#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 0.27 0.03 0.03 2.47 -1.26 -5.14 119.74 116.13 1j3d s LYS 2 Ca 0.00 -0.22 0.01 0.00 -1.56 0.00 0.00 55.97 54.20 1j3d s LYS 2 Cb 0.00 -0.88 -0.04 0.00 -1.46 0.00 0.00 37.83 35.45 1j3d s LYS 2 CO 0.00 -0.98 0.09 0.15 0.16 0.00 0.00 175.35 174.77 1j3d s LYS 3 N 2.28 3.05 0.46 4.03 3.01 -1.26 -5.08 119.74 126.22 1j3d s LYS 3 Ca 0.09 -0.54 0.08 0.00 -1.01 0.00 0.00 55.97 54.59 1j3d s LYS 3 Cb -0.15 -2.84 0.02 0.00 -1.01 0.00 0.00 37.83 33.86 1j3d s LYS 3 CO -0.32 0.62 0.57 -0.51 0.51 0.00 0.00 175.35 176.22 1j3d s ASP 4 N -2.02 5.34 0.29 2.83 1.11 -1.26 -5.01 116.67 117.95 1j3d s ASP 4 Ca 0.26 -0.64 0.11 0.00 0.18 0.00 0.00 52.55 52.47 1j3d s ASP 4 Cb -0.12 -0.36 0.43 0.00 1.07 0.00 0.00 42.92 43.94 1j3d s ASP 4 CO 0.18 -0.89 1.65 1.55 1.18 0.00 0.00 175.17 178.84 1j3d h PRO 5 N 0.63 0.00 0.02 8.23 0.13 -2.01 -3.16 132.00 135.85 1j3d h PRO 5 Ca -0.38 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.47 1j3d h PRO 5 Cb 1.28 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.37 1j3d h PRO 5 CO 0.47 0.57 -1.54 -0.91 -0.23 0.00 0.00 178.00 176.36 1j3d h ASN 6 N 0.00 0.08 -4.27 1.44 4.21 -2.05 -3.47 115.58 111.52 1j3d h ASN 6 Ca -0.01 -0.14 -0.51 0.00 1.21 0.00 0.00 56.30 56.86 1j3d h ASN 6 Cb 1.02 -0.03 0.12 0.00 -1.12 0.00 0.00 38.32 38.31 1j3d h ASN 6 CO 0.07 1.12 0.34 0.00 -1.29 0.00 0.00 177.43 177.67 1j3d s ALA 7 N -2.62 2.33 0.16 -0.83 0.00 -1.19 -5.00 121.76 114.60 1j3d s ALA 7 Ca -0.05 0.39 -0.28 0.00 0.00 0.00 0.00 51.96 52.02 1j3d s ALA 7 Cb 0.08 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 1j3d s ALA 7 CO 0.82 -1.59 0.87 -1.25 0.00 0.00 0.00 175.76 174.62 1j3d s PRO 8 N -4.57 4.69 0.04 0.00 0.04 -1.26 -4.67 135.00 129.26 1j3d s PRO 8 Ca 0.64 1.33 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 1j3d s PRO 8 Cb -0.19 -3.31 0.01 0.00 0.04 0.00 0.00 34.50 31.05 1j3d s PRO 8 CO 0.50 0.43 0.06 1.63 0.04 0.00 0.00 177.00 179.66 1j3d n LYS 9 N 2.00 0.18 -1.69 4.56 4.01 -1.26 -4.93 118.16 121.03 1j3d n LYS 9 Ca -0.02 -0.11 -0.43 0.00 -0.51 0.00 0.00 58.31 57.23 1j3d n LYS 9 Cb 0.48 -0.05 -0.03 0.00 -0.51 0.00 0.00 35.03 34.92 1j3d n LYS 9 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1j3d n ARG 10 N -1.12 2.66 -1.60 1.97 1.85 -1.26 -4.96 116.66 114.20 1j3d n ARG 10 Ca 0.01 0.97 -0.31 0.00 -1.00 0.00 0.00 57.85 57.51 1j3d n ARG 10 Cb 0.03 -2.84 0.05 0.00 -1.05 0.00 0.00 32.46 28.65 1j3d n ARG 10 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1j3d s PRO 11 N 2.50 2.84 0.08 2.89 0.04 -1.26 -5.05 135.00 137.04 1j3d s PRO 11 Ca 0.82 1.09 -0.01 0.00 0.04 0.00 0.00 61.00 62.93 1j3d s PRO 11 Cb -0.53 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.06 1j3d s PRO 11 CO 0.38 -1.18 0.08 -0.35 0.04 0.00 0.00 177.00 175.97 1j3d n PRO 12 N -2.95 -0.92 -2.43 0.56 -0.04 -1.26 -5.04 135.00 122.91 1j3d n PRO 12 Ca 0.08 -0.12 -0.02 0.00 -0.04 0.00 0.00 63.50 63.40 1j3d n PRO 12 Cb 0.53 -0.11 0.10 0.00 -0.04 0.00 0.00 33.50 33.99 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 -3.11 -1.32 0.00 3.54 2.88 -1.26 -4.86 113.62 109.49 1j3d n SER 13 Ca 0.01 -2.10 0.00 0.00 -1.33 0.00 0.00 58.87 55.45 1j3d n SER 13 Cb 0.04 0.60 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 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 -1.31 0.00 0.31 -1.46 0.00 -1.25 -4.03 120.51 112.77 1j3d n ALA 14 Ca -0.17 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.45 1j3d n ALA 14 Cb 0.83 0.00 1.03 0.00 0.00 0.00 0.00 19.45 21.32 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 -0.02 0.00 3.57 -1.96 -1.71 116.94 116.81 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 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1j3d h PHE 15 CO 0.00 0.01 -0.76 0.35 -2.23 0.00 0.00 178.31 175.68 1j3d h PHE 16 N 0.00 0.26 0.00 0.41 3.57 -1.94 -2.60 116.94 116.63 1j3d h PHE 16 Ca -0.00 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.37 1j3d h PHE 16 Cb 0.02 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1j3d h PHE 16 CO 0.00 0.87 0.00 1.28 -2.23 0.00 0.00 178.31 178.23 1j3d n LEU 17 N -3.74 0.01 -0.33 0.59 4.32 -0.65 -0.65 117.00 116.56 1j3d n LEU 17 Ca -0.03 0.80 -0.05 0.00 -0.02 0.00 0.00 56.01 56.71 1j3d n LEU 17 Cb 0.73 -0.49 -0.03 0.00 -1.62 0.00 0.00 43.42 42.00 1j3d n LEU 17 CO 0.46 -0.49 0.43 0.33 -1.22 0.00 0.00 177.39 176.90 1j3d n PHE 18 N -1.98 -0.18 -0.20 -1.77 7.35 -1.17 0.45 117.46 119.96 1j3d n PHE 18 Ca 0.00 1.01 -0.08 0.00 -0.76 0.00 0.00 57.45 57.62 1j3d n PHE 18 Cb 0.00 -0.68 0.02 0.00 0.35 0.00 0.00 39.48 39.18 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 0.76 0.30 0.62 0.00 0.87 0.24 -0.14 113.55 116.20 1j3d h SER 20 Ca 0.19 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.52 1j3d h SER 20 Cb 0.16 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 1j3d h SER 20 CO -0.02 0.19 -1.53 1.05 -0.53 0.00 0.00 176.83 175.99 1j3d h GLU 21 N 0.34 0.00 -0.62 2.24 4.11 -0.51 -3.35 114.58 116.79 1j3d h GLU 21 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1j3d h GLU 21 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1j3d h GLU 21 CO -0.05 0.40 0.00 0.72 0.07 0.00 0.00 179.01 180.15 1j3d n HIS 22 N -2.98 1.83 0.04 2.06 8.25 -0.23 -4.46 115.22 119.73 1j3d n HIS 22 Ca -0.13 -0.67 -0.20 0.00 -0.26 0.00 0.00 57.72 56.47 1j3d n HIS 22 Cb 0.94 -0.39 -0.14 0.00 1.12 0.00 0.00 29.99 31.52 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 4.08 0.31 0.00 -0.41 2.43 -1.17 -3.22 114.38 116.40 1j3d h ARG 23 Ca 0.00 -0.50 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1j3d h ARG 23 Cb 1.75 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.48 