#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3d n LYS 2 N 0.00 2.35 -3.13 0.03 5.02 -1.26 -4.86 118.16 116.31 1j3d n LYS 2 Ca 0.00 -2.99 -0.45 0.00 -2.02 0.00 0.00 58.31 52.85 1j3d n LYS 2 Cb 0.00 -2.17 -0.04 0.00 -0.02 0.00 0.00 35.03 32.80 1j3d n LYS 2 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1j3d s LYS 3 N -3.25 3.18 1.26 1.97 2.47 -1.26 -5.05 119.74 119.06 1j3d s LYS 3 Ca 0.56 -1.54 -0.16 0.00 -1.56 0.00 0.00 55.97 53.27 1j3d s LYS 3 Cb 0.47 -4.37 0.31 0.00 -1.46 0.00 0.00 37.83 32.79 1j3d s LYS 3 CO 0.11 -1.53 0.91 -0.25 0.16 0.00 0.00 175.35 174.75 1j3d n ASP 4 N 5.99 -2.44 0.17 1.43 8.00 -1.26 -4.88 116.55 123.56 1j3d n ASP 4 Ca -0.03 -0.35 0.03 0.00 0.71 0.00 0.00 54.79 55.14 1j3d n ASP 4 Cb 0.44 -1.17 0.28 0.00 -0.02 0.00 0.00 41.12 40.65 1j3d n ASP 4 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1j3d h PRO 5 N -2.92 0.00 0.01 -0.24 0.13 -2.02 -3.00 132.00 123.96 1j3d h PRO 5 Ca -0.58 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.35 1j3d h PRO 5 Cb 1.33 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1j3d h PRO 5 CO 0.44 0.47 -0.91 -0.91 -0.23 0.00 0.00 178.00 176.86 1j3d h ASN 6 N 0.00 0.15 -4.02 1.44 -0.26 -2.03 -3.45 115.58 107.41 1j3d h ASN 6 Ca -0.00 -0.13 -0.48 0.00 -0.56 0.00 0.00 56.30 55.12 1j3d h ASN 6 Cb 0.93 -0.05 0.03 0.00 -1.06 0.00 0.00 38.32 38.17 1j3d h ASN 6 CO 0.06 0.97 0.42 0.00 -1.06 0.00 0.00 177.43 177.82 1j3d s ALA 7 N -3.06 2.95 -0.07 -0.83 0.00 -1.14 -5.01 121.76 114.61 1j3d s ALA 7 Ca -0.01 0.72 -0.24 0.00 0.00 0.00 0.00 51.96 52.43 1j3d s ALA 7 Cb 0.10 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1j3d s ALA 7 CO 0.82 -0.38 0.71 -1.25 0.00 0.00 0.00 175.76 175.67 1j3d s PRO 8 N -2.87 4.44 0.94 0.00 0.04 -1.26 -4.75 135.00 131.53 1j3d s PRO 8 Ca 0.64 0.90 -0.13 0.00 0.04 0.00 0.00 61.00 62.45 1j3d s PRO 8 Cb -0.21 -3.45 0.12 0.00 0.04 0.00 0.00 34.50 31.00 1j3d s PRO 8 CO 0.26 0.05 0.15 1.63 0.04 0.00 0.00 177.00 179.12 1j3d n LYS 9 N 3.83 -1.77 -1.64 4.56 5.02 -1.26 -4.93 118.16 121.97 1j3d n LYS 9 Ca -0.01 -0.52 -0.30 0.00 -2.02 0.00 0.00 58.31 55.45 1j3d n LYS 9 Cb 0.51 -1.39 0.06 0.00 -0.02 0.00 0.00 35.03 34.20 1j3d n LYS 9 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1j3d s ARG 10 N -3.17 2.63 -0.36 1.97 0.52 -1.26 -4.97 118.95 114.32 1j3d s ARG 10 Ca 0.32 0.73 -0.29 0.00 -0.52 0.00 0.00 55.73 55.97 1j3d s ARG 10 Cb -0.05 -1.97 0.01 0.00 0.52 0.00 0.00 34.95 33.46 1j3d s ARG 10 CO 0.32 -1.26 1.34 -1.25 0.02 0.00 0.00 175.30 174.48 1j3d s PRO 11 N -5.15 3.75 0.53 3.54 0.04 -1.26 -4.97 135.00 131.48 1j3d s PRO 11 Ca 0.59 1.07 -0.05 0.00 