#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 0.84 -4.04 0.03 2.85 -1.26 -4.58 118.16 112.00 1j3d n LYS 2 Ca 0.00 0.34 -0.08 0.00 -1.05 0.00 0.00 58.31 57.53 1j3d n LYS 2 Cb 0.00 -2.40 -0.09 0.00 -0.65 0.00 0.00 35.03 31.88 1j3d n LYS 2 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1j3d s LYS 3 N -3.37 0.69 1.25 -1.58 -0.14 -1.26 -5.06 119.74 110.28 1j3d s LYS 3 Ca 0.79 -1.18 -0.15 0.00 -1.36 0.00 0.00 55.97 54.06 1j3d s LYS 3 Cb -0.37 0.24 0.32 0.00 -1.68 0.00 0.00 37.83 36.34 1j3d s LYS 3 CO 0.44 -0.16 0.99 -0.51 -0.76 0.00 0.00 175.35 175.35 1j3d s ASP 4 N -2.92 0.23 0.34 2.83 1.01 -1.26 -4.88 116.67 112.03 1j3d s ASP 4 Ca 0.08 1.36 0.15 0.00 0.71 0.00 0.00 52.55 54.85 1j3d s ASP 4 Cb 0.07 -2.08 0.60 0.00 1.01 0.00 0.00 42.92 42.52 1j3d s ASP 4 CO -0.09 -4.64 1.72 1.55 0.21 0.00 0.00 175.17 173.92 1j3d h PRO 5 N -2.92 0.00 0.00 8.23 0.13 -2.02 -2.97 132.00 132.44 1j3d h PRO 5 Ca -0.59 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.40 1j3d h PRO 5 Cb 1.34 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1j3d h PRO 5 CO 0.45 0.45 -0.79 -0.91 -0.23 0.00 0.00 178.00 176.98 1j3d h ASN 6 N 0.00 0.00 -4.19 1.44 2.35 -2.07 -3.46 115.58 109.65 1j3d h ASN 6 Ca -0.00 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 55.24 1j3d h ASN 6 Cb 0.90 0.00 0.05 0.00 0.05 0.00 0.00 38.32 39.32 1j3d h ASN 6 CO 0.06 0.64 0.35 0.00 -1.65 0.00 0.00 177.43 176.83 1j3d s ALA 7 N -2.89 3.16 -0.64 -0.83 0.00 -1.12 -4.99 121.76 114.44 1j3d s ALA 7 Ca 0.02 -0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.57 1j3d s ALA 7 Cb 0.08 -2.99 0.04 0.00 0.00 0.00 0.00 23.12 20.25 1j3d s ALA 7 CO 0.77 -0.57 1.17 -1.25 0.00 0.00 0.00 175.76 175.88 1j3d s PRO 8 N -4.97 3.33 0.98 0.00 0.04 -1.26 -4.71 135.00 128.40 1j3d s PRO 8 Ca 0.54 -0.11 -0.16 0.00 0.04 0.00 0.00 61.00 61.30 1j3d s PRO 8 Cb -0.11 -4.10 0.25 0.00 0.04 0.00 0.00 34.50 30.58 1j3d s PRO 8 CO 0.50 -1.84 0.78 1.63 0.04 0.00 0.00 177.00 178.10 1j3d n LYS 9 N 8.59 -3.10 -1.65 4.56 5.02 -1.26 -4.75 118.16 125.57 1j3d n LYS 9 Ca 0.04 -1.26 -0.39 0.00 -2.02 0.00 0.00 58.31 54.69 1j3d n LYS 9 Cb 0.48 -1.30 0.04 0.00 -0.02 0.00 0.00 35.03 34.24 1j3d n LYS 9 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1j3d n ARG 10 N -4.29 1.23 -1.62 1.97 1.74 -1.26 -4.97 116.66 109.45 1j3d n ARG 10 Ca 0.11 0.46 -0.29 0.00 -0.77 0.00 0.00 57.85 57.36 1j3d n ARG 10 Cb 0.45 -2.24 0.11 0.00 -1.02 0.00 0.00 32.46 29.75 1j3d n ARG 10 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1j3d s PRO 11 N -2.59 1.68 0.00 5.56 0.04 -1.26 -5.07 135.00 133.36 1j3d s PRO 11 Ca 0.71 0.38 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1j3d s PRO 11 Cb -0.45 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1j3d s PRO 11 CO 0.50 -1.84 0.00 -0.35 0.04 0.00 0.00 177.00 175.35 1j3d n PRO 12 N -3.54 0.82 -2.67 0.56 -0.04 -1.26 -5.01 135.00 123.86 1j3d n PRO 12 Ca 0.07 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.48 1j3d n PRO 12 Cb 0.58 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.07 1j3d n PRO 12 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1j3d n SER 13 N -0.27 -1.38 0.00 3.54 2.88 -1.26 -4.86 113.62 112.27 1j3d n SER 13 Ca 0.00 -1.90 0.00 0.00 -1.33 0.00 0.00 58.87 55.64 1j3d n SER 13 Cb 0.00 1.