#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3d s LYS 2 N 0.00 4.04 0.06 2.12 1.02 -1.26 -5.02 119.74 120.70 1j3d s LYS 2 Ca 0.00 1.32 0.01 0.00 0.02 0.00 0.00 55.97 57.32 1j3d s LYS 2 Cb 0.00 -3.81 -0.04 0.00 -0.52 0.00 0.00 37.83 33.46 1j3d s LYS 2 CO 0.00 -0.96 0.15 0.15 -0.92 0.00 0.00 175.35 173.77 1j3d s LYS 3 N 3.87 3.20 0.52 1.68 3.01 -1.26 -5.12 119.74 125.64 1j3d s LYS 3 Ca 0.53 -0.54 0.04 0.00 -1.01 0.00 0.00 55.97 55.00 1j3d s LYS 3 Cb -0.17 -2.91 0.04 0.00 -1.01 0.00 0.00 37.83 33.78 1j3d s LYS 3 CO 0.19 0.60 0.72 -0.51 0.51 0.00 0.00 175.35 176.86 1j3d s ASP 4 N -2.39 5.32 0.25 2.83 1.11 -1.26 -5.01 116.67 117.53 1j3d s ASP 4 Ca 0.32 -0.25 0.07 0.00 0.18 0.00 0.00 52.55 52.87 1j3d s ASP 4 Cb -0.13 -0.64 0.31 0.00 1.07 0.00 0.00 42.92 43.53 1j3d s ASP 4 CO 0.24 -1.08 1.59 1.55 1.18 0.00 0.00 175.17 178.65 1j3d h PRO 5 N 0.23 0.15 -0.12 8.23 0.13 -1.99 -3.08 132.00 135.55 1j3d h PRO 5 Ca -0.40 -0.10 -0.16 0.00 -0.87 0.00 0.00 66.00 64.47 1j3d h PRO 5 Cb 1.29 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1j3d h PRO 5 CO 0.48 0.70 -0.60 -0.91 -0.23 0.00 0.00 178.00 177.44 1j3d h ASN 6 N 0.11 0.45 -3.21 1.44 4.21 -2.06 -3.44 115.58 113.09 1j3d h ASN 6 Ca -0.01 -0.26 -0.50 0.00 1.21 0.00 0.00 56.30 56.75 1j3d h ASN 6 Cb 1.08 -0.13 0.01 0.00 -1.12 0.00 0.00 38.32 38.16 1j3d h ASN 6 CO 0.09 0.95 -0.08 0.00 -1.29 0.00 0.00 177.43 177.10 1j3d s ALA 7 N -3.85 3.57 0.81 -0.83 0.00 -1.17 -5.09 121.76 115.21 1j3d s ALA 7 Ca -0.06 -0.62 -0.11 0.00 0.00 0.00 0.00 51.96 51.18 1j3d s ALA 7 Cb 0.11 -2.34 0.10 0.00 0.00 0.00 0.00 23.12 21.00 1j3d s ALA 7 CO 0.82 0.01 1.16 -1.25 0.00 0.00 0.00 175.76 176.50 1j3d s PRO 8 N -4.06 1.71 0.48 0.00 0.04 -1.26 -4.53 135.00 127.38 1j3d s PRO 8 Ca 0.44 -0.18 0.04 0.00 0.04 0.00 0.00 61.00 61.33 1j3d s PRO 8 Cb -0.10 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1j3d s PRO 8 CO 0.35 -1.68 0.08 0.15 0.04 0.00 0.00 177.00 175.94 1j3d s LYS 9 N -5.53 2.16 0.13 4.56 1.02 -1.26 -4.82 119.74 116.00 1j3d s LYS 9 Ca 0.64 -2.23 -0.35 0.00 0.02 0.00 0.00 55.97 54.06 1j3d s LYS 9 Cb -0.09 -1.68 -0.14 0.00 -0.52 0.00 0.00 37.83 35.40 1j3d s LYS 9 CO 0.48 -0.31 1.54 2.89 -0.92 0.00 0.00 175.35 179.04 1j3d n ARG 10 N -1.27 1.94 -1.40 1.68 -4.01 -1.26 -4.96 116.66 107.39 1j3d n ARG 10 Ca -0.12 0.70 -0.29 0.00 -1.04 0.00 0.00 57.85 57.10 1j3d n ARG 10 Cb 0.66 -2.44 0.18 0.00 -3.04 0.00 0.00 32.46 27.82 1j3d n ARG 10 CO 0.00 0.00 0.00 -1.25 -3.04 0.00 0.00 177.63 173.34 1j3d s PRO 11 N 0.94 0.29 0.00 2.89 0.04 -1.26 -5.06 135.00 132.84 1j3d s PRO 11 Ca 0.80 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.98 1j3d s PRO 11 Cb -0.74 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.05 1j3d s PRO 11 CO 0.40 -2.75 0.00 -0.35 0.04 0.00 0.00 177.00 174.35 1j3d n PRO 12 N -4.12 0.21 -2.67 0.56 -0.04 -1.26 -4.98 135.00 122.70 1j3d n PRO 12 Ca 0.09 