0.04 0.00 0.00 61.00 62.65 1j3d s PRO 11 Cb -0.13 -3.95 -0.01 0.00 0.04 0.00 0.00 34.50 30.45 1j3d s PRO 11 CO 0.54 -1.33 0.83 -1.25 0.04 0.00 0.00 177.00 175.83 1j3d s PRO 12 N 4.52 3.24 0.25 0.56 0.04 -1.26 -5.02 135.00 137.34 1j3d s PRO 12 Ca 0.58 0.08 0.11 0.00 0.04 0.00 0.00 61.00 61.80 1j3d s PRO 12 Cb -0.15 -2.34 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1j3d s PRO 12 CO 0.28 -0.43 -0.12 -1.12 0.04 0.00 0.00 177.00 175.65 1j3d s SER 13 N -4.20 4.00 0.06 6.66 0.01 -1.26 -4.52 113.70 114.44 1j3d s SER 13 Ca 0.50 -0.82 -0.30 0.00 1.31 0.00 0.00 55.95 56.65 1j3d s SER 13 Cb -0.10 -0.54 -0.18 0.00 0.21 0.00 0.00 66.02 65.41 1j3d s SER 13 CO 0.45 0.04 1.55 0.00 0.41 0.00 0.00 173.24 175.69 1j3d h ALA 14 N 2.33 -0.69 -0.40 1.44 0.00 -1.91 -0.38 119.26 119.66 1j3d h ALA 14 Ca -0.43 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.32 1j3d h ALA 14 Cb 1.24 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1j3d h ALA 14 CO 0.58 -0.85 0.27 0.35 0.00 0.00 0.00 179.25 179.60 1j3d h PHE 15 N -0.76 0.48 -0.18 0.00 3.57 -1.97 -0.43 116.94 117.65 1j3d h PHE 15 Ca -0.07 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.37 1j3d h PHE 15 Cb 0.56 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1j3d h PHE 15 CO -0.02 0.29 -0.20 0.35 -2.23 0.00 0.00 178.31 176.50 1j3d h PHE 16 N 0.51 0.34 0.00 0.41 3.04 -1.86 -1.54 116.94 117.84 1j3d h PHE 16 Ca 0.15 -0.06 0.00 0.00 3.98 0.00 0.00 57.97 62.05 1j3d h PHE 16 Cb -0.01 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.41 1j3d h PHE 16 CO -0.00 0.50 0.00 1.28 -2.02 0.00 0.00 178.31 178.07 1j3d n LEU 17 N -4.19 0.38 -0.31 0.59 4.32 -0.19 -0.17 117.00 117.43 1j3d n LEU 17 Ca -0.01 0.64 0.00 0.00 -0.02 0.00 0.00 56.01 56.63 1j3d n LEU 17 Cb 0.34 -0.30 0.05 0.00 -1.62 0.00 0.00 43.42 41.89 1j3d n LEU 17 CO 0.40 -0.30 0.49 0.33 -1.22 0.00 0.00 177.39 177.09 1j3d n PHE 18 N -1.39 0.08 -0.11 -1.77 7.35 -0.98 0.50 117.46 121.13 1j3d n PHE 18 Ca 0.00 1.01 -0.10 0.00 -0.76 0.00 0.00 57.45 57.60 1j3d n PHE 18 Cb 0.00 -0.84 -0.02 0.00 0.35 0.00 0.00 39.48 38.97 1j3d n PHE 18 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1j3d h SER 20 N 0.37 0.00 0.29 0.00 0.87 0.34 0.49 113.55 115.91 1j3d h SER 20 Ca 0.10 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.53 1j3d h SER 20 Cb 0.29 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1j3d h SER 20 CO 0.00 0.00 -1.83 -1.84 -0.53 0.00 0.00 176.83 172.63 1j3d n GLU 21 N -3.88 0.65 -0.65 2.24 0.28 -0.65 -4.20 120.64 114.43 1j3d n GLU 21 Ca 0.07 -0.01 0.08 0.00 -0.16 0.00 0.00 57.16 57.14 1j3d n GLU 21 Cb 0.58 -1.63 0.35 0.00 1.43 