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.47 1j3d n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j3d n ALA 14 N -0.54 0.00 0.28 -1.46 0.00 -1.26 -4.08 120.51 113.45 1j3d n ALA 14 Ca -0.20 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.40 1j3d n ALA 14 Cb 0.71 0.00 0.93 0.00 0.00 0.00 0.00 19.45 21.09 1j3d n ALA 14 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1j3d h PHE 15 N 0.00 0.00 -0.06 0.00 3.57 -1.96 -1.17 116.94 117.32 1j3d h PHE 15 Ca 0.00 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.30 1j3d h PHE 15 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1j3d h PHE 15 CO 0.00 0.00 -0.79 0.35 -2.23 0.00 0.00 178.31 175.64 1j3d h PHE 16 N 0.00 0.58 0.00 0.41 3.04 -1.93 -2.64 116.94 116.40 1j3d h PHE 16 Ca 0.02 -0.27 0.00 0.00 3.98 0.00 0.00 57.97 61.70 1j3d h PHE 16 Cb 0.12 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.55 1j3d h PHE 16 CO 0.00 1.05 0.00 1.28 -2.02 0.00 0.00 178.31 178.62 1j3d n LEU 17 N -3.81 0.24 -0.27 0.59 7.99 -0.45 0.11 117.00 121.40 1j3d n LEU 17 Ca -0.05 0.57 -0.02 0.00 -0.01 0.00 0.00 56.01 56.51 1j3d n LEU 17 Cb 0.74 -0.13 0.01 0.00 -0.11 0.00 0.00 43.42 43.94 1j3d n LEU 17 CO 0.49 -0.13 0.39 0.33 -1.51 0.00 0.00 177.39 176.96 1j3d n PHE 18 N -0.88 -0.03 -0.14 -1.77 7.35 -1.17 0.72 117.46 121.55 1j3d n PHE 18 Ca 0.00 0.84 -0.09 0.00 -0.76 0.00 0.00 57.45 57.44 1j3d n PHE 18 Cb 0.00 -0.73 -0.01 0.00 0.35 0.00 0.00 39.48 39.09 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 0.50 0.28 0.74 0.00 0.02 0.44 0.29 113.55 115.82 1j3d h SER 20 Ca 0.13 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 1j3d h SER 20 Cb 0.26 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 1j3d h SER 20 CO -0.00 0.18 -1.36 -1.84 -1.14 0.00 0.00 176.83 172.66 1j3d n GLU 21 N -4.47 0.62 0.05 3.45 0.28 -0.31 -4.24 120.64 116.02 1j3d n GLU 21 Ca 0.07 0.22 -0.19 0.00 -0.16 0.00 0.00 57.16 57.10 1j3d n GLU 21 Cb 0.33 -1.81 -0.14 0.00 1.43 0.00 0.00 31.44 31.24 1j3d n GLU 21 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1j3d h HIS 22 N 0.00 0.49 -0.91 -1.84 3.86 -0.33 -3.38 115.15 113.04 1j3d h HIS 22 Ca -0.15 -0.36 0.18 0.00 -1.16 0.00 0.00 60.37 58.89 1j3d h HIS 22 Cb 1.52 -0.02 -0.17 0.00 1.06 0.00 0.00 27.41 29.80 1j3d h HIS 22 CO 0.00 1.50 -0.22 -0.09 0.86 0.00 0.00 177.93 179.98 1j3d h ARG 23 N 0.07 0.00 0.00 2.45 2.43 -0.63 1.01 114.38 119.72 1j3d h ARG 23 Ca -0.31 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 1j3d h ARG 23 Cb 2.04 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1j3d h ARG 23 CO 0.15 0.00 -0.12 -1.00 -1.51 0.00 0.00 179.97 177.48 1j3d h PRO 24 N 