#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jxb s LEU 5 N 0.00 3.59 0.26 1.69 1.43 -1.26 -4.95 118.68 119.43 3jxb s LEU 5 Ca 0.00 1.67 -0.02 0.00 -1.03 0.00 0.00 54.13 54.75 3jxb s LEU 5 Cb 0.00 -4.52 0.49 0.00 0.03 0.00 0.00 46.19 42.19 3jxb s LEU 5 CO 0.00 -0.80 1.77 -0.03 0.23 0.00 0.00 176.35 177.52 3jxb h MET 6 N 0.78 0.61 -0.89 1.70 1.85 -1.83 -1.65 114.93 115.50 3jxb h MET 6 Ca -0.47 -0.04 0.13 0.00 -0.61 0.00 0.00 59.70 58.71 3jxb h MET 6 Cb 1.20 -0.14 -0.07 0.00 0.43 0.00 0.00 31.60 33.02 3jxb h MET 6 CO 0.60 0.40 0.57 0.78 -0.40 0.00 0.00 176.91 178.87 3jxb h GLY 7 N 0.63 1.24 1.22 1.39 0.00 -1.78 -0.20 103.07 105.58 3jxb h GLY 7 Ca 0.44 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.35 3jxb h GLY 7 CO -0.34 0.12 -0.08 0.83 0.00 0.00 0.00 176.54 177.07 3jxb h GLU 8 N 0.75 0.92 -0.60 4.80 5.08 -1.41 -1.47 114.58 122.65 3jxb h GLU 8 Ca 0.44 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 3jxb h GLU 8 Cb 0.62 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 3jxb h GLU 8 CO -0.20 0.96 -0.02 0.00 -1.00 0.00 0.00 179.01 178.75 3jxb h ARG 9 N 0.83 1.07 0.13 2.33 3.08 -1.01 -1.06 114.38 119.75 3jxb h ARG 9 Ca 0.14 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 3jxb h ARG 9 Cb 0.60 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3jxb h ARG 9 CO 0.04 1.05 -0.06 0.82 -1.07 0.00 0.00 179.97 180.74 3jxb h ILE 10 N 0.97 0.91 -0.55 2.04 2.04 -0.88 -1.14 117.51 120.91 3jxb h ILE 10 Ca 0.17 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 65.91 3jxb h ILE 10 Cb 0.58 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 3jxb h ILE 10 CO 0.03 0.04 0.31 -0.09 0.00 0.00 0.00 178.15 178.44 3jxb h ARG 11 N -0.25 0.59 -0.85 2.37 2.43 -1.23 -0.14 114.38 117.30 3jxb h ARG 11 Ca -0.02 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3jxb h ARG 11 Cb 0.20 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 3jxb h ARG 11 CO 0.03 0.39 0.56 0.00 -1.51 0.00 0.00 179.97 179.43 3jxb h ALA 12 N 1.26 1.09 -0.30 2.80 0.00 -1.01 -0.40 119.26 122.70 3jxb h ALA 12 Ca 0.23 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 3jxb h ALA 12 Cb 0.08 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3jxb h ALA 12 CO -0.13 0.45 -0.50 0.00 0.00 0.00 0.00 179.25 179.07 3jxb h ARG 13 N 1.12 0.88 -0.60 0.00 2.47 -0.93 -1.47 114.38 115.85 3jxb h ARG 13 Ca 0.32 -0.54 0.01 0.00 -1.26 0.00 0.00 59.98 58.51 3jxb h ARG 13 Cb -0.09 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.26 3jxb h ARG 13 CO -0.08 1.17 0.40 -0.09 0.56 0.00 0.00 179.97 181.93 3jxb h ARG 14 N 0.66 0.79 -0.45 0.04 2.43 -0.71 -1.93 114.38 115.22 3jxb h ARG 14 Ca 0.02 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 3jxb h ARG 14 Cb 1.11 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 3jxb h ARG 14 CO 0.11 0.52 0.09 0.87 -1.51 0.00 0.00 179.97 180.06 3jxb h LYS 15 N 0.81 0.68 -0.74 0.20 1.57 -0.98 -1.50 