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.51 1j3d n PRO 12 Cb 0.59 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.06 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 -1.17 -1.27 0.00 3.54 2.88 -1.26 -4.77 113.62 111.56 1j3d n SER 13 Ca 0.00 -1.80 0.00 0.00 -1.33 0.00 0.00 58.87 55.74 1j3d n SER 13 Cb 0.00 1.02 0.00 0.00 -0.75 0.00 0.00 64.21 64.48 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 -0.48 0.00 0.30 -1.46 0.00 -1.26 -4.15 120.51 113.45 1j3d n ALA 14 Ca -0.23 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.39 1j3d n ALA 14 Cb 0.68 0.00 0.96 0.00 0.00 0.00 0.00 19.45 21.10 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 -0.01 0.00 3.57 -1.95 -1.75 116.94 116.79 1j3d h PHE 15 Ca 0.00 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.33 1j3d h PHE 15 Cb 0.00 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1j3d h PHE 15 CO 0.00 0.03 -0.77 0.35 -2.23 0.00 0.00 178.31 175.68 1j3d h PHE 16 N 0.00 0.17 0.00 0.41 3.04 -1.93 -2.82 116.94 115.82 1j3d h PHE 16 Ca -0.00 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 61.86 1j3d h PHE 16 Cb 0.10 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.59 1j3d h PHE 16 CO 0.00 0.84 0.00 1.28 -2.02 0.00 0.00 178.31 178.41 1j3d n LEU 17 N -3.70 0.25 -0.29 0.59 7.99 -0.66 -0.42 117.00 120.76 1j3d n LEU 17 Ca -0.02 0.71 -0.02 0.00 -0.01 0.00 0.00 56.01 56.67 1j3d n LEU 17 Cb 0.74 -0.37 0.01 0.00 -0.11 0.00 0.00 43.42 43.70 1j3d n LEU 17 CO 0.45 -0.37 0.42 0.33 -1.51 0.00 0.00 177.39 176.72 1j3d n PHE 18 N -1.60 -0.03 -0.17 -1.77 7.35 -1.18 0.63 117.46 120.69 1j3d n PHE 18 Ca 0.00 0.92 -0.10 0.00 -0.76 0.00 0.00 57.45 57.51 1j3d n PHE 18 Cb 0.00 -0.75 0.00 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 0.75 0.00 0.46 0.00 0.87 0.30 0.21 113.55 116.14 1j3d h SER 20 Ca 0.14 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.59 1j3d h SER 20 Cb 0.53 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1j3d h SER 20 CO 0.03 0.00 -1.64 -1.84 -0.53 0.00 0.00 176.83 172.85 1j3d n GLU 21 N -4.20 0.64 0.02 2.24 0.28 -0.63 -4.35 120.64 114.64 1j3d n GLU 21 Ca 0.05 0.04 -0.18 0.00 -0.16 0.00 0.00 57.16 56.91 1j3d n GLU 21 Cb 0.43 -1.69 -0.14 0.00 1.43 0.00 0.00 31.44 31.47 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 0.43 -0.91 -1.84 3.86 -0.68 -3.38 115.15 112.63 1j3d h HIS 22 Ca -0.14 -0.31 0.18 0.00 -1.16 0.00 0.00 60.37 58.94 1j3d h HIS 22 Cb 1.38 -0.02 -0.17 0.00 1.06 0.00 0.00 27.41 29.66 1j3d h HIS 22 CO 0.00 1.54 -0.23 -0.09 0.86 0.00 0.00 177.93 180.01 1j3d h ARG 23 N 0.06 -0.00 0.00 2.45 2.43 -0.82 0.96 114.38 119.47 1j3d h ARG 23 Ca -0.35 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.80 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 0.12 -0.00 -0.12 -1.00 -1.51 0.00 0.00 179.97 177.46 1j3d h PRO 24 N -0.00 0.00 0.20 0.20 0.13 -1.80 -2.87 132.00 127.86 1j3d h PRO 24 Ca 0.43 