ca 0.17 -3.25 -0.26 0.00 0.00 0.00 0.00 53.44 50.10 2j9b n ALA 58 Cb 0.26 -0.35 0.02 0.00 0.00 0.00 0.00 19.45 19.38 2j9b n ALA 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2j9b n PHE 59 N -1.14 2.90 -1.09 0.00 3.72 -1.26 -4.54 117.46 116.06 2j9b n PHE 59 Ca 0.19 -2.44 -0.30 0.00 -0.05 0.00 0.00 57.45 54.85 2j9b n PHE 59 Cb 0.69 -0.42 0.23 0.00 -0.94 0.00 0.00 39.48 39.04 2j9b n PHE 59 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2j9b s GLY 60 N -3.38 1.58 0.28 1.37 0.00 -1.26 -4.89 107.32 101.02 2j9b s GLY 60 Ca 0.52 -0.81 -0.30 0.00 0.00 0.00 0.00 44.72 44.13 2j9b s GLY 60 CO -0.01 0.02 1.38 -1.55 0.00 0.00 0.00 173.10 172.94 2j9b n PRO 61 N -4.64 2.14 -0.98 2.90 -0.04 -1.26 -2.31 135.00 130.81 2j9b n PRO 61 Ca 0.11 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 2j9b n PRO 61 Cb 0.59 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 2j9b n PRO 61 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j9b n GLY 62 N 1.63 0.63 1.80 0.55 0.00 -1.26 -4.90 105.19 103.65 2j9b n GLY 62 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 2j9b n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2j9b n THR 63 N -2.52 2.46 1.24 2.61 -2.24 -0.98 -3.68 114.28 111.17 2j9b n THR 63 Ca 0.00 -1.30 0.13 0.00 -2.27 0.00 0.00 64.05 60.61 2j9b n THR 63 Cb 0.03 -0.56 0.35 0.00 -2.10 0.00 0.00 70.33 68.05 2j9b n THR 63 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2j9b n ASP 64 N -0.44 1.22 -3.81 3.42 5.75 -1.26 -4.79 116.55 116.65 2j9b n ASP 64 Ca 0.38 -1.05 -0.12 0.00 -0.01 0.00 0.00 54.79 53.99 2j9b n ASP 64 Cb 1.26 0.16 -0.06 0.00 -1.03 0.00 0.00 41.12 41.44 2j9b n ASP 64 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2j9b s LYS 65 N -2.43 1.57 0.00 0.11 -2.85 -1.24 -4.92 119.74 109.97 2j9b s LYS 65 Ca 0.25 -1.53 0.00 0.00 -1.00 0.00 0.00 55.97 53.69 2j9b s LYS 65 Cb 0.19 0.40 0.00 0.00 -2.06 0.00 0.00 37.83 36.37 2j9b s LYS 65 CO 0.50 -0.62 0.00 0.41 0.10 0.00 0.00 175.35 175.74 2j9b n GLY 66 N -0.42 1.49 3.54 0.59 0.00 -1.26 -3.73 105.19 105.40 2j9b n GLY 66 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2j9b n GLY 66 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2j9b s HIS 67 N -2.02 -0.38 0.39 1.61 5.65 -1.26 -3.85 115.29 115.43 2j9b s HIS 67 Ca 0.00 0.16 -0.27 0.00 0.25 0.00 0.00 55.06 55.20 2j9b s HIS 67 Cb 0.00 0.58 -0.11 0.00 -1.18 0.00 0.00 32.58 31.87 2j9b s HIS 67 CO 0.00 -0.77 1.29 0.41 -0.65 0.00 0.00 174.74 175.02 2j9b n GLY 68 N -0.35 0.59 3.33 1.59 0.00 -1.26 -5.00 105.19 104.09 2j9b n GLY 68 Ca -0.11 0.25 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 2j9b n GLY 68 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2j9b s THR 69 N -1.15 0.03 -1.29 2.61 -1.32 -1.26 -4.90 115.64 108.35 2j9b s THR 69 Ca 0.58 -0.22 0.16 0.00 -1.21 0.00 0.00 61.69 61.00 2j9b s THR 69 Cb -0.53 -0.69 0.47 0.00 -1.51 0.00 0.00 72.50 70.24 2j9b s THR 69 CO 0.60 -0.12 1.39 -0.62 -2.21 0.00 0.00 174.62 173.66 2j9b n GLU 70 N 1.74 2.89 -2.26 7.08 1.02 -1.26 -4.99 120.64 124.86 2j9b n GLU 70 Ca -0.18 -2.37 -0.42 0.00 -0.02 0.00 0.00 57.16 54.17 2j9b n GLU 70 Cb 0.56 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.51 2j9b n GLU 70 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2j9b s ALA 71 N -1.14 3.58 0.51 0.62 0.00 -1.26 -4.36 121.76 119.70 2j9b s ALA 71 Ca 0.35 0.81 -0.19 0.00 0.00 0.00 0.00 51.96 52.94 2j9b s ALA 71 Cb 0.19 -3.60 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 2j9b s ALA 71 CO 0.22 -0.95 1.03 0.15 0.00 0.00 0.00 175.76 176.21 2j9b s LYS 72 N 2.57 3.76 0.54 0.00 1.02 -0.18 -4.93 119.74 122.52 2j9b s LYS 72 Ca 0.63 1.25 0.30 0.00 0.02 0.00 0.00 55.97 58.17 2j9b s LYS 72 Cb -0.30 -2.10 1.47 0.00 -0.52 0.00 0.00 37.83 36.38 2j9b s LYS 72 CO 0.25 -0.45 1.91 -1.35 -0.92 0.00 0.00 175.35 174.79 2j9b h PRO 73 N 1.27 0.00 -0.07 -1.68 0.11 -1.95 -1.28 132.00 128.42 2j9b h PRO 73 Ca -0.49 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.64 2j9b h PRO 73 Cb 1.21 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2j9b h PRO 73 CO 0.59 0.00 0.13 0.00 -0.21 0.00 0.00 178.00 178.51 2j9b h ALA 74 N 1.58 1.43 -0.87 -0.75 0.00 -1.91 -1.10 119.26 117.65 2j9b h ALA 74 Ca 0.40 -0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.46 2j9b h ALA 74 Cb 1.59 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.29 2j9b h ALA 74 CO -0.01 -0.16 0.44 0.28 0.00 0.00 0.00 179.25 179.80 2j9b h VAL 75 N 0.00 0.69 0.06 0.00 2.07 -1.53 0.22 116.25 117.77 2j9b h VAL 75 Ca 0.03 -0.21 -0.35 0.00 0.82 0.00 0.00 66.70 66.99 2j9b h VAL 75 Cb 0.29 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 2j9b h VAL 75 CO -0.00 0.11 -2.05 0.79 0.02 0.00 0.00 177.57 176.43 2j9b n TRP 76 N -4.89 0.86 0.96 1.57 8.01 -0.50 -3.99 117.44 119.47 2j9b n TRP 76 Ca 0.18 0.22 0.12 0.00 -1.31 0.00 0.00 57.50 56.71 2j9b n TRP 76 Cb 0.47 -1.13 0.34 0.00 -2.01 0.00 0.00 31.31 28.98 2j9b n TRP 76 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2j9b n SER 77 N -3.28 0.40 -3.15 -0.99 3.41 -0.68 -3.79 113.62 105.53 2j9b n SER 77 Ca -0.31 -0.03 -0.25 0.00 -0.26 0.00 0.00 58.87 58.02 2j9b n SER 77 Cb 1.05 0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.99 2j9b n SER 77 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2j9b n ASP 78 N -1.56 3.09 -0.11 4.04 2.03 0.77 -4.95 116.55 119.86 2j9b n ASP 78 Ca 0.06 -3.37 -0.01 0.00 0.52 0.00 0.00 54.79 51.98 2j9b n ASP 78 Cb 0.35 -0.61 0.25 0.00 -0.72 0.00 0.00 41.12 40.38 2j9b n ASP 78 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2j9b h ALA 79 N 3.44 1.35 -0.66 -1.67 0.00 -1.69 -0.96 119.26 119.07 2j9b h ALA 79 Ca 0.14 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2j9b h ALA 79 Cb 0.68 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2j9b h ALA 79 CO 0.72 0.48 0.11 0.00 0.00 0.00 0.00 179.25 180.57 2j9b h ALA 80 N 1.45 0.96 -0.53 0.00 0.00 -1.92 -0.44 119.26 118.78 2j9b h ALA 80 Ca 0.18 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2j9b h ALA 80 Cb 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2j9b h ALA 80 CO -0.01 0.65 0.27 0.78 0.00 0.00 0.00 179.25 180.94 2j9b h GLY 