116.57 116.60 3jxb h LYS 15 Ca 0.22 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3jxb h LYS 15 Cb -0.09 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 3jxb h LYS 15 CO -0.05 0.63 0.30 0.87 -0.57 0.00 0.00 179.45 180.63 3jxb h LYS 16 N 0.66 1.10 0.00 3.15 1.57 -0.93 -2.00 116.57 120.11 3jxb h LYS 16 Ca 0.15 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3jxb h LYS 16 Cb 0.27 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3jxb h LYS 16 CO -0.00 0.89 0.00 1.28 -0.57 0.00 0.00 179.45 181.05 3jxb n LEU 17 N -4.29 0.39 -2.41 2.94 4.77 -0.75 -4.93 117.00 112.71 3jxb n LEU 17 Ca 0.07 0.57 -0.17 0.00 -0.03 0.00 0.00 56.01 56.45 3jxb n LEU 17 Cb 0.18 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.83 3jxb n LEU 17 CO 0.40 -0.27 0.06 0.29 -1.33 0.00 0.00 177.39 176.54 3jxb n LYS 18 N -1.90 -4.29 -4.42 3.23 5.02 -0.62 -5.02 118.16 110.16 3jxb n LYS 18 Ca 0.04 0.65 -0.27 0.00 -2.02 0.00 0.00 58.31 56.71 3jxb n LYS 18 Cb 0.29 -5.00 -0.12 0.00 -0.02 0.00 0.00 35.03 30.18 3jxb n LYS 18 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3jxb s ILE 19 N -3.08 2.34 0.69 -0.18 -4.36 -1.14 -5.06 121.20 110.41 3jxb s ILE 19 Ca 0.29 -2.02 -0.11 0.00 -0.26 0.00 0.00 60.65 58.55 3jxb s ILE 19 Cb -0.13 -2.12 0.00 0.00 1.25 0.00 0.00 42.46 41.47 3jxb s ILE 19 CO 0.35 -0.11 1.06 -0.13 0.24 0.00 0.00 174.94 176.35 3jxb s ARG 20 N -2.65 3.01 0.23 0.37 0.52 -1.26 -4.67 118.95 114.49 3jxb s ARG 20 Ca 0.20 0.93 -0.07 0.00 -0.52 0.00 0.00 55.73 56.27 3jxb s ARG 20 Cb -0.08 -2.00 0.28 0.00 0.52 0.00 0.00 34.95 33.67 3jxb s ARG 20 CO 0.10 -1.04 1.84 1.96 0.02 0.00 0.00 175.30 178.17 3jxb h GLN 21 N -0.68 0.84 -0.81 3.54 4.20 -1.99 -1.72 115.11 118.50 3jxb h GLN 21 Ca -0.44 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.21 3jxb h GLN 21 Cb 1.21 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.76 3jxb h GLN 21 CO 0.57 0.56 0.45 0.00 -0.67 0.00 0.00 178.83 179.74 3jxb h ALA 22 N 1.37 1.27 -0.46 3.87 0.00 -1.92 0.10 119.26 123.49 3jxb h ALA 22 Ca 0.34 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3jxb h ALA 22 Cb 0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3jxb h ALA 22 CO -0.16 0.60 0.04 0.00 0.00 0.00 0.00 179.25 179.72 3jxb h ALA 23 N 1.37 0.62 -0.53 0.00 0.00 -1.81 -0.21 119.26 118.70 3jxb h ALA 23 Ca 0.29 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3jxb h ALA 23 Cb 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3jxb h ALA 23 CO -0.05 0.38 0.12 1.25 0.00 0.00 0.00 179.25 180.96 3jxb h LEU 24 N 0.65 0.80 -0.35 0.00 5.85 -0.81 -2.36 115.31 119.08 3jxb h LEU 24 Ca 0.14 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.68 3jxb h LEU 24 Cb 0.44 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 3jxb h LEU 24 CO 0.02 0.83 -0.01 1.23 -0.34 0.00 0.00 178.44 180.17 3jxb h GLY 25 N 0.74 0.34 0.76 3.75 0.00 -0.39 -0.95 103.07 107.32 3jxb h GLY 25 Ca 0.17 