1j3d h ARG 23 CO 0.38 1.22 0.00 -0.35 -1.51 0.00 0.00 179.97 179.71 1j3d n PRO 24 N -4.15 0.52 -0.03 0.20 -0.04 -1.26 -3.23 135.00 127.01 1j3d n PRO 24 Ca -0.13 0.04 -0.17 0.00 -0.04 0.00 0.00 63.50 63.20 1j3d n PRO 24 Cb 0.80 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.62 1j3d n PRO 24 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1j3d n LYS 25 N -1.16 0.71 0.20 0.54 4.81 -1.23 -3.87 118.16 118.16 1j3d n LYS 25 Ca 0.14 0.24 0.08 0.00 -0.87 0.00 0.00 58.31 57.90 1j3d n LYS 25 Cb 0.14 -1.69 0.34 0.00 0.02 0.00 0.00 35.03 33.84 1j3d n LYS 25 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1j3d h ILE 26 N 0.04 0.59 0.00 3.15 1.08 -1.56 -2.95 117.51 117.86 1j3d h ILE 26 Ca -0.42 -1.36 0.00 0.00 -0.39 0.00 0.00 64.86 62.69 1j3d h ILE 26 Cb 2.03 1.93 0.00 0.00 -3.07 0.00 0.00 36.82 37.71 1j3d h ILE 26 CO 0.06 0.27 0.00 0.11 -0.69 0.00 0.00 178.15 177.89 1j3d h LYS 27 N 0.00 0.00 -0.00 2.37 1.57 -1.71 -2.85 116.57 115.95 1j3d h LYS 27 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j3d h LYS 27 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1j3d h LYS 27 CO 0.04 0.00 -0.01 0.77 -0.57 0.00 0.00 179.45 179.67 1j3d h SER 28 N 0.00 0.01 -0.11 0.86 0.02 -1.63 -3.23 113.55 109.48 1j3d h SER 28 Ca 0.00 -0.77 0.00 0.00 -0.84 0.00 0.00 61.79 60.18 1j3d h SER 28 Cb 0.88 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1j3d h SER 28 CO 0.00 0.79 0.00 -0.62 -1.14 0.00 0.00 176.83 175.86 1j3d n GLU 29 N -4.71 1.36 -3.05 3.45 -0.58 -1.24 -4.40 120.64 111.48 1j3d n GLU 29 Ca -0.09 -0.55 -0.14 0.00 -0.42 0.00 0.00 57.16 55.96 1j3d n GLU 29 Cb 0.39 -1.28 -0.04 0.00 -0.57 0.00 0.00 31.44 29.94 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 -1.86 -0.50 0.09 -0.32 3.76 -1.08 -5.11 115.29 110.27 1j3d s HIS 30 Ca 0.25 -1.25 -0.31 0.00 -0.15 0.00 0.00 55.06 53.60 1j3d s HIS 30 Cb 0.12 -0.20 -0.08 0.00 1.11 0.00 0.00 32.58 33.54 1j3d s HIS 30 CO 0.19 -1.09 1.52 -1.25 -0.85 0.00 0.00 174.74 173.26 1j3d s PRO 31 N 0.61 4.25 0.00 8.40 0.04 -1.23 -1.97 135.00 145.10 1j3d s PRO 31 Ca 0.30 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1j3d s PRO 31 Cb 0.01 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1j3d s PRO 31 CO -0.11 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 176.75 1j3d n GLY 32 N 3.74 3.22 3.57 0.56 0.00 -1.26 -5.01 105.19 110.02 1j3d n GLY 32 Ca 0.14 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.60 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 2.11 0.00 0.99 -0.00 -0.83 -4.93 117.00 114.34 1j3d n LEU 33 Ca 0.00 0.82 0.00 0.00 -0.00 0.00 0.00 56.01 56.83 1j3d n LEU 33 Cb 0.00 -1.15 0.00 0.00 -0.00 0.00 0.00 43.42 42.27 1j3d n LEU 33 CO 0.00 -0.56 0.00 -1.54 -0.00 0.00 0.00 177.39 175.29 1j3d n SER 34 N 7.06 -0.84 -0.06 1.96 3.41 -1.26 -4.91 113.62 