81 N 1.05 0.82 0.99 0.00 0.00 -1.77 -0.57 103.07 103.58 2j9b h GLY 81 Ca 0.20 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 2j9b h GLY 81 CO 0.01 0.38 0.01 -2.75 0.00 0.00 0.00 176.54 174.19 2j9b h PHE 82 N 0.71 0.88 -0.85 5.60 3.57 -0.87 -1.36 116.94 124.63 2j9b h PHE 82 Ca 0.18 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2j9b h PHE 82 Cb 0.10 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 2j9b h PHE 82 CO -0.01 0.85 0.46 -0.22 -2.23 0.00 0.00 178.31 177.16 2j9b h LYS 83 N 0.66 1.20 -0.66 1.11 1.63 -0.93 -0.08 116.57 119.50 2j9b h LYS 83 Ca 0.13 -0.15 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 2j9b h LYS 83 Cb 0.49 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 2j9b h LYS 83 CO 0.02 0.89 0.28 0.00 -3.45 0.00 0.00 179.45 177.19 2j9b h ALA 84 N 1.25 0.86 -0.60 5.00 0.00 -0.81 0.11 119.26 125.06 2j9b h ALA 84 Ca 0.30 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2j9b h ALA 84 Cb 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2j9b h ALA 84 CO -0.05 0.47 0.11 0.00 0.00 0.00 0.00 179.25 179.78 2j9b h ALA 85 N 1.12 1.06 -0.38 0.00 0.00 -0.80 -0.68 119.26 119.58 2j9b h ALA 85 Ca 0.22 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2j9b h ALA 85 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2j9b h ALA 85 CO -0.02 0.61 -0.06 0.00 0.00 0.00 0.00 179.25 179.78 2j9b h ALA 86 N 1.20 0.51 -0.39 0.00 0.00 -0.56 -2.26 119.26 117.77 2j9b h ALA 86 Ca 0.19 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2j9b h ALA 86 Cb 0.38 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2j9b h ALA 86 CO 0.01 0.35 -0.13 -0.44 0.00 0.00 0.00 179.25 179.04 2j9b h ASP 87 N 0.51 0.69 -0.76 0.00 3.32 -0.60 -0.03 116.42 119.55 2j9b h ASP 87 Ca 0.10 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 2j9b h ASP 87 Cb 0.56 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 2j9b h ASP 87 CO 0.03 0.84 0.40 0.50 -1.72 0.00 0.00 179.24 179.29 2j9b h LYS 88 N 0.63 1.08 -0.19 3.56 3.64 -1.00 -1.21 116.57 123.08 2j9b h LYS 88 Ca 0.11 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2j9b h LYS 88 Cb 0.58 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2j9b h LYS 88 CO 0.04 0.82 0.05 0.35 -2.27 0.00 0.00 179.45 178.43 2j9b h PHE 89 N 1.06 0.33 -0.73 1.91 3.57 -1.01 -2.27 116.94 119.80 2j9b h PHE 89 Ca 0.27 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2j9b h PHE 89 Cb 0.07 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2j9b h PHE 89 CO 0.00 0.43 0.36 0.00 -2.23 0.00 0.00 178.31 176.87 2j9b h ALA 90 N 0.86 1.26 -0.69 2.41 0.00 -0.72 0.10 119.26 122.48 2j9b h ALA 90 Ca 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2j9b h ALA 90 Cb 0.27 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2j9b h ALA 90 CO 0.00 0.58 0.34 0.00 0.00 0.00 0.00 179.25 180.16 2j9b h ALA 91 N 1.36 0.89 -0.47 0.00 0.00 -1.12 -0.46 119.26 119.46 2j9b h ALA 91 Ca 0.25 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2j9b h ALA 91 Cb 0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2j9b h ALA 91 CO -0.03 0.45 -0.03 0.00 0.00 0.00 0.00 179.25 179.63 2j9b h ALA 92 N 1.16 0.64 -0.32 0.00 0.00 -0.80 -2.63 119.26 117.31 2j9b h ALA 92 Ca 0.24 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2j9b h ALA 92 Cb 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2j9b h ALA 92 CO -0.03 0.47 -0.08 0.28 0.00 0.00 0.00 179.25 179.89 2j9b h VAL 93 N 0.70 1.22 -0.73 0.00 2.07 -0.77 -0.64 116.25 118.10 2j9b h VAL 93 Ca 0.13 -0.94 0.02 0.00 0.82 0.00 0.00 66.70 66.73 2j9b h VAL 93 Cb 0.55 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2j9b h VAL 93 CO 0.03 0.31 0.46 0.44 0.02 0.00 0.00 177.57 178.84 2j9b h ASP 94 N 0.49 0.78 -0.28 0.57 3.32 -0.83 0.17 116.42 120.64 2j9b h ASP 94 Ca 0.10 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 2j9b h ASP 94 Cb 0.44 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2j9b h ASP 94 CO 0.02 0.54 -0.28 0.11 -1.72 0.00 0.00 179.24 177.92 2j9b h LYS 95 N 0.92 0.78 -0.34 3.56 1.57 -1.06 -1.53 116.57 120.47 2j9b h LYS 95 Ca 0.28 -0.34 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2j9b h LYS 95 Cb -0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2j9b h LYS 95 CO -0.10 0.96 0.18 1.25 -0.57 0.00 0.00 179.45 181.17 2j9b h LEU 96 N 0.67 0.44 -0.25 2.94 5.85 -0.43 -0.69 115.31 123.83 2j9b h LEU 96 Ca 0.08 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2j9b h LEU 96 Cb 0.80 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2j9b h LEU 96 CO 0.07 0.42 0.03 -0.78 -0.34 0.00 0.00 178.44 177.84 2j9b h ASP 97 N 0.42 -0.04 -0.90 1.25 -0.00 -0.47 -0.03 116.42 116.66 2j9b h ASP 97 Ca 0.12 0.05 0.01 0.00 -0.00 0.00 0.00 57.03 57.21 2j9b h ASP 97 Cb 0.09 0.07 -0.04 0.00 -0.00 0.00 0.00 39.33 39.45 2j9b h ASP 97 CO -0.02 0.01 0.60 0.00 -0.00 0.00 0.00 179.24 179.83 2j9b h ALA 98 N 1.20 1.14 -0.69 -0.78 0.00 -1.06 -2.49 119.26 116.59 2j9b h ALA 98 Ca 0.12 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2j9b h ALA 98 Cb 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2j9b h ALA 98 CO -0.18 0.54 0.14 0.00 0.00 0.00 0.00 179.25 179.75 2j9b h ALA 99 N 1.33 0.94 -0.76 0.00 0.00 -0.55 -2.35 119.26 117.87 2j9b h ALA 99 Ca 0.33 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2j9b h ALA 99 Cb -0.14 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.34 2j9b h ALA 99 CO -0.07 0.67 0.50 0.78 0.00 0.00 0.00 179.25 181.13 2j9b h GLY 100 N 1.07 1.05 2.00 0.00 0.00 -0.60 -1.70 103.07 104.88 2j9b h GLY 100 Ca 0.21 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.06 2j9b h GLY 100 CO 0.01 0.29 -0.61 0.50 0.00 0.00 0.00 176.54 176.72 2j9b h LYS 101 N 0.88 0.00 0.00 4.80 1.57 -1.07 -3.13 116.57 119.62 2j9b h LYS 101 Ca 0.31 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.94 2j9b h LYS 101 Cb 0.13 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2j9b h LYS 101 CO -0.10 0.61 -0.73 1.79 -0.57 0.00 0.00 179.45 180.46 2j9b h THR 102 N 0.00 1.29 0.00 -0.16 1.35 -0.89 -3.47 112.91 111.02 2j9b h THR 102 Ca -0.01 -2.72 0.00 0.00 -0.55 0.00 0.00 66.41 63.14 2j9b h THR 102 Cb 1.13 2.57 0.00 0.00 -1.73 0.00 0.00 68.15 70.12 2j9b h THR 102 CO 0.08 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.67 2j9b n GLY 103 N 1.16 0.31 3.64 5.82 0.00 -0.70 -4.98 105.19 110.44 2j9b n GLY 103 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2j9b n GLY 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j9b s ASP 104 N -2.07 6.92 0.19 1.61 2.15 -1.25 -4.91 116.67 119.31 2j9b s ASP 104 Ca 0.00 1.21 -0.12 0.00 0.43 0.00 0.00 52.55 54.07 2j9b s ASP 104 Cb 0.00 -2.54 0.22 0.00 -0.30 0.00 0.00 42.92 40.30 2j9b s ASP 104 CO 0.00 -0.86 1.71 0.15 -0.17 0.00 0.00 175.17 176.00 2j9b h PHE 105 N 8.18 0.15 -0.68 -5.34 3.04 -1.93 0.08 116.94 120.44 2j9b h PHE 105 Ca -0.22 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.69 2j9b h PHE 105 Cb 1.07 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.57 2j9b h PHE 105 CO 0.82 -0.02 0.14 0.00 -2.02 0.00 0.00 178.31 177.23 2j9b h ALA 106 N 1.42 0.90 -0.52 2.41 0.00 -1.99 0.70 119.26 122.17 2j9b h ALA 106 Ca 0.27 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2j9b h ALA 106 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2j9b h ALA 106 CO -0.35 0.64 -0.14 1.96 0.00 0.00 0.00 179.25 181.35 2j9b h GLN 107 N 1.03 1.01 -0.12 0.00 4.20 -1.76 -1.13 115.11 118.35 2j9b h GLN 107 Ca 0.21 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 2j9b h GLN 107 Cb 0.40 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2j9b h GLN 107 CO 0.01 1.07 0.07 0.82 -0.67 0.00 0.00 178.83 180.13 2j9b h ILE 108 N 0.89 1.06 -0.67 2.54 2.04 -0.65 -1.74 117.51 120.98 2j9b h ILE 108 Ca 0.13 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2j9b h ILE 108 Cb 0.71 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2j9b h ILE 108 CO 0.05 0.06 0.37 0.50 0.00 0.00 0.00 178.15 179.13 2j9b h LYS 109 N 0.13 0.94 -0.61 2.37 3.64 -0.72 0.18 116.57 122.50 2j9b h LYS 109 Ca 0.04 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 2j9b h LYS 109 Cb 0.03 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.64 2j9b h LYS 109 CO -0.01 0.71 0.24 0.00 -2.27 0.00 0.00 179.45 178.12 2j9b h ALA 110 N 1.18 0.79 -0.09 5.00 0.00 -1.11 -1.97 119.26 123.07 2j9b h ALA 110 Ca 0.24 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 2j9b h ALA 110 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2j9b h ALA 110 CO -0.04 0.41 -0.54 0.00 0.00 0.00 0.00 179.25 179.08 2j9b h ALA 111 N 1.09 0.91 -0.77 0.00 0.00 -0.85 -1.89 119.26 117.75 2j9b h ALA 111 Ca 0.20 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.66 2j9b h ALA 111 Cb 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2j9b h ALA 111 CO -0.02 0.69 0.47 0.28 0.00 0.00 0.00 179.25 180.67 2j9b h VAL 112 N 0.20 1.04 -0.27 0.00 2.07 -0.32 0.72 116.25 119.70 2j9b h VAL 112 Ca 0.00 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2j9b h VAL 112 Cb 1.02 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2j9b h VAL 112 CO 0.09 0.16 0.07 1.23 0.02 0.00 0.00 177.57 179.14 2j9b h GLY 113 N 0.88 0.46 0.98 2.17 0.00 -0.90 -0.33 103.07 106.34 2j9b h GLY 113 Ca 0.33 