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.58 3jxb h GLY 25 CO 0.00 -0.09 0.31 1.70 0.00 0.00 0.00 176.54 178.47 3jxb h LYS 26 N 0.09 0.58 -0.54 4.80 1.63 -0.88 0.30 116.57 122.55 3jxb h LYS 26 Ca 0.17 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.97 3jxb h LYS 26 Cb 0.24 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.70 3jxb h LYS 26 CO -0.29 0.39 0.30 0.52 -3.45 0.00 0.00 179.45 176.91 3jxb h MET 27 N 0.60 0.57 0.00 1.90 2.86 -0.87 -3.05 114.93 116.95 3jxb h MET 27 Ca 0.24 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.67 3jxb h MET 27 Cb 0.11 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3jxb h MET 27 CO -0.14 0.38 -0.83 0.28 1.06 0.00 0.00 176.91 177.65 3jxb h VAL 28 N 0.59 1.49 -0.03 -2.22 2.07 -0.66 -3.48 116.25 114.00 3jxb h VAL 28 Ca 0.23 -2.95 0.00 0.00 0.82 0.00 0.00 66.70 64.79 3jxb h VAL 28 Cb 0.08 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3jxb h VAL 28 CO -0.13 0.81 0.00 0.61 0.02 0.00 0.00 177.57 178.89 3jxb n GLY 29 N 1.14 1.41 3.34 2.17 0.00 0.92 -4.86 105.19 109.32 3jxb n GLY 29 Ca 0.00 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 3jxb n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3jxb s VAL 30 N -2.03 0.53 0.80 1.61 -7.23 -0.46 -5.03 120.40 108.58 3jxb s VAL 30 Ca 0.00 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 3jxb s VAL 30 Cb 0.00 -2.59 0.07 0.00 0.56 0.00 0.00 36.38 34.42 3jxb s VAL 30 CO 0.00 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 174.94 3jxb s SER 31 N -3.36 4.40 0.34 4.85 1.04 -1.26 -3.90 113.70 115.80 3jxb s SER 31 Ca 0.36 1.60 0.05 0.00 0.48 0.00 0.00 55.95 58.44 3jxb s SER 31 Cb 0.07 -2.34 0.70 0.00 0.10 0.00 0.00 66.02 64.55 3jxb s SER 31 CO 0.15 -2.07 1.91 -0.55 0.98 0.00 0.00 173.24 173.66 3jxb h ASN 32 N -1.15 0.74 -0.67 7.02 -1.07 -1.85 -2.76 115.58 115.83 3jxb h ASN 32 Ca -0.46 0.02 -0.04 0.00 0.07 0.00 0.00 56.30 55.89 3jxb h ASN 32 Cb 1.25 -0.14 -0.03 0.00 -2.07 0.00 0.00 38.32 37.33 3jxb h ASN 32 CO 0.55 0.44 0.26 0.58 0.07 0.00 0.00 177.43 179.33 3jxb h VAL 33 N 0.82 1.24 -0.59 6.14 2.07 -1.93 -1.52 116.25 122.50 3jxb h VAL 33 Ca 0.39 -0.78 0.09 0.00 0.82 0.00 0.00 66.70 67.22 3jxb h VAL 33 Cb 0.41 0.49 -0.07 0.00 -1.52 0.00 0.00 31.29 30.60 3jxb h VAL 33 CO -0.16 0.31 0.20 0.00 0.02 0.00 0.00 177.57 177.95 3jxb h ALA 34 N 1.11 0.74 -0.50 1.67 0.00 -1.86 0.11 119.26 120.52 3jxb h ALA 34 Ca 0.22 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.24 3jxb h ALA 34 Cb 0.23 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3jxb h ALA 34 CO -0.02 -0.21 0.30 0.82 0.00 0.00 0.00 179.25 180.14 3jxb h ILE 35 N 0.38 1.06 -0.37 0.00 1.08 -1.20 -0.55 117.51 117.91 3jxb h ILE 35 Ca 0.29 -0.21 0.03 0.00 -0.39 0.00 0.00 64.86 64.59 3jxb h ILE 35 Cb 0.37 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 34.48 3jxb h ILE 35 CO -0.31 0.11 0.17 -1.28 -0.69 0.00 0.00 178.15 176.16 3jxb