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 65.25 1j3d h PRO 24 Cb 0.66 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 -1.40 -0.22 -0.23 0.00 0.00 178.00 175.33 1j3d h LYS 25 N 0.00 0.42 0.00 0.86 3.64 0.64 -3.22 116.57 118.91 1j3d h LYS 25 Ca -0.00 -0.72 0.00 0.00 -1.27 0.00 0.00 60.65 58.66 1j3d h LYS 25 Cb 0.56 0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 1j3d h LYS 25 CO 0.02 1.34 0.00 -0.89 -2.27 0.00 0.00 179.45 177.64 1j3d n ILE 26 N -3.63 0.82 0.26 2.00 2.08 0.42 -2.53 119.36 118.79 1j3d n ILE 26 Ca -0.14 0.19 0.13 0.00 0.56 0.00 0.00 62.75 63.49 1j3d n ILE 26 Cb 1.07 -1.08 0.32 0.00 -0.75 0.00 0.00 39.64 39.20 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 -0.02 0.38 1.57 -1.52 -2.38 116.57 114.60 1j3d h LYS 27 Ca 0.00 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 1j3d h LYS 27 Cb 0.38 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.70 1j3d h LYS 27 CO 0.00 0.00 -0.80 1.03 -0.57 0.00 0.00 179.45 179.11 1j3d h SER 28 N 0.00 0.74 -0.19 0.86 0.87 -1.63 -3.25 113.55 110.94 1j3d h SER 28 Ca 0.00 -0.73 0.00 0.00 -1.23 0.00 0.00 61.79 59.83 1j3d h SER 28 Cb 0.85 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1j3d h SER 28 CO 0.00 1.37 0.00 -0.62 -0.53 0.00 0.00 176.83 177.05 1j3d n GLU 29 N -4.04 2.01 -3.17 2.24 -0.58 -1.23 -4.61 120.64 111.26 1j3d n GLU 29 Ca -0.10 -1.51 -0.17 0.00 -0.42 0.00 0.00 57.16 54.96 1j3d n GLU 29 Cb 0.76 -1.45 -0.06 0.00 -0.57 0.00 0.00 31.44 30.13 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 -1.77 -0.13 -0.36 -0.32 3.76 -0.90 -5.09 115.29 110.48 1j3d s HIS 30 Ca 0.34 -1.42 -0.28 0.00 -0.15 0.00 0.00 55.06 53.56 1j3d s HIS 30 Cb 0.20 -0.38 -0.02 0.00 1.11 0.00 0.00 32.58 33.48 1j3d s HIS 30 CO 0.29 -1.01 1.83 -1.25 -0.85 0.00 0.00 174.74 173.75 1j3d s PRO 31 N 0.62 3.21 0.00 8.40 0.04 -1.25 -1.82 135.00 144.21 1j3d s PRO 31 Ca 0.29 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1j3d s PRO 31 Cb -0.01 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.29 1j3d s PRO 31 CO -0.11 -2.01 0.00 0.41 0.04 0.00 0.00 177.00 175.33 1j3d n GLY 32 N 5.48 2.41 3.57 0.56 0.00 -1.26 -5.07 105.19 110.87 1j3d n GLY 32 Ca 0.23 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.68 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 0.85 0.00 0.99 -0.00 -0.76 -4.97 117.00 113.11 1j3d n LEU 33 Ca 0.00 1.14 0.00 0.00 -0.00 0.00 0.00 56.01 57.15 1j3d n LEU 33 Cb 0.00 -1.03 0.00 0.00 -0.00 0.00 0.00 43.42 42.39 1j3d n LEU 33 CO 0.00 -1.41 0.00 -1.54 -0.00 0.00 0.00 177.39 174.44 1j3d n SER 34 N 2.34 0.50 -0.02 1.96 3.41 -1.26 -4.98 113.62 115.58 1j3d n SER 34 Ca 0.21 -0.89 0.15 0.00 -0.26 0.00 0.00 58.87 58.09 1j3d n SER 34 Cb 0.11 0.00 0.85 0.00 -0.26 0.00 0.00 64.21 64.91 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 -0.66 0.00 -0.03 -1.33 2.08 -1.26 -3.12 119.36 115.04 1j3d n ILE 35 Ca 0.00 -0.01 0.05 0.00 0.56 0.00 0.00 62.75 63.35 1j3d n