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.32 2j9b h GLY 113 CO -0.15 0.27 0.12 0.83 0.00 0.00 0.00 176.54 177.61 2j9b h GLU 114 N 0.27 0.83 -0.27 4.80 5.08 -1.16 -1.15 114.58 122.97 2j9b h GLU 114 Ca 0.09 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2j9b h GLU 114 Cb 0.27 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2j9b h GLU 114 CO -0.00 0.79 0.10 1.15 -1.00 0.00 0.00 179.01 180.05 2j9b h THR 115 N 0.72 1.19 -0.59 1.13 2.02 -0.72 -2.04 112.91 114.61 2j9b h THR 115 Ca 0.16 -0.59 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 2j9b h THR 115 Cb 0.34 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 2j9b h THR 115 CO 0.00 0.20 0.26 1.23 0.37 0.00 0.00 175.52 177.58 2j9b h GLY 116 N 0.28 0.89 1.39 2.16 0.00 -0.95 -0.68 103.07 106.17 2j9b h GLY 116 Ca 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2j9b h GLY 116 CO -0.00 0.41 0.40 -1.33 0.00 0.00 0.00 176.54 176.01 2j9b h GLY 117 N 0.93 0.88 1.40 4.60 0.00 -0.98 -1.86 103.07 108.04 2j9b h GLY 117 Ca 0.20 -0.33 -0.17 0.00 0.00 0.00 0.00 47.33 47.03 2j9b h GLY 117 CO -0.02 0.33 -0.58 0.00 0.00 0.00 0.00 176.54 176.27 2j9b h ALA 118 N 1.60 0.62 -0.01 3.60 0.00 -0.43 0.04 119.26 124.68 2j9b h ALA 118 Ca 0.23 -0.53 0.02 0.00 0.00 0.00 0.00 54.91 54.63 2j9b h ALA 118 Cb -0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2j9b h ALA 118 CO -0.05 0.69 -0.08 0.00 0.00 0.00 0.00 179.25 179.81 2j9b h LYS 120 N -0.14 0.90 -0.65 0.00 3.64 -1.24 -1.27 116.57 117.80 2j9b h LYS 120 Ca 0.04 -0.34 0.03 0.00 -1.27 0.00 0.00 60.65 59.11 2j9b h LYS 120 Cb 0.19 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 2j9b h LYS 120 CO -0.09 0.98 0.40 0.78 -2.27 0.00 0.00 179.45 179.25 2j9b h GLY 121 N 0.75 0.94 0.73 5.01 0.00 -0.93 0.14 103.07 109.71 2j9b h GLY 121 Ca 0.12 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 2j9b h GLY 121 CO 0.04 0.24 -0.12 0.00 0.00 0.00 0.00 176.54 176.70 2j9b h HIS 123 N -0.04 1.19 -0.91 0.00 -0.00 -0.85 0.27 115.15 114.81 2j9b h HIS 123 Ca 0.02 0.03 0.11 0.00 -0.00 0.00 0.00 60.37 60.54 2j9b h HIS 123 Cb 0.64 -0.40 -0.07 0.00 -0.00 0.00 0.00 27.41 27.58 2j9b h HIS 123 CO 0.08 0.70 0.58 -0.44 -0.00 0.00 0.00 177.93 178.85 2j9b h ASP 124 N 1.24 0.78 0.21 2.45 3.32 -1.00 -1.61 116.42 121.81 2j9b h ASP 124 Ca 0.38 0.03 -0.24 0.00 0.02 0.00 0.00 57.03 57.23 2j9b h ASP 124 Cb -0.02 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 2j9b h ASP 124 CO -0.11 0.43 -2.02 0.29 -1.72 0.00 0.00 179.24 176.11 2j9b n LYS 125 N -4.55 0.66 0.00 3.56 4.01 -0.85 -4.77 118.16 116.21 2j9b n LYS 125 Ca 0.16 0.03 0.00 0.00 -0.51 0.00 0.00 58.31 57.99 2j9b n LYS 125 Cb 0.36 -1.61 0.00 0.00 -0.51 0.00 0.00 35.03 33.27 2j9b n LYS 125 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2j9b n PHE 126 N -2.70 0.00 -0.12 2.13 3.72 0.03 -4.86 117.46 115.66 2j9b n PHE 126 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 2j9b n PHE 126 Cb 0.95 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.49 2j9b n PHE 126 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88