h SER 36 N 0.60 0.25 -0.67 1.72 0.87 -0.59 -0.26 113.55 115.47 3jxb h SER 36 Ca 0.20 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 3jxb h SER 36 Cb 0.02 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 3jxb h SER 36 CO -0.09 0.18 0.38 1.56 -0.53 0.00 0.00 176.83 178.34 3jxb h GLN 37 N 0.36 0.93 -0.27 2.24 4.20 -0.42 -1.46 115.11 120.69 3jxb h GLN 37 Ca 0.16 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 3jxb h GLN 37 Cb 0.08 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 3jxb h GLN 37 CO -0.12 0.68 0.02 -1.49 -0.67 0.00 0.00 178.83 177.25 3jxb h TRP 38 N 0.92 0.50 -0.36 2.96 6.55 -0.73 0.33 115.95 126.12 3jxb h TRP 38 Ca 0.24 -0.08 -0.03 0.00 0.95 0.00 0.00 58.89 59.97 3jxb h TRP 38 Cb 0.02 -0.13 -0.02 0.00 -0.86 0.00 0.00 29.16 28.17 3jxb h TRP 38 CO -0.01 0.60 0.09 0.93 -1.05 0.00 0.00 178.44 178.99 3jxb h GLU 39 N 0.25 0.53 -0.03 0.49 5.08 -0.74 -1.73 114.58 118.42 3jxb h GLU 39 Ca 0.08 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3jxb h GLU 39 Cb 0.39 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3jxb h GLU 39 CO 0.01 0.49 0.00 0.54 -1.00 0.00 0.00 179.01 179.05 3jxb n ARG 40 N -4.34 1.58 -1.84 2.33 1.74 -0.58 -3.89 116.66 111.66 3jxb n ARG 40 Ca 0.02 -0.84 -0.17 0.00 -0.77 0.00 0.00 57.85 56.09 3jxb n ARG 40 Cb 0.19 -1.47 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 3jxb n ARG 40 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3jxb n SER 41 N 0.03 -4.95 -0.13 0.55 7.64 -0.65 -4.88 113.62 111.22 3jxb n SER 41 Ca 0.19 0.22 -0.08 0.00 1.01 0.00 0.00 58.87 60.22 3jxb n SER 41 Cb 0.32 -3.97 0.08 0.00 -1.01 0.00 0.00 64.21 59.63 3jxb n SER 41 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3jxb h GLU 42 N 0.00 0.87 -4.25 1.43 4.81 -1.20 -3.46 114.58 112.78 3jxb h GLU 42 Ca -0.36 -0.31 -0.17 0.00 -0.13 0.00 0.00 59.36 58.39 3jxb h GLU 42 Cb 1.17 -0.06 -0.13 0.00 0.63 0.00 0.00 28.75 30.35 3jxb h GLU 42 CO 0.48 0.94 -0.46 0.95 -0.73 0.00 0.00 179.01 180.20 3jxb s THR 43 N -4.80 0.02 0.10 0.32 -4.23 -1.15 -5.03 115.64 100.86 3jxb s THR 43 Ca -0.10 -1.77 0.09 0.00 -1.18 0.00 0.00 61.69 58.73 3jxb s THR 43 Cb 0.13 -2.31 -0.04 0.00 1.34 0.00 0.00 72.50 71.63 3jxb s THR 43 CO 0.84 -0.08 -0.22 -1.61 -0.54 0.00 0.00 174.62 173.01 3jxb s GLU 44 N -4.09 1.72 0.51 3.99 2.02 -1.26 -4.08 118.70 117.51 3jxb s GLU 44 Ca 0.31 -1.19 -0.22 0.00 0.02 0.00 0.00 54.97 53.89 3jxb s GLU 44 Cb 0.05 -2.04 -0.06 0.00 0.10 0.00 0.00 34.13 32.17 3jxb s GLU 44 CO 0.09 0.49 1.26 -1.25 0.02 0.00 0.00 175.26 175.87 3jxb s PRO 45 N -1.86 3.42 0.51 0.39 0.04 -1.26 -5.02 135.00 131.22 3jxb s PRO 45 Ca 0.15 2.01 -0.09 0.00 0.04 0.00 0.00 61.00 63.11 3jxb s PRO 45 Cb -0.10 -2.31 0.12 0.00 0.04 0.00 0.00 34.50 32.25 3jxb s PRO 45 CO 0.07 -0.90 0.51 0.27 0.04 0.00 0.00 177.00 176.99 3jxb n ASN 46 N -0.80 -1.07 0.26 6.66 0.23 -1.26 -4.55 115.26 114.73 3jxb n ASN 46 Ca 0.09 -0.91 -0.16 0.00 -0.53 0.00 0.00 54.58 53.08 3jxb n ASN 46 Cb 0.47 -0.44 -0.08 0.00 -2.08 0.00 0.00 39.78 37.64 3jxb n ASN 46 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3jxb h GLY 47 N -1.29 -0.66 1.04 4.83 0.00 -1.99 0.10 103.07 105.11 3jxb h GLY 47 Ca -0.18 0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 3jxb h GLY 47 CO 0.12 -0.24 0.33 1.05 0.00 0.00 0.00 176.54 177.80 3jxb h GLU 48 N -0.71 1.17 -0.17 4.80 4.11 -2.00 -2.30 114.58 119.46 3jxb h GLU 48 Ca -0.06 -0.20 -0.16 0.00 0.07 0.00 0.00 59.36 59.01 3jxb h GLU 48 Cb 0.53 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3jxb h GLU 48 CO 0.11 0.94 -0.54 -0.91 0.07 0.00 0.00 179.01 178.67 3jxb h ASN 49 N 1.14 0.57 -0.58 3.06 2.35 -1.88 -1.67 115.58 118.56 3jxb h ASN 49 Ca 0.26 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3jxb h ASN 49 Cb 0.19 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.37 3jxb h ASN 49 CO -0.02 1.00 0.32 0.25 -1.65 0.00 0.00 177.43 177.32 3jxb h LEU 50 N 0.40 0.73 -0.37 1.61 5.85 -0.49 0.21 115.31 123.24 3jxb h LEU 50 Ca 0.01 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 3jxb h LEU 50 Cb 1.07 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 3jxb h LEU 50 CO 0.10 0.61 0.15 -0.07 -0.34 0.00 0.00 178.44 178.89 3jxb h LEU 51 N 0.79 0.51 -0.59 2.25 3.38 -1.28 -0.91 115.31 119.45 3jxb h LEU 51 Ca 0.21 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3jxb h LEU 51 Cb 0.05 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3jxb h LEU 51 CO -0.03 0.53 0.21 0.00 0.09 0.00 0.00 178.44 179.23 3jxb h ALA 52 N 0.99 0.77 -0.58 1.53 0.00 -1.14 -2.58 119.26 118.26 3jxb h ALA 52 Ca 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3jxb h ALA 52 Cb 0.18 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3jxb h ALA 52 CO -0.01 0.41 0.30 1.25 0.00 0.00 0.00 179.25 181.20 3jxb h LEU 53 N 0.82 0.74 -0.93 0.00 5.85 -0.42 -1.57 115.31 119.80 3jxb h LEU 53 Ca 0.19 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.83 3jxb h LEU 53 Cb 0.25 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 3jxb h LEU 53 CO -0.01 0.64 0.61 0.28 -0.34 0.00 0.00 178.44 179.62 3jxb h SER 54 N 0.79 1.02 -0.40 1.25 0.02 -1.02 -0.76 113.55 114.46 3jxb h SER 54 Ca 0.20 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.08 3jxb h SER 54 Cb 0.08 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 3jxb h SER 54 CO -0.03 0.71 0.01 0.11 -1.14 0.00 0.00 176.83 176.49 3jxb h LYS 55 N 1.19 0.70 -0.42 3.45 1.57 -1.24 -0.48 116.57 121.35 3jxb h LYS 55 Ca 0.37 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.89 3jxb h LYS 55 Cb -0.03 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3jxb h LYS 55 CO -0.11 0.78 0.10 0.00 -0.57 0.00 0.00 179.45 179.64 3jxb h ALA 56 N 0.89 1.40 -0.02 3.86 0.00 -0.95 -2.73 119.26 121.72 3jxb h ALA 56 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3jxb h ALA 56 Cb 0.45 