ILE 35 Cb 0.00 -0.46 0.24 0.00 -0.75 0.00 0.00 39.64 38.68 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 1.12 2.15 2.04 7.39 0.00 -1.26 -3.72 105.19 112.92 1j3d n GLY 36 Ca 0.20 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1j3d n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j3d n ASP 37 N 0.49 -0.84 -0.15 1.61 8.00 -1.21 -4.81 116.55 119.64 1j3d n ASP 37 Ca 0.17 0.32 -0.03 0.00 0.71 0.00 0.00 54.79 55.96 1j3d n ASP 37 Cb 0.74 0.94 0.17 0.00 -0.02 0.00 0.00 41.12 42.96 1j3d n ASP 37 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1j3d h THR 38 N 0.00 1.23 -0.24 -3.53 2.02 -1.77 -1.05 112.91 109.57 1j3d h THR 38 Ca 0.00 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.32 1j3d h THR 38 Cb 0.00 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1j3d h THR 38 CO 0.00 0.31 -0.02 0.00 0.37 0.00 0.00 175.52 176.18 1j3d h ALA 39 N 1.31 1.54 0.02 6.16 0.00 -1.79 0.26 119.26 126.75 1j3d h ALA 39 Ca 0.19 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 1j3d h ALA 39 Cb 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1j3d h ALA 39 CO -0.00 0.34 -0.95 0.87 0.00 0.00 0.00 179.25 179.51 1j3d h LYS 40 N 0.34 0.07 0.00 0.00 1.57 -1.60 -2.44 116.57 114.51 1j3d h LYS 40 Ca 0.08 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1j3d h LYS 40 Cb 0.26 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1j3d h LYS 40 CO 0.01 0.96 -0.41 -0.22 -0.57 0.00 0.00 179.45 179.22 1j3d h LYS 41 N 0.03 0.00 0.00 3.15 3.64 -0.52 -3.28 116.57 119.59 1j3d h LYS 41 Ca -0.03 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1j3d h LYS 41 Cb 1.64 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 1j3d h LYS 41 CO 0.13 0.00 -0.66 -0.07 -2.27 0.00 0.00 179.45 176.58 1j3d h LEU 42 N 0.00 0.00 -1.93 5.20 4.07 -0.52 -3.24 115.31 118.89 1j3d h LEU 42 Ca 0.00 -0.22 0.19 0.00 0.08 0.00 0.00 57.88 57.93 1j3d h LEU 42 Cb 0.93 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.64 1j3d h LEU 42 CO 0.00 0.98 0.58 1.23 -1.08 0.00 0.00 178.44 180.14 1j3d h GLY 43 N -1.00 0.00 1.30 0.83 0.00 -1.61 1.03 103.07 103.62 1j3d h GLY 43 Ca -0.11 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.02 1j3d h GLY 43 CO -0.07 0.00 -0.68 -2.09 0.00 0.00 0.00 176.54 173.70 1j3d h GLU 44 N 0.00 0.70 0.21 4.80 4.81 -1.70 -2.79 114.58 120.62 1j3d h GLU 44 Ca 0.31 -0.52 -0.28 0.00 -0.13 0.00 0.00 59.36 58.74 1j3d h GLU 44 Cb 1.46 0.09 0.03 0.00 0.63 0.00 0.00 28.75 30.96 1j3d h GLU 44 CO -0.00 1.14 -1.22 0.52 -0.73 0.00 0.00 179.01 178.72 1j3d h MET 45 N 0.51 0.46 -0.64 1.92 2.86 0.41 -3.29 114.93 117.16 1j3d h MET 45 Ca -0.02 -0.77 0.13 0.00 -2.06 0.00 0.00 59.70 56.97 1j3d h MET 45 Cb 1.28 0.29 -0.09 0.00 0.06 0.00 0.00 31.60 33.14 1j3d h MET 45 CO 0.14 1.37 0.14 2.35 1.06 0.00 0.00 176.91 181.97 1j3d h TRP 46 N -0.04 0.22 0.00 -0.22 -0.00 0.66 0.87 115.95 117.44 1j3d h TRP 46 Ca -0.21 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.72 