0.00 0.00 31.44 32.17 1j3d n GLU 21 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1j3d n HIS 22 N -2.58 1.52 0.00 -1.84 8.25 -0.39 -4.50 115.22 115.68 1j3d n HIS 22 Ca -0.12 -0.69 -0.21 0.00 -0.26 0.00 0.00 57.72 56.44 1j3d n HIS 22 Cb 0.77 -0.33 -0.14 0.00 1.12 0.00 0.00 29.99 31.42 1j3d n HIS 22 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1j3d h ARG 23 N 3.56 0.23 0.00 -0.41 2.43 -1.13 -3.32 114.38 115.74 1j3d h ARG 23 Ca 0.00 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1j3d h ARG 23 Cb 1.58 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 31.28 1j3d h ARG 23 CO 0.30 1.19 0.00 -0.35 -1.51 0.00 0.00 179.97 179.60 1j3d n PRO 24 N -3.97 0.05 0.05 0.20 -0.04 -1.26 -3.13 135.00 126.89 1j3d n PRO 24 Ca -0.24 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.19 1j3d n PRO 24 Cb 0.88 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.70 1j3d n PRO 24 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1j3d h LYS 25 N 0.00 0.13 0.00 0.54 3.64 -1.82 -3.30 116.57 115.76 1j3d h LYS 25 Ca 0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1j3d h LYS 25 Cb 0.38 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1j3d h LYS 25 CO 0.00 0.95 0.00 0.82 -2.27 0.00 0.00 179.45 178.95 1j3d h ILE 26 N 0.03 0.00 0.00 2.00 1.08 -1.63 -3.11 117.51 115.88 1j3d h ILE 26 Ca -0.18 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.54 1j3d h ILE 26 Cb 1.94 1.73 0.00 0.00 -3.07 0.00 0.00 36.82 37.43 1j3d h ILE 26 CO 0.14 0.00 0.00 0.11 -0.69 0.00 0.00 178.15 177.71 1j3d h LYS 27 N 0.00 0.00 -0.01 2.37 1.57 -1.63 -2.11 116.57 116.77 1j3d h LYS 27 Ca 0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 1j3d h LYS 27 Cb 0.81 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.13 1j3d h LYS 27 CO 0.00 0.00 -0.84 0.77 -0.57 0.00 0.00 179.45 178.81 1j3d h SER 28 N 0.00 0.75 -0.24 0.86 0.02 -1.68 -3.26 113.55 110.01 1j3d h SER 28 Ca 0.00 -0.74 0.00 0.00 -0.84 0.00 0.00 61.79 60.21 1j3d h SER 28 Cb 0.72 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1j3d h SER 28 CO 0.00 1.39 0.00 -0.62 -1.14 0.00 0.00 176.83 176.46 1j3d n GLU 29 N -4.02 2.10 -3.19 3.45 1.02 -1.21 -4.63 120.64 114.17 1j3d n GLU 29 Ca -0.11 -1.66 -0.16 0.00 -0.02 0.00 0.00 57.16 55.21 1j3d n GLU 29 Cb 0.79 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.69 1j3d n GLU 29 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1j3d s HIS 30 N -1.70 -0.21 -0.41 -0.32 3.76 -0.80 -5.09 115.29 110.53 1j3d s HIS 30 Ca 0.35 -1.30 -0.28 0.00 -0.15 0.00 0.00 55.06 53.68 1j3d s HIS 30 Cb 0.20 -0.36 -0.02 0.00 1.11 0.00 0.00 32.58 33.51 1j3d s HIS 30 CO 0.29 -1.02 1.87 -1.25 -0.85 0.00 0.00 174.74 173.78 1j3d s PRO 31 N 0.74 3.07 0.00 8.40 0.04 -1.25 -1.80 135.00 144.20 1j3d s PRO 31 Ca 0.27 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.54 1j3d s PRO 31 Cb -0.03 -4.28 0.00 0.00 0.04 0.00 0.00 34.50 30.23 1j3d s PRO 31 CO -0.10 -2.18 0.00 0.41 0.04 0.00 0.00 177.00 175.17 1j3d n GLY 32 N 5.54 2.50 3.35 0.56 0.00 -1.26 -5.05 105.19 110.83 1j3d n GLY 32 Ca 0.23 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.69 1j3d n GLY 32 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1j3d n LEU 33 N 0.00 1.33 0.00 0.99 -0.00 -0.75 -4.93 117.00 113.65 1j3d n LEU 33 Ca 0.00 0.61 0.00 0.00 -0.00 0.00 0.00 56.01 56.62 1j3d n LEU 33 Cb 0.00 -1.04 0.00 0.00 -0.00 0.00 0.00 43.42 42.38 1j3d n LEU 33 CO 0.00 -0.74 0.00 -1.54 -0.00 0.00 0.00 177.39 175.11 1j3d n SER 34 N 8.16 -0.26 -1.13 1.96 3.41 -1.26 -4.92 113.62 119.57 1j3d n SER 34 Ca 0.48 -0.56 0.04 0.00 -0.26 0.00 0.00 58.87 58.57 1j3d n SER 34 Cb 0.06 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.22 1j3d n SER 34 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1j3d n ILE 35 N -1.58 1.27 -0.09 -1.33 2.08 -1.26 -3.99 119.36 114.47 1j3d n ILE 35 Ca 0.00 -0.70 -0.11 0.00 0.56 0.00 0.00 62.75 62.50 1j3d n ILE 35 Cb 0.00 -0.25 -0.04 0.00 -0.75 0.00 0.00 39.64 38.60 1j3d n ILE 35 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1j3d n GLY 36 N 0.50 -0.73 0.13 7.39 0.00 -1.26 -3.60 105.19 107.62 1j3d n GLY 36 Ca 0.14 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 1j3d n GLY 36 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1j3d h ASP 37 N -1.00 -0.19 -0.71 1.61 3.32 -1.96 -2.11 116.42 115.38 1j3d h ASP 37 Ca -0.11 -0.30 0.08 0.00 0.02 0.00 0.00 57.03 56.72 1j3d h ASP 37 Cb 0.90 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.44 1j3d h ASP 37 CO -0.07 0.23 0.38 0.74 -1.72 0.00 0.00 179.24 178.79 1j3d h THR 38 N -0.66 0.91 0.00 0.35 2.02 -1.82 0.13 112.91 113.84 1j3d h THR 38 Ca -0.02 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 1j3d h THR 38 Cb 0.48 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1j3d h THR 38 CO 0.04 0.12 -0.14 0.00 0.37 0.00 0.00 175.52 175.91 1j3d h ALA 39 N 1.39 1.57 0.00 6.16 0.00 -1.61 0.49 119.26 127.27 1j3d h ALA 39 Ca 0.33 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 1j3d h ALA 39 Cb 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1j3d h ALA 39 CO -0.22 0.18 -0.61 0.87 0.00 0.00 0.00 179.25 179.46 1j3d h LYS 40 N 0.00 0.00 0.00 0.00 1.57 -0.10 -2.42 116.57 115.63 1j3d h LYS 40 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1j3d h LYS 40 Cb 0.28 