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3jxb h ALA 56 CO 0.02 0.44 -0.03 1.28 0.00 0.00 0.00 179.25 180.96 3jxb n LEU 57 N -4.32 1.93 -3.55 0.00 4.77 -0.32 -4.97 117.00 110.55 3jxb n LEU 57 Ca 0.03 -0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 55.15 3jxb n LEU 57 Cb 0.20 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.36 3jxb n LEU 57 CO 0.38 0.32 0.19 0.00 -1.33 0.00 0.00 177.39 176.96 3jxb n GLN 58 N 0.48 -7.35 -4.12 3.23 6.02 -0.28 -5.00 117.38 110.36 3jxb n GLN 58 Ca 0.17 0.82 -0.13 0.00 -0.01 0.00 0.00 57.00 57.86 3jxb n GLN 58 Cb 0.43 -5.85 -0.07 0.00 1.02 0.00 0.00 30.24 25.77 3jxb n GLN 58 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3jxb s SER 60 N -3.16 6.68 0.40 0.00 1.04 -1.26 -4.32 113.70 113.07 3jxb s SER 60 Ca 0.32 1.51 0.07 0.00 0.48 0.00 0.00 55.95 58.33 3jxb s SER 60 Cb 0.02 -2.48 0.84 0.00 0.10 0.00 0.00 66.02 64.50 3jxb s SER 60 CO 0.15 -0.49 2.04 -0.65 0.98 0.00 0.00 173.24 175.27 3jxb h PRO 61 N 1.26 0.58 -0.62 4.02 0.11 -1.91 -2.34 132.00 133.10 3jxb h PRO 61 Ca -0.47 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 3jxb h PRO 61 Cb 1.18 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 3jxb h PRO 61 CO 0.62 0.38 0.19 -0.44 -0.21 0.00 0.00 178.00 178.54 3jxb h ASP 62 N 0.60 0.88 -0.27 -2.05 3.32 -1.99 -0.34 116.42 116.57 3jxb h ASP 62 Ca 0.19 -0.15 0.05 0.00 0.02 0.00 0.00 57.03 57.13 3jxb h ASP 62 Cb 0.02 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.29 3jxb h ASP 62 CO -0.04 0.83 -0.02 0.22 -1.72 0.00 0.00 179.24 178.51 3jxb h TYR 63 N 0.92 -0.06 -0.12 4.55 3.20 -1.78 0.60 116.97 124.28 3jxb h TYR 63 Ca 0.20 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 3jxb h TYR 63 Cb 0.27 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 3jxb h TYR 63 CO 0.02 -0.07 0.04 -0.07 -1.64 0.00 0.00 178.16 176.44 3jxb h LEU 64 N 0.05 0.17 -0.36 2.82 3.38 -1.17 0.34 115.31 120.55 3jxb h LEU 64 Ca 0.13 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3jxb h LEU 64 Cb 0.18 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3jxb h LEU 64 CO -0.24 0.32 0.12 -0.07 0.09 0.00 0.00 178.44 178.65 3jxb h LEU 65 N 0.01 0.52 -0.77 1.67 3.38 -0.91 -3.39 115.31 115.82 3jxb h LEU 65 Ca 0.04 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3jxb h LEU 65 Cb 0.21 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3jxb h LEU 65 CO -0.00 0.58 0.00 2.29 0.09 0.00 0.00 178.44 181.40 3jxb n LYS 66 N -4.65 -0.18 -0.28 1.13 2.85 0.19 -4.66 118.16 112.56 3jxb n LYS 66 Ca -0.01 -0.38 0.00 0.00 -1.05 0.00 0.00 58.31 56.87 3jxb n LYS 66 Cb 0.17 -0.76 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 3jxb n LYS 66 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3jxb n GLY 67 N -0.04 2.43 0.00 2.58 0.00 0.12 -5.00 105.19 105.28 3jxb n GLY 67 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3jxb n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66