1j3d h TRP 46 Cb 1.96 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 31.12 1j3d h TRP 46 CO 0.15 -0.05 0.00 0.45 -0.00 0.00 0.00 178.44 179.00 1j3d n SER 47 N -5.14 0.00 -0.00 2.65 2.88 -1.05 -2.02 113.62 110.94 1j3d n SER 47 Ca 0.10 0.20 0.06 0.00 -1.33 0.00 0.00 58.87 57.90 1j3d n SER 47 Cb 0.36 -0.33 -0.08 0.00 -0.75 0.00 0.00 64.21 63.41 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 -1.33 2.22 -1.83 -1.46 -0.58 0.28 -5.00 120.64 112.95 1j3d n GLU 48 Ca 0.05 -0.03 -0.39 0.00 -0.42 0.00 0.00 57.16 56.37 1j3d n GLU 48 Cb 0.10 -1.13 0.03 0.00 -0.57 0.00 0.00 31.44 29.87 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 -2.35 3.38 0.00 3.49 -1.52 -0.01 -5.02 119.66 117.63 1j3d s GLN 49 Ca 0.02 2.26 0.00 0.00 -1.95 0.00 0.00 55.36 55.69 1j3d s GLN 49 Cb 0.09 -2.41 0.00 0.00 -0.22 0.00 0.00 33.01 30.46 1j3d s GLN 49 CO 0.50 -1.00 0.00 -1.13 -0.25 0.00 0.00 175.29 173.40 1j3d n SER 50 N -0.68 0.00 0.00 5.90 3.41 -1.26 -4.85 113.62 116.13 1j3d n SER 50 Ca 0.08 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.84 1j3d n SER 50 Cb 0.44 0.00 0.82 0.00 -0.26 0.00 0.00 64.21 65.21 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 2.53 0.06 7.33 0.00 -1.26 -3.33 120.51 122.84 1j3d n ALA 51 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.06 1j3d n ALA 51 Cb 0.00 -1.48 -0.15 0.00 0.00 0.00 0.00 19.45 17.82 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 0.35 -1.90 0.00 3.64 -2.01 -3.28 116.57 113.37 1j3d h LYS 52 Ca 0.00 -0.60 -0.60 0.00 -1.27 0.00 0.00 60.65 58.18 1j3d h LYS 52 Cb 0.14 0.22 -0.42 0.00 -0.41 0.00 0.00 32.23 31.77 1j3d h LYS 52 CO 0.00 1.29 -0.63 -0.25 -2.27 0.00 0.00 179.45 177.59 1j3d n ASP 53 N -3.87 4.70 0.00 4.20 9.92 -1.23 -4.67 116.55 125.60 1j3d n ASP 53 Ca -0.20 -3.71 0.00 0.00 -0.53 0.00 0.00 54.79 50.35 1j3d n ASP 53 Cb 0.96 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 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 -0.37 0.00 0.09 -1.24 4.81 -1.21 -4.66 118.16 115.59 1j3d n LYS 54 Ca 0.36 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.69 1j3d n LYS 54 Cb 0.52 0.00 -0.07 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 -0.29 0.00 1.64 1.08 -1.74 -2.89 115.11 112.91 1j3d h GLN 55 Ca 0.00 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1j3d h GLN 55 Cb 0.00 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1j3d h GLN 55 CO 0.00 0.07 0.00 -0.35 -0.95 0.00 0.00 178.83 177.60 1j3d n PRO 56 N -4.99 0.01 0.05 1.46 -0.04 -1.26 -3.09 135.00 127.14 1j3d n PRO 56 Ca -0.08 0.21 -0.21 0.00 -0.04 0.00 0.00 63.50 63.38 1j3d n PRO 56 Cb 0.25 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.07 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 0.57 0.00 0.54 -1.99 -1.90 -3.18 116.97 111.02 1j3d h TYR 57 Ca 0.00 -0.42 0.00 0.00 2.00 0.00 0.00 58.73 60.31 1j3d h TYR 57 Cb 0.28 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.99 1j3d h TYR 57 CO 0.00 1.47 0.00 1.05 -0.00 0.00 0.00 178.16 180.68 1j3d h GLU 58 N -0.25 0.00 0.05 4.88 4.11 -1.44 -3.13 114.58 118.80 1j3d h GLU 58 Ca -0.24 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.19 1j3d h GLU 58 Cb 1.