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 1j3d h LYS 40 CO 0.02 0.61 -1.69 1.63 -0.57 0.00 0.00 179.45 179.45 1j3d n LYS 41 N -3.33 0.64 0.01 3.15 5.02 -0.29 -3.63 118.16 119.73 1j3d n LYS 41 Ca 0.01 0.14 -0.05 0.00 -2.02 0.00 0.00 58.31 56.39 1j3d n LYS 41 Cb 0.74 -1.72 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1j3d n LYS 41 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1j3d h LEU 42 N 0.00 -0.11 -1.96 -0.35 4.07 -0.13 -2.76 115.31 114.06 1j3d h LEU 42 Ca -0.23 -0.16 0.13 0.00 0.08 0.00 0.00 57.88 57.70 1j3d h LEU 42 Cb 1.67 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 43.43 1j3d h LEU 42 CO 0.04 0.44 0.47 1.23 -1.08 0.00 0.00 178.44 179.54 1j3d h GLY 43 N -1.01 0.00 1.10 0.83 0.00 -1.64 0.94 103.07 103.28 1j3d h GLY 43 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.12 1j3d h GLY 43 CO 0.02 0.00 -0.65 -2.09 0.00 0.00 0.00 176.54 173.82 1j3d h GLU 44 N 0.00 0.76 0.12 4.80 4.81 -1.62 -2.69 114.58 120.75 1j3d h GLU 44 Ca 0.21 -0.57 -0.27 0.00 -0.13 0.00 0.00 59.36 58.60 1j3d h GLU 44 Cb 1.14 0.11 0.03 0.00 0.63 0.00 0.00 28.75 30.66 1j3d h GLU 44 CO -0.00 1.19 -1.12 0.52 -0.73 0.00 0.00 179.01 178.87 1j3d h MET 45 N 0.48 0.54 -0.58 1.92 2.86 0.21 -3.25 114.93 117.11 1j3d h MET 45 Ca -0.03 -0.75 0.11 0.00 -2.06 0.00 0.00 59.70 56.98 1j3d h MET 45 Cb 1.27 0.25 -0.09 0.00 0.06 0.00 0.00 31.60 33.10 1j3d h MET 45 CO 0.14 1.33 0.09 2.35 1.06 0.00 0.00 176.91 181.88 1j3d h TRP 46 N 0.11 0.14 0.00 -0.22 -0.00 0.58 0.75 115.95 117.30 1j3d h TRP 46 Ca -0.17 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.75 1j3d h TRP 46 Cb 1.82 0.03 0.00 0.00 -0.00 0.00 0.00 29.16 31.01 1j3d h TRP 46 CO 0.13 -0.06 0.00 0.45 -0.00 0.00 0.00 178.44 178.97 1j3d n SER 47 N -5.16 0.00 -0.00 2.65 2.88 -1.02 -1.99 113.62 110.99 1j3d n SER 47 Ca 0.08 0.17 0.07 0.00 -1.33 0.00 0.00 58.87 57.87 1j3d n SER 47 Cb 0.31 -0.32 -0.10 0.00 -0.75 0.00 0.00 64.21 63.35 1j3d n SER 47 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1j3d n GLU 48 N -1.32 1.19 -1.85 -1.46 -0.58 0.24 -4.98 120.64 111.88 1j3d n GLU 48 Ca 0.05 -0.08 -0.40 0.00 -0.42 0.00 0.00 57.16 56.32 1j3d n GLU 48 Cb 0.10 -1.29 0.01 0.00 -0.57 0.00 0.00 31.44 29.69 1j3d n GLU 48 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1j3d s GLN 49 N -2.77 3.69 0.00 3.49 -1.52 -0.17 -5.01 119.66 117.36 1j3d s GLN 49 Ca -0.00 2.34 0.00 0.00 -1.95 0.00 0.00 55.36 55.75 1j3d s GLN 49 Cb 0.11 -2.63 0.00 0.00 -0.22 0.00 0.00 33.01 30.26 1j3d s GLN 49 CO 0.63 -0.79 0.00 -1.13 -0.25 0.00 0.00 175.29 173.75 1j3d n SER 50 N -0.22 0.00 -0.47 5.90 3.41 -1.26 -4.87 113.62 