0.00 0.00 0.10 0.20 0.13 -1.79 -2.84 132.00 127.81 1j3d h PRO 24 Ca 0.44 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 65.29 1j3d h PRO 24 Cb 0.68 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.82 1j3d h PRO 24 CO -0.94 0.12 -1.19 -0.22 -0.23 0.00 0.00 178.00 175.54 1j3d h LYS 25 N 0.00 0.47 0.00 0.86 3.64 0.79 -3.13 116.57 119.20 1j3d h LYS 25 Ca -0.00 -0.65 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1j3d h LYS 25 Cb 0.54 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1j3d h LYS 25 CO 0.02 1.27 0.00 -0.89 -2.27 0.00 0.00 179.45 177.58 1j3d n ILE 26 N -3.71 0.95 0.18 2.00 2.08 -0.02 -2.30 119.36 118.55 1j3d n ILE 26 Ca -0.11 0.24 0.09 0.00 0.56 0.00 0.00 62.75 63.53 1j3d n ILE 26 Cb 0.97 -1.00 0.11 0.00 -0.75 0.00 0.00 39.64 38.97 1j3d n ILE 26 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1j3d h LYS 27 N 0.00 0.00 -0.01 0.38 1.57 -1.47 -2.80 116.57 114.24 1j3d h LYS 27 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1j3d h LYS 27 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1j3d h LYS 27 CO 0.00 0.15 -0.17 0.77 -0.57 0.00 0.00 179.45 179.62 1j3d h SER 28 N 0.00 0.18 -0.06 0.86 0.02 -1.58 -3.19 113.55 109.77 1j3d h SER 28 Ca -0.01 -0.72 0.00 0.00 -0.84 0.00 0.00 61.79 60.22 1j3d h SER 28 Cb 1.12 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1j3d h SER 28 CO 0.02 0.88 0.00 -0.62 -1.14 0.00 0.00 176.83 175.97 1j3d n GLU 29 N -4.58 1.32 -3.14 3.45 -0.58 -1.25 -4.41 120.64 111.45 1j3d n GLU 29 Ca -0.09 -0.48 -0.13 0.00 -0.42 0.00 0.00 57.16 56.04 1j3d n GLU 29 Cb 0.45 -1.36 -0.05 0.00 -0.57 0.00 0.00 31.44 29.91 1j3d n GLU 29 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1j3d s HIS 30 N -1.92 -0.54 -1.14 -0.32 3.76 -1.06 -5.06 115.29 109.02 1j3d s HIS 30 Ca 0.32 -1.02 -0.25 0.00 -0.15 0.00 0.00 55.06 53.96 1j3d s HIS 30 Cb 0.16 -0.21 -0.15 0.00 1.11 0.00 0.00 32.58 33.48 1j3d s HIS 30 CO 0.25 -1.06 2.02 -1.25 -0.85 0.00 0.00 174.74 173.85 1j3d s PRO 31 N 0.91 1.85 0.00 8.40 0.04 -1.22 -2.91 135.00 142.08 1j3d s PRO 31 Ca 0.26 -0.81 0.00 0.00 0.04 0.00 0.00 61.00 60.49 1j3d s PRO 31 Cb -0.04 -5.12 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1j3d s PRO 31 CO -0.08 -4.73 0.00 0.41 0.04 0.00 0.00 177.00 172.64 1j3d n GLY 32 N 5.98 0.38 3.74 0.56 0.00 -1.26 -5.15 105.19 109.43 1j3d n GLY 32 Ca 0.43 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1j3d n GLY 32 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1j3d s LEU 33 N 0.00 3.65 0.00 0.99 1.98 -1.15 -5.13 118.68 119.02 1j3d s LEU 33 Ca 0.00 -0.10 0.00 0.00 -2.89 0.00 0.00 54.13 51.14 1j3d s LEU 33 Cb 0.00 -2.34 0.00 0.00 0.66 0.00 0.00 46.19 44.51 1j3d s LEU 33 CO 0.00 0.16 0.00 -1.54 -1.89 0.00 0.00 176.35 173.08 1j3d n SER 34 N 0.41 0.53 -1.08 3.68 3.41 -1.26 -4.99 113.62 114.32 1j3d n SER 34 Ca -0.09 -0.40 0.05 0.00 -0.26 0.00 0.00 58.87 58.16 1j3d n SER 34 Cb 0.52 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.68 