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.04 1j3d h GLU 58 CO 0.13 0.00 -0.02 1.96 0.07 0.00 0.00 179.01 181.15 1j3d h GLN 59 N 0.00 -0.06 -1.04 1.06 4.20 -1.63 -1.25 115.11 116.39 1j3d h GLN 59 Ca 0.00 0.00 0.30 0.00 0.06 0.00 0.00 58.65 59.02 1j3d h GLN 59 Cb 0.60 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1j3d h GLN 59 CO 0.00 -0.04 0.94 -0.22 -0.67 0.00 0.00 178.83 178.84 1j3d h LYS 60 N -0.32 0.00 0.12 1.46 3.64 -1.65 0.62 116.57 120.44 1j3d h LYS 60 Ca -0.01 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.04 1j3d h LYS 60 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1j3d h LYS 60 CO 0.01 0.00 -1.74 0.00 -2.27 0.00 0.00 179.45 175.45 1j3d h ALA 61 N 1.09 0.36 0.19 5.00 0.00 -1.63 -3.18 119.26 121.08 1j3d h ALA 61 Ca 0.49 -1.25 0.01 0.00 0.00 0.00 0.00 54.91 54.16 1j3d h ALA 61 Cb 2.38 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 20.62 1j3d h ALA 61 CO -0.01 1.22 -0.22 0.00 0.00 0.00 0.00 179.25 180.25 1j3d h ALA 62 N 0.35 -0.42 0.00 0.00 0.00 0.15 0.27 119.26 119.60 1j3d h ALA 62 Ca -0.32 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1j3d h ALA 62 Cb 2.04 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.16 1j3d h ALA 62 CO 0.13 -0.77 0.00 1.17 0.00 0.00 0.00 179.25 179.78 1j3d n LYS 63 N -5.34 0.16 0.04 0.00 4.81 -0.76 -2.15 118.16 114.91 1j3d n LYS 63 Ca -0.08 0.47 -0.17 0.00 -0.87 0.00 0.00 58.31 57.66 1j3d n LYS 63 Cb 0.25 -1.85 -0.14 0.00 0.02 0.00 0.00 35.03 33.31 1j3d n LYS 63 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1j3d h LEU 64 N 0.00 0.36 0.36 3.14 3.38 -1.03 -3.17 115.31 118.36 1j3d h LEU 64 Ca 0.00 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.36 1j3d h LEU 64 Cb 0.25 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1j3d h LEU 64 CO 0.00 1.50 -0.17 0.50 0.09 0.00 0.00 178.44 180.36 1j3d h LYS 65 N 0.06 -0.47 -0.62 1.13 3.64 -0.04 -2.86 116.57 117.41 1j3d h LYS 65 Ca -0.29 0.03 0.16 0.00 -1.27 0.00 0.00 60.65 59.28 1j3d h LYS 65 Cb 2.03 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.92 1j3d h LYS 65 CO 0.14 -0.16 0.44 1.05 -2.27 0.00 0.00 179.45 178.65 1j3d h GLU 66 N -0.80 0.12 0.00 1.90 -0.00 -1.64 0.31 114.58 114.47 1j3d h GLU 66 Ca -0.05 -0.01 -0.06 0.00 -0.00 0.00 0.00 59.36 59.24 1j3d h GLU 66 Cb 0.52 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 29.24 1j3d h GLU 66 CO 0.08 0.08 -0.28 -0.22 -0.00 0.00 0.00 179.01 178.67 1j3d h LYS 67 N 0.13 0.00 -0.26 1.06 3.64 -1.47 -2.36 116.57 117.30 1j3d h LYS 67 Ca 0.30 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.57 1j3d h LYS 67 Cb 1.01 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1j3d