116.11 1j3d n SER 50 Ca 0.05 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.75 1j3d n SER 50 Cb 0.43 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.39 1j3d n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j3d n ALA 51 N -3.00 3.02 0.11 7.33 0.00 -1.26 -4.11 120.51 122.60 1j3d n ALA 51 Ca 0.00 -0.57 -0.23 0.00 0.00 0.00 0.00 53.44 52.63 1j3d n ALA 51 Cb 0.00 -0.59 -0.15 0.00 0.00 0.00 0.00 19.45 18.70 1j3d n ALA 51 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1j3d h LYS 52 N 2.29 0.46 -1.87 0.00 1.63 -2.01 -3.27 116.57 113.80 1j3d h LYS 52 Ca 0.00 -0.78 -0.57 0.00 -0.85 0.00 0.00 60.65 58.45 1j3d h LYS 52 Cb 0.62 0.29 -0.42 0.00 -0.60 0.00 0.00 32.23 32.12 1j3d h LYS 52 CO 0.00 1.37 -0.73 -0.25 -3.45 0.00 0.00 179.45 176.39 1j3d n ASP 53 N -3.84 4.28 0.00 4.20 8.00 -1.26 -4.71 116.55 123.23 1j3d n ASP 53 Ca -0.17 -3.63 0.00 0.00 0.71 0.00 0.00 54.79 51.70 1j3d n ASP 53 Cb 1.02 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 1j3d n ASP 53 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1j3d n LYS 54 N -0.32 0.00 0.00 -1.24 4.81 -1.26 -4.73 118.16 115.42 1j3d n LYS 54 Ca 0.33 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.66 1j3d n LYS 54 Cb 0.54 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.50 1j3d n LYS 54 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 1j3d h GLN 55 N 0.00 -0.11 0.00 1.64 1.08 -1.74 -2.31 115.11 113.67 1j3d h GLN 55 Ca 0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1j3d h GLN 55 Cb 0.00 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1j3d h GLN 55 CO 0.00 0.44 0.00 -0.35 -0.95 0.00 0.00 178.83 177.97 1j3d n PRO 56 N -4.82 0.03 -0.06 1.46 -0.04 -1.26 -1.06 135.00 129.24 1j3d n PRO 56 Ca -0.08 0.22 -0.14 0.00 -0.04 0.00 0.00 63.50 63.46 1j3d n PRO 56 Cb 0.30 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.11 1j3d n PRO 56 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1j3d n TYR 57 N -1.47 0.53 0.03 0.54 4.01 -1.22 -3.59 117.16 115.99 1j3d n TYR 57 Ca 0.04 0.15 -0.04 0.00 -0.16 0.00 0.00 57.90 57.89 1j3d n TYR 57 Cb 0.17 -1.08 -0.10 0.00 -0.31 0.00 0.00 39.34 38.02 1j3d n TYR 57 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 1j3d h GLU 58 N 0.02 0.00 -0.00 -0.72 4.11 -1.25 -3.15 114.58 113.59 1j3d h GLU 58 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1j3d h GLU 58 Cb 2.