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 -0.30 1.17 -0.03 -1.33 2.08 -1.26 -3.82 119.36 115.87 1j3d n ILE 35 Ca 0.00 -0.69 -0.03 0.00 0.56 0.00 0.00 62.75 62.60 1j3d n ILE 35 Cb 0.00 -0.14 -0.01 0.00 -0.75 0.00 0.00 39.64 38.74 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 0.63 -0.55 0.11 7.39 0.00 -1.26 -3.68 105.19 107.83 1j3d n GLY 36 Ca 0.15 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.33 0.23 -0.69 1.61 3.32 -1.99 -1.11 116.42 117.46 1j3d h ASP 37 Ca 0.00 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 1j3d h ASP 37 Cb 0.29 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1j3d h ASP 37 CO 0.00 0.36 0.43 0.74 -1.72 0.00 0.00 179.24 179.05 1j3d h THR 38 N 0.08 1.19 -0.16 0.35 2.02 -1.83 -0.28 112.91 114.29 1j3d h THR 38 Ca 0.05 -0.41 -0.14 0.00 0.77 0.00 0.00 66.41 66.67 1j3d h THR 38 Cb 0.21 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1j3d h THR 38 CO -0.00 0.20 -0.51 0.00 0.37 0.00 0.00 175.52 175.58 1j3d h ALA 39 N 1.51 0.82 -0.06 6.16 0.00 -1.58 0.06 119.26 126.17 1j3d h ALA 39 Ca 0.25 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.51 1j3d h ALA 39 Cb -0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1j3d h ALA 39 CO -0.05 0.67 -0.66 0.87 0.00 0.00 0.00 179.25 180.08 1j3d h LYS 40 N 0.35 0.25 0.00 0.00 1.57 -0.51 -2.28 116.57 115.96 1j3d h LYS 40 Ca 0.01 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.55 1j3d h LYS 40 Cb 1.02 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1j3d h LYS 40 CO 0.09 0.83 -0.50 -0.22 -0.57 0.00 0.00 179.45 179.08 1j3d h LYS 41 N 0.18 0.00 0.00 3.15 3.64 -0.93 -3.22 116.57 119.39 1j3d h LYS 41 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1j3d h LYS 41 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1j3d h LYS 41 CO 0.10 0.16 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.26 1j3d h LEU 42 N 0.00 0.00 -1.98 5.20 4.07 -0.89 -3.03 115.31 118.68 1j3d h LEU 42 Ca -0.02 0.00 0.24 0.00 0.08 0.00 0.00 57.88 58.18 1j3d h LEU 42 Cb 1.16 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.87 1j3d h LEU 42 CO 0.02 0.44 0.60 1.23 -1.08 0.00 0.00 178.44 179.66 1j3d h GLY 43 N -0.77 0.04 1.45 0.83 0.00 -1.60 1.08 103.07 104.10 1j3d h GLY 43 Ca 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 47.33 47.16 1j3d h GLY 43 CO 0.00 -0.00 -0.55 -2.09 0.00 0.00 0.00 176.54 173.90 1j3d h GLU 44 N 0.02 0.57 0.19 4.80 4.57 -1.68 -2.68 114.58 120.37 1j3d h GLU 44 Ca 0.40 -0.36 -0.28 0.00 -1.18 0.00 0.00 59.36 57.94 1j3d h GLU 44 Cb 1.58 0.04 0.03 0.00 -0.16 0.00 0.00 28.75 30.24 1j3d h GLU 44 CO -0.01 0.97 -1.25 0.52 -1.18 0.00 0.00 179.01 178.06 1j3d h MET 45 N 0.44 0.41 -0.54 1.92 2.86 0.50 -3.29 114.93 117.23 1j3d h MET 45 Ca 0.01 -0.70 0.11 0.00 -2.06 0.00 0.00 59.70 57.05 1j3d h MET 45 Cb 1.09 0.26 -0.09 0.00 0.06 0.00 0.00 31.60 32.93 1j3d h MET 45 CO 0.10 1.34 0.01 2.35 1.06 0.00 0.00 176.91 181.77 1j3d h TRP 46 N -0.09 -0.01 0.00 -0.22 -0.00 0.80 