h LYS 67 CO -0.04 0.28 -0.31 -0.92 -2.27 0.00 0.00 179.45 176.20 1j3d h TYR 68 N 0.00 0.60 -0.86 1.91 3.20 -0.18 0.44 116.97 122.10 1j3d h TYR 68 Ca -0.00 -0.15 0.02 0.00 3.14 0.00 0.00 58.73 61.74 1j3d h TYR 68 Cb 0.56 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.64 1j3d h TYR 68 CO 0.00 0.78 0.56 0.93 -1.64 0.00 0.00 178.16 178.79 1j3d h GLU 69 N 0.45 1.09 0.11 1.82 5.08 -1.34 0.80 114.58 122.59 1j3d h GLU 69 Ca 0.06 -0.07 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 1j3d h GLU 69 Cb 0.76 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1j3d h GLU 69 CO 0.06 0.72 -1.31 0.87 -1.00 0.00 0.00 179.01 178.35 1j3d h LYS 70 N 1.12 0.23 0.15 2.33 1.57 -1.52 -1.07 116.57 119.38 1j3d h LYS 70 Ca 0.33 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1j3d h LYS 70 Cb -0.07 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1j3d h LYS 70 CO -0.09 1.14 -0.07 -0.44 -0.57 0.00 0.00 179.45 179.42 1j3d h ASP 71 N 0.06 -0.17 0.11 0.86 5.19 -0.45 -2.64 116.42 119.39 1j3d h ASP 71 Ca -0.15 -0.19 -0.08 0.00 -0.62 0.00 0.00 57.03 55.98 1j3d h ASP 71 Cb 1.96 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 41.50 1j3d h ASP 71 CO 0.18 0.10 -0.28 0.40 -3.12 0.00 0.00 179.24 176.52 1j3d h ILE 72 N -0.44 1.26 -0.86 0.35 1.08 0.51 -2.88 117.51 116.53 1j3d h ILE 72 Ca -0.02 -1.21 0.10 0.00 -0.39 0.00 0.00 64.86 63.33 1j3d h ILE 72 Cb 0.35 1.46 -0.07 0.00 -3.07 0.00 0.00 36.82 35.48 1j3d h ILE 72 CO 0.03 0.37 0.50 0.00 -0.69 0.00 0.00 178.15 178.36 1j3d h ALA 73 N 1.47 1.23 0.00 1.87 0.00 -0.91 1.06 119.26 123.97 1j3d h ALA 73 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1j3d h ALA 73 Cb 0.63 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1j3d h ALA 73 CO 0.05 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1j3d h ALA 74 N 1.46 1.00 -0.01 0.00 0.00 -1.26 -3.01 119.26 117.45 1j3d h ALA 74 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1j3d h ALA 74 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1j3d h ALA 74 CO -0.24 0.00 -0.50 0.98 0.00 0.00 0.00 179.25 179.49 1j3d n TYR 75 N -2.30 0.00 0.14 0.00 9.36 0.33 -4.63 117.16 120.06 1j3d n TYR 75 Ca 0.04 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.19 1j3d n TYR 75 Cb 0.35 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.03 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 0.97 -0.43 -3.70 2.98 2.43 0.12 -3.37 114.38 113.38 1j3d h ARG 76 Ca 0.00 0.03 -0.78 0.00 -0.81 0.00 0.00 59.98 58.42 1j3d h ARG 76 Cb 0.45 0.10 -0.24 0.00 -0.42 0.00 0.00 29.97 29.87 1j3d h ARG 76 CO 0.00 -0.29 1.00 0.00 -1.51 0.00 0.00 179.97 179.17 1j3d n ALA 77 N -2.72 4.54 -0.98 2.80 0.00 -1.25 -5.11 120.51 117.79 1j3d n ALA 77 Ca -0.06 -4.54 0.00 0.00 0.00 0.00 0.00 53.44 48.84 1j3d n ALA 77 Cb 0.18 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 16.97 1j3d n ALA 77 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13