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.31 1j3d h GLU 58 CO 0.03 0.55 -0.06 1.04 0.07 0.00 0.00 179.01 180.64 1j3d n GLN 59 N -3.09 0.92 -0.03 1.06 1.13 -0.23 -1.53 117.38 115.61 1j3d n GLN 59 Ca -0.09 -0.29 0.04 0.00 -1.94 0.00 0.00 57.00 54.72 1j3d n GLN 59 Cb 0.93 -1.49 -0.13 0.00 0.11 0.00 0.00 30.24 29.65 1j3d n GLN 59 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1j3d n LYS 60 N -0.78 0.75 -0.08 -1.09 0.00 -1.23 -4.08 118.16 111.64 1j3d n LYS 60 Ca 0.18 -0.12 -0.09 0.00 0.00 0.00 0.00 58.31 58.28 1j3d n LYS 60 Cb 0.25 -1.41 -0.12 0.00 0.00 0.00 0.00 35.03 33.74 1j3d n LYS 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j3d n ALA 61 N -2.23 1.59 -0.00 3.14 0.00 -1.19 -3.94 120.51 117.88 1j3d n ALA 61 Ca -0.09 -1.06 -0.16 0.00 0.00 0.00 0.00 53.44 52.13 1j3d n ALA 61 Cb 0.60 -0.08 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 1j3d n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j3d h ALA 62 N 0.68 0.36 -0.00 0.00 0.00 -1.51 -1.41 119.26 117.37 1j3d h ALA 62 Ca -0.45 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1j3d h ALA 62 Cb 1.97 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.74 1j3d h ALA 62 CO 0.01 0.70 -0.11 1.17 0.00 0.00 0.00 179.25 181.02 1j3d n LYS 63 N -3.91 0.79 -0.01 0.00 3.00 -1.26 -3.55 118.16 113.23 1j3d n LYS 63 Ca -0.07 -0.30 0.07 0.00 -0.00 0.00 0.00 58.31 58.01 1j3d n LYS 63 Cb 0.75 -1.49 -0.11 0.00 0.00 0.00 0.00 35.03 34.18 1j3d n LYS 63 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1j3d n LEU 64 N -0.84 0.04 0.12 3.14 0.00 -1.17 -4.35 117.00 113.94 1j3d n LEU 64 Ca 0.15 -0.03 -0.23 0.00 0.00 0.00 0.00 56.01 55.90 1j3d n LEU 64 Cb 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 43.42 43.55 1j3d n LEU 64 CO 0.23 0.01 -0.32 0.50 0.00 0.00 0.00 177.39 177.82 1j3d h LYS 65 N 0.00 0.45 0.00 1.96 3.64 -1.32 -2.78 116.57 118.52 1j3d h LYS 65 Ca 0.00 -0.77 -0.06 0.00 -1.27 0.00 0.00 60.65 58.55 1j3d h LYS 65 Cb 0.64 0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1j3d h LYS 65 CO 0.00 1.36 -0.27 1.05 -2.27 0.00 0.00 179.45 179.32 1j3d h GLU 66 N 0.12 0.00 0.00 1.90 4.11 -1.80 -2.88 114.58 116.04 1j3d h GLU 66 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 1j3d h GLU 66 Cb 2.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.37 1j3d h GLU 66 CO 0.23 0.27 -1.09 1.17 0.07 0.00 0.00 179.01 179.66 1j3d n LYS 67 N -3.72 0.40 0.08 1.06 3.00 -1.25 -4.12 118.16 113.62 1j3d n LYS 67 Ca -0.01 0.01 -0.12 0.00 -0.00 0.00 0.00 58.31 58.19 1j3d n LYS 67 Cb 0.38 -1.65 -0.06 0.00 0.00 0.00 0.00 35.03 33.70 1j3d n LYS 67 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 1j3d h TYR 68 N 0.00 0.40 -0.71 5.64 5.03 -1.27 -2.05 116.97 124.01 1j3d h TYR 68 Ca 0.00 -0.24 0.00 0.00 2.58 0.00 0.00 58.73 61.07 1j3d h TYR 68 Cb 0.82 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 39.03 1j3d h TYR 68 CO 