0.78 115.95 117.20 1j3d h TRP 46 Ca -0.23 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.70 1j3d h TRP 46 Cb 1.93 0.09 0.00 0.00 -0.00 0.00 0.00 29.16 31.18 1j3d h TRP 46 CO 0.15 -0.12 0.00 0.45 -0.00 0.00 0.00 178.44 178.92 1j3d n SER 47 N -5.24 0.00 -0.00 2.65 2.88 -1.01 -1.77 113.62 111.13 1j3d n SER 47 Ca 0.07 0.45 0.07 0.00 -1.33 0.00 0.00 58.87 58.13 1j3d n SER 47 Cb 0.30 -0.47 -0.09 0.00 -0.75 0.00 0.00 64.21 63.20 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 -1.47 1.84 -1.84 -1.46 1.02 0.25 -4.99 120.64 113.99 1j3d n GLU 48 Ca 0.02 -0.03 -0.39 0.00 -0.02 0.00 0.00 57.16 56.74 1j3d n GLU 48 Cb 0.10 -1.21 0.02 0.00 -0.02 0.00 0.00 31.44 30.32 1j3d n GLU 48 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1j3d s GLN 49 N -2.51 3.52 0.00 3.49 -1.52 0.24 -5.02 119.66 117.86 1j3d s GLN 49 Ca 0.03 2.30 0.00 0.00 -1.95 0.00 0.00 55.36 55.74 1j3d s GLN 49 Cb 0.10 -2.51 0.00 0.00 -0.22 0.00 0.00 33.01 30.38 1j3d s GLN 49 CO 0.59 -0.91 0.00 -1.13 -0.25 0.00 0.00 175.29 173.59 1j3d n SER 50 N -0.47 0.00 0.00 5.90 3.41 -1.26 -4.85 113.62 116.35 1j3d n SER 50 Ca 0.07 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.81 1j3d n SER 50 Cb 0.43 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 65.04 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 2.31 0.04 7.33 0.00 -1.26 -3.27 120.51 122.66 1j3d n ALA 51 Ca 0.00 -0.12 -0.20 0.00 0.00 0.00 0.00 53.44 53.12 1j3d n ALA 51 Cb 0.00 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.89 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 0.00 0.38 -2.07 0.00 3.64 -2.01 -3.25 116.57 113.26 1j3d h LYS 52 Ca 0.00 -0.53 -0.59 0.00 -1.27 0.00 0.00 60.65 58.26 1j3d h LYS 52 Cb 0.28 0.18 -0.42 0.00 -0.41 0.00 0.00 32.23 31.86 1j3d h LYS 52 CO 0.00 1.22 -0.67 -0.25 -2.27 0.00 0.00 179.45 177.48 1j3d n ASP 53 N -4.11 4.55 0.00 4.20 9.92 -1.23 -4.68 116.55 125.20 1j3d n ASP 53 Ca -0.13 -3.70 0.00 0.00 -0.53 0.00 0.00 54.79 50.44 1j3d n ASP 53 Cb 0.80 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 1j3d n ASP 53 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1j3d n LYS 54 N -0.32 0.00 -0.03 -1.24 4.81 -1.20 -4.64 118.16 115.54 1j3d n LYS 54 Ca 0.33 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.65 1j3d n LYS 54 Cb 0.47 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.41 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 -0.04 0.00 1.64 1.08 -1.73 -3.00 115.11 113.06 1j3d h GLN 55 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1j3d h GLN 55 Cb 0.00 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1j3d h GLN 55 CO 0.00 0.66 0.00 -0.35 -0.95 0.00 0.00 178.83 178.19 1j3d n PRO 56 N -4.74 0.01 0.00 1.46 -0.04 -1.26 -2.97 135.00 127.45 1j3d n PRO 56 Ca -0.09 0.18 -0.14 0.00 -0.04 0.00 0.00 63.50 63.41 1j3d n PRO 56 Cb 0.35 -1.51 -0.14 0.00 -0.04 0.00 0.00 33.50 32.16 1j3d n PRO 56 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1j3d h TYR 57 N 0.00 0.23 0.00 0.54 0.05 -1.92 -3.24 116.97 112.63 1j3d h TYR 57 Ca 0.00 -0.17 -0.06 0.00 0.05 0.00 0.00 58.73 58.56 1j3d h TYR 57 Cb 0.33 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1j3d h TYR 57 CO 0.00 1.31 -0.28 1.05 -1.05 0.00 0.00 178.16 179.19 1j3d h GLU 58 N 0.03 0.00 -0.00 4.88 4.11 -1.45 -2.94 114.58 119.21 1j3d h GLU 58 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1j3d h GLU 58 Cb 2.