118.97 1j3d n SER 34 Ca 0.35 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.90 1j3d n SER 34 Cb 0.14 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.94 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 -1.84 1.18 -0.17 -1.33 -0.00 -1.26 -4.10 119.36 111.84 1j3d n ILE 35 Ca 0.00 -0.78 -0.10 0.00 -0.00 0.00 0.00 62.75 61.87 1j3d n ILE 35 Cb 0.00 -0.48 0.00 0.00 -0.00 0.00 0.00 39.64 39.16 1j3d n ILE 35 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1j3d h GLY 36 N 3.92 0.88 0.81 7.39 0.00 -1.97 0.13 103.07 114.23 1j3d h GLY 36 Ca -0.40 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.31 1j3d h GLY 36 CO 0.03 0.57 -0.06 -0.55 0.00 0.00 0.00 176.54 176.53 1j3d h ASP 37 N 0.68 -0.15 0.40 0.19 3.32 -1.95 0.75 116.42 119.67 1j3d h ASP 37 Ca 0.14 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 1j3d h ASP 37 Cb 0.45 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1j3d h ASP 37 CO 0.02 0.07 -0.49 0.00 -1.72 0.00 0.00 179.24 177.12 1j3d h THR 38 N -0.37 1.35 -0.06 0.35 1.03 -1.70 -1.95 112.91 111.56 1j3d h THR 38 Ca -0.02 -1.71 -0.13 0.00 -0.01 0.00 0.00 66.41 64.54 1j3d h THR 38 Cb 0.30 1.87 -0.01 0.00 -1.07 0.00 0.00 68.15 69.24 1j3d h THR 38 CO 0.03 0.50 -0.55 0.00 -0.01 0.00 0.00 175.52 175.48 1j3d h ALA 39 N 1.41 0.95 -0.23 0.00 0.00 -0.61 0.17 119.26 120.95 1j3d h ALA 39 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.27 1j3d h ALA 39 Cb 0.91 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1j3d h ALA 39 CO 0.07 0.70 -0.35 0.87 0.00 0.00 0.00 179.25 180.53 1j3d h LYS 40 N 0.14 0.65 0.15 0.00 1.57 -0.53 -2.04 116.57 116.51 1j3d h LYS 40 Ca -0.00 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.38 1j3d h LYS 40 Cb 1.02 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1j3d h LYS 40 CO 0.08 1.00 -0.07 -0.22 -0.57 0.00 0.00 179.45 179.67 1j3d h LYS 41 N 0.36 -0.19 -0.16 3.15 3.64 -1.20 -2.94 116.57 119.24 1j3d h LYS 41 Ca 0.02 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1j3d h LYS 41 Cb 0.94 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.73 1j3d h LYS 41 CO 0.08 0.16 -0.41 -0.07 -2.27 0.00 0.00 179.45 176.94 1j3d h LEU 42 N -0.58 -1.30 -1.99 5.20 4.07 -0.69 0.15 115.31 120.17 1j3d h LEU 42 Ca -0.02 0.18 0.22 0.00 0.08 0.00 0.00 57.88 58.34 1j3d h LEU 42 Cb 0.44 0.53 -0.03 0.00 1.08 0.00 0.00 40.66 42.69 1j3d h LEU 42 CO 0.03 -0.42 0.57 1.23 -1.08 0.00 0.00 178.44 178.78 1j3d h GLY 43 N -0.47 0.00 1.46 0.83 0.00 -1.42 1.03 103.07 104.50 1j3d h GLY 43 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.26 1j3d h GLY 43 CO -0.41 0.00 -0.53 -2.09 0.00 0.00 0.00 176.54 173.51 1j3d h GLU 44 N 0.00 0.57 0.18 4.80 4.81 -0.55 -2.64 114.58 121.75 1j3d h GLU 44 Ca 0.36 -0.35 -0.26 0.00 -0.13 0.00 0.00 59.36 58.98 1j3d h GLU 44 Cb 1.50 0.04 0.02 0.00 0.63 0.00 0.00 