0.00 1.10 0.46 0.93 -1.32 0.00 0.00 178.16 179.33 1j3d h GLU 69 N 0.12 0.94 0.05 1.82 5.08 -1.69 0.11 114.58 121.02 1j3d h GLU 69 Ca -0.07 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 58.03 1j3d h GLU 69 Cb 1.66 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.69 1j3d h GLU 69 CO 0.16 0.63 -1.01 0.87 -1.00 0.00 0.00 179.01 178.66 1j3d h LYS 70 N 0.97 0.10 -0.21 2.33 1.57 -1.75 -3.20 116.57 116.38 1j3d h LYS 70 Ca 0.26 -0.18 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1j3d h LYS 70 Cb -0.10 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.21 1j3d h LYS 70 CO -0.05 1.08 -0.29 -0.44 -0.57 0.00 0.00 179.45 179.18 1j3d h ASP 71 N -0.71 -0.92 -0.25 0.86 5.19 -1.26 0.12 116.42 119.46 1j3d h ASP 71 Ca -0.24 0.15 0.07 0.00 -0.62 0.00 0.00 57.03 56.39 1j3d h ASP 71 Cb 1.42 0.41 -0.01 0.00 0.18 0.00 0.00 39.33 41.33 1j3d h ASP 71 CO -0.04 -0.32 0.18 0.40 -3.12 0.00 0.00 179.24 176.34 1j3d h ILE 72 N -0.32 0.85 -0.71 0.35 1.08 -0.93 -2.30 117.51 115.53 1j3d h ILE 72 Ca 0.12 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.70 1j3d h ILE 72 Cb 0.51 0.87 -0.08 0.00 -3.07 0.00 0.00 36.82 35.06 1j3d h ILE 72 CO -0.39 0.00 0.34 0.00 -0.69 0.00 0.00 178.15 177.40 1j3d h ALA 73 N 1.87 0.98 0.00 1.87 0.00 -0.74 0.85 119.26 124.09 1j3d h ALA 73 Ca 0.12 0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1j3d h ALA 73 Cb 0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1j3d h ALA 73 CO -0.00 -0.09 -0.89 0.00 0.00 0.00 0.00 179.25 178.27 1j3d h ALA 74 N 1.45 0.46 -0.01 0.00 0.00 -1.40 -3.22 119.26 116.55 1j3d h ALA 74 Ca 0.36 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1j3d h ALA 74 Cb 0.42 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1j3d h ALA 74 CO -0.30 1.11 -0.11 0.98 0.00 0.00 0.00 179.25 180.94 1j3d n TYR 75 N -3.38 0.00 -0.01 0.00 9.36 -0.65 -4.40 117.16 118.08 1j3d n TYR 75 Ca 0.00 0.00 -0.00 0.00 3.32 0.00 0.00 57.90 61.22 1j3d n TYR 75 Cb 0.88 -0.05 -0.00 0.00 -0.63 0.00 0.00 39.34 39.53 1j3d n TYR 75 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1j3d h ARG 76 N 1.86 -0.01 -4.07 2.98 2.43 0.68 -3.45 114.38 114.80 1j3d h ARG 76 Ca 0.00 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.57 1j3d h ARG 76 Cb 0.50 0.00 -0.39 0.00 -0.42 0.00 0.00 29.97 29.66 1j3d h ARG 76 CO 0.00 -0.01 -0.76 0.00 -1.51 0.00 0.00 179.97 177.70 1j3d s ALA 77 N -2.87 1.96 -2.87 2.80 0.00 -1.26 -5.11 121.76 114.41 1j3d s ALA 77 Ca -0.00 -1.73 0.25 0.00 0.00 0.00 0.00 51.96 50.48 1j3d s ALA 77 Cb 0.00 -1.62 0.41 0.00 0.00 0.00 0.00 23.12 21.91 1j3d s ALA 77 CO 0.00 -1.50 1.39 1.17 0.00 0.00 0.00 175.76 176.82