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.26 1j3d h GLU 58 CO 0.10 0.28 -0.27 1.04 0.07 0.00 0.00 179.01 180.23 1j3d n GLN 59 N -3.21 0.43 -0.08 1.06 6.02 -1.16 -1.78 117.38 118.66 1j3d n GLN 59 Ca 0.02 -0.21 -0.10 0.00 -0.01 0.00 0.00 57.00 56.70 1j3d n GLN 59 Cb 0.60 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 30.21 1j3d n GLN 59 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1j3d n LYS 60 N -1.10 0.68 -0.03 -1.09 4.81 -1.16 -3.85 118.16 116.42 1j3d n LYS 60 Ca 0.10 0.06 -0.12 0.00 -0.87 0.00 0.00 58.31 57.49 1j3d n LYS 60 Cb 0.32 -1.58 -0.14 0.00 0.02 0.00 0.00 35.03 33.65 1j3d n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j3d n ALA 61 N -2.72 1.37 -0.13 3.14 0.00 -1.12 -3.56 120.51 117.49 1j3d n ALA 61 Ca -0.30 -0.81 -0.11 0.00 0.00 0.00 0.00 53.44 52.23 1j3d n ALA 61 Cb 1.13 -0.72 -0.02 0.00 0.00 0.00 0.00 19.45 19.84 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 0.79 0.51 0.00 0.00 0.00 -1.55 -0.40 119.26 118.60 1j3d h ALA 62 Ca -0.35 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1j3d h ALA 62 Cb 2.04 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.70 1j3d h ALA 62 CO 0.07 0.33 0.00 1.17 0.00 0.00 0.00 179.25 180.82 1j3d n LYS 63 N -4.42 0.21 -0.06 0.00 4.81 -1.25 -3.28 118.16 114.17 1j3d n LYS 63 Ca -0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.37 1j3d n LYS 63 Cb 0.32 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 33.72 1j3d n LYS 63 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1j3d n LEU 64 N -1.39 0.24 -0.03 3.14 4.77 -1.03 -4.05 117.00 118.64 1j3d n LEU 64 Ca 0.11 0.11 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 1j3d n LEU 64 Cb 0.29 0.33 -0.10 0.00 -2.33 0.00 0.00 43.42 41.61 1j3d n LEU 64 CO 0.25 0.38 0.55 0.50 -1.33 0.00 0.00 177.39 177.74 1j3d h LYS 65 N 0.00 0.12 -0.18 3.23 3.64 -1.08 0.12 116.57 122.43 1j3d h LYS 65 Ca -0.39 -0.09 0.05 0.00 -1.27 0.00 0.00 60.65 58.96 1j3d h LYS 65 Cb 1.97 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.80 1j3d h LYS 65 CO 0.04 0.69 0.15 0.93 -2.27 0.00 0.00 179.45 178.99 1j3d h GLU 66 N -0.42 0.00 0.00 1.90 5.08 -1.76 -1.42 114.58 117.96 1j3d h GLU 66 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.13 1j3d h GLU 66 Cb 0.69 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 1j3d h GLU 66 CO 0.02 0.00 -1.66 1.17 -1.00 0.00 0.00 179.01 177.54 1j3d n LYS 67 N -4.22 0.63 0.33 2.33 3.00 -1.18 -4.08 118.16 114.97 1j3d n LYS 67 Ca 0.01 0.20 -0.15 0.00 -0.00 0.00 0.00 58.31 58.37 1j3d n LYS 67 Cb 0.28 -1.75 -0.08 0.00 0.00 0.00 0.00 35.03 33.49 1j3d n LYS 67 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 1j3d h TYR 68 N 0.00 -0.79 -1.05 5.64 -1.99 0.34 0.59 116.97 119.71 1j3d h TYR 68 Ca -0.24 -0.02 0.29 0.00 2.00 0.00 0.00 58.73 60.76 1j3d h TYR 68 Cb 1.78 0.26 -0.12 0.00 2.00 0.00 0.00 36.73 40.65 1j3d h TYR 68 CO 0.00 -0.45 0.64 0.93 -0.00 0.00 0.00 178.16 179.28 1j3d h GLU 69 N -1.11 0.40 -0.22 4.88 5.08 -1.64 1.26 114.58 123.22 1j3d h GLU 69 Ca -0.09 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.10 1j3d h GLU 69 Cb 0.69 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1j3d h GLU 69 CO 0.14 0.26 -0.45 0.87 -1.00 0.00 0.00 179.01 178.83 1j3d h LYS 70 N 0.41 0.70 0.41 2.33 1.57 -1.68 -0.34 116.57 119.97 1j3d h LYS 70 Ca 0.67 -0.46 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1j3d h LYS 70 Cb 1.57 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.94 1j3d h LYS 70 CO -0.43 1.08 -0.20 -0.44 -0.57 0.00 0.00 179.45 178.89 1j3d h ASP 71 N 0.42 -0.46 -0.92 0.86 3.32 0.31 -2.09 116.42 117.86 1j3d h ASP 71 Ca 0.01 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.08 1j3d h ASP 71 Cb 1.06 0.12 -0.06 0.00 0.22 0.00 0.00 39.33 40.67 1j3d h ASP 71 CO 0.10 -0.27 0.60 0.40 -1.72 0.00 0.00 179.24 178.35 1j3d h ILE 72 N -0.63 1.12 -0.73 0.35 5.03 0.11 0.90 117.51 123.66 1j3d h ILE 72 Ca -0.06 -0.38 0.04 0.00 -0.12 0.00 0.00 64.86 64.35 1j3d h ILE 72 Cb 0.47 -0.08 -0.05 0.00 -3.03 0.00 0.00 36.82 34.12 1j3d h ILE 72 CO 0.09 0.20 0.44 0.00 -0.68 0.00 0.00 178.15 178.21 1j3d h ALA 73 N 1.48 0.97 0.10 1.87 0.00 -0.75 0.78 119.26 123.72 1j3d h ALA 73 Ca 0.38 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 55.00 1j3d h ALA 73 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1j3d h ALA 73 CO -0.13 0.19 -1.36 0.00 0.00 0.00 0.00 179.25 177.95 1j3d h ALA 74 N 1.33 0.23 0.00 0.00 0.00 -0.63 -3.26 119.26 116.93 1j3d h ALA 74 Ca 0.31 -1.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.13 1j3d h ALA 74 Cb 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1j3d h ALA 74 CO -0.14 1.11 -0.35 -0.92 0.00 0.00 0.00 179.25 178.95 1j3d h TYR 75 N 0.06 0.00 -0.00 0.00 5.03 0.13 -2.62 116.97 119.57 1j3d h TYR 75 Ca -0.17 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.14 1j3d h TYR 75 Cb 1.97 0.00 0.00 0.00 1.55 0.00 0.00 36.73 40.25 1j3d h TYR 75 CO 0.05 0.35 -0.08 -2.13 -1.32 0.00 0.00 178.16 175.04 1j3d n ARG 76 N -3.66 0.20 -3.84 1.82 0.63 0.27 -4.45 116.66 107.62 1j3d n ARG 76 Ca -0.01 -0.03 -0.32 0.00 -0.92 0.00 0.00 57.85 56.57 1j3d n ARG 76 Cb 0.46 -1.50 -0.12 0.00 0.45 0.00 0.00 32.46 31.75 1j3d n ARG 76 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1j3d s ALA 77 N -2.82 3.55 0.00 5.13 0.00 -0.99 -5.08 121.76 121.55 1j3d s ALA 77 Ca 0.19 -3.41 0.00 0.00 0.00 0.00 0.00 51.96 48.74 1j3d s ALA 77 Cb 0.19 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.94 1j3d s ALA 77 CO 0.53 -2.07 0.32 1.63 0.00 0.00 0.00 175.76 176.16