28.75 30.94 1j3d h GLU 44 CO -0.00 0.96 -1.18 0.52 -0.73 0.00 0.00 179.01 178.57 1j3d h MET 45 N 0.44 0.39 -0.68 1.92 2.86 0.14 -3.29 114.93 116.71 1j3d h MET 45 Ca 0.01 -0.66 0.13 0.00 -2.06 0.00 0.00 59.70 57.13 1j3d h MET 45 Cb 1.07 0.25 -0.09 0.00 0.06 0.00 0.00 31.60 32.88 1j3d h MET 45 CO 0.10 1.32 0.19 2.35 1.06 0.00 0.00 176.91 181.92 1j3d h TRP 46 N -0.15 0.30 0.00 -0.22 -0.00 0.69 0.87 115.95 117.44 1j3d h TRP 46 Ca -0.22 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.71 1j3d h TRP 46 Cb 1.87 -0.03 0.00 0.00 -0.00 0.00 0.00 29.16 31.00 1j3d h TRP 46 CO 0.16 -0.02 0.00 0.45 -0.00 0.00 0.00 178.44 179.03 1j3d n SER 47 N -5.10 0.00 -0.00 2.65 2.88 -1.00 -1.91 113.62 111.14 1j3d n SER 47 Ca 0.12 0.44 0.07 0.00 -1.33 0.00 0.00 58.87 58.17 1j3d n SER 47 Cb 0.38 -0.47 -0.09 0.00 -0.75 0.00 0.00 64.21 63.28 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 1.87 -1.76 -1.46 -0.58 0.27 -4.99 120.64 112.53 1j3d n GLU 48 Ca 0.03 -0.03 -0.39 0.00 -0.42 0.00 0.00 57.16 56.35 1j3d n GLU 48 Cb 0.13 -1.21 0.03 0.00 -0.57 0.00 0.00 31.44 29.82 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 -2.50 3.35 0.00 3.49 -1.52 0.33 -5.02 119.66 117.79 1j3d s GLN 49 Ca 0.03 2.35 0.00 0.00 -1.95 0.00 0.00 55.36 55.79 1j3d s GLN 49 Cb 0.10 -2.43 0.00 0.00 -0.22 0.00 0.00 33.01 30.46 1j3d s GLN 49 CO 0.59 -1.06 0.00 -1.13 -0.25 0.00 0.00 175.29 173.43 1j3d n SER 50 N -0.68 0.00 0.02 5.90 3.41 -1.26 -4.86 113.62 116.15 1j3d n SER 50 Ca 0.08 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.81 1j3d n SER 50 Cb 0.43 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.88 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 2.08 -0.03 7.33 0.00 -1.26 -3.18 120.51 122.45 1j3d n ALA 51 Ca 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.22 1j3d n ALA 51 Cb 0.00 -1.39 -0.09 0.00 0.00 0.00 0.00 19.45 17.96 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 -2.18 0.00 3.64 -2.01 -3.22 116.57 113.18 1j3d h LYS 52 Ca 0.00 -0.32 -0.59 0.00 -1.27 0.00 0.00 60.65 58.48 1j3d h LYS 52 Cb 0.44 0.07 -0.42 0.00 -0.41 0.00 0.00 32.23 31.91 1j3d h LYS 52 CO 0.00 0.96 -0.67 -0.25 -2.27 0.00 0.00 179.45 177.22 1j3d n ASP 53 N -4.37 4.38 0.00 4.20 9.92 -1.22 -4.69 116.55 124.77 1j3d n ASP 53 Ca -0.08 -3.66 0.00 0.00 -0.53 0.00 0.00 54.79 50.51 1j3d n ASP 53 Cb 0.54 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 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 -0.26 0.00 0.08 -1.24 4.81 -1.19 -4.62 118.16 115.75 1j3d n LYS 54 Ca 0.32 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.65 1j3d n LYS 54 Cb 0.43 0.00 -0.07 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 -0.27 0.00 1.64 1.08 -1.72 -1.78 115.11 114.06 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 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1j3d h GLN 55 CO 0.00 0.12 0.00 -0.35 -0.95 0.00 0.00 178.83 177.65 1j3d n PRO 56 N -4.97 0.18 -0.08 1.46 -0.04 -1.26 -1.54 135.00 128.73 1j3d n PRO 56 Ca -0.08 0.15 -0.14 0.00 -0.04 0.00 0.00 63.50 63.39 1j3d n PRO 56 Cb 0.26 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.08 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 -1.35 0.32 0.05 0.54 4.01 -1.20 -3.74 117.16 115.78 1j3d n TYR 57 Ca 0.07 0.09 -0.14 0.00 -0.16 0.00 0.00 57.90 57.76 1j3d n TYR 57 Cb 0.15 -1.05 -0.14 0.00 -0.31 0.00 0.00 39.34 38.00 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 0.01 0.17 0.17 -0.72 4.11 -1.20 -3.22 114.58 113.91 1j3d h GLU 58 Ca -0.50 -0.29 -0.01 0.00 0.07 0.00 0.00 59.36 58.63 1j3d h GLU 58 Cb 2.07 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.42 1j3d h GLU 58 CO 0.00 1.00 -0.08 1.96 0.07 0.00 0.00 179.01 181.96 1j3d h GLN 59 N 0.05 -0.22 0.00 1.06 4.20 -1.49 0.68 115.11 119.38 1j3d h GLN 59 Ca -0.22 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1j3d h GLN 59 Cb 1.98 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.81 1j3d h GLN 59 CO 0.14 -0.15 0.36 -0.22 -0.67 0.00 0.00 178.83 178.29 1j3d h LYS 60 N -0.39 0.00 0.03 1.46 3.64 -1.76 -0.56 116.57 118.99 1j3d h LYS 60 Ca -0.02 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.99 1j3d h LYS 60 Cb 0.18 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 1j3d h LYS 60 CO 0.04 0.00 -2.24 0.00 -2.27 0.00 0.00 179.45 174.98 1j3d n ALA 61 N -1.76 1.33 -0.21 5.00 0.00 -1.20 -3.29 120.51 120.37 1j3d n ALA 61 Ca -0.02 -0.99 -0.09 0.00 0.00 0.00 0.00 53.44 52.35 1j3d n ALA 61 Cb 0.40 -0.36 0.04 0.00 0.00 0.00 0.00 19.45 19.52 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 0.38 0.86 0.25 0.00 0.00 0.68 -1.56 119.26 119.88 1j3d h ALA 62 Ca -0.49 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 1j3d h ALA 62 Cb 2.03 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1j3d h ALA 62 CO 0.00 0.67 -0.12 -0.22 0.00 0.00 0.00 179.25 179.58 1j3d h LYS 63 N 0.98 -0.33 -0.20 0.00 3.64 -1.51 -2.43 116.57 116.72 1j3d h LYS 63 Ca 0.18 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 1j3d h LYS 63 Cb 0.54 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1j3d h LYS 63 CO 0.03 -0.22 0.35 -0.07 -2.27 0.00 0.00 179.45 177.27 1j3d h LEU 64 N -1.00 0.00 0.10 5.20 3.38 -1.64 -1.00 115.31 120.35 1j3d h LEU 64 Ca -0.03 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 1j3d h LEU 64 Cb 0.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1j3d h LEU 64 CO 0.06 0.00 -0.73 0.50 0.09 0.00 0.00 178.44 178.36 1j3d h LYS 65 N 0.00 0.22 -0.84 1.13 3.64 -1.32 -2.46 116.57 116.94 1j3d h LYS 65 Ca 0.10 -0.37 0.10 0.00 -1.27 0.00 0.00 60.65 59.21 1j3d h LYS 65 Cb 0.79 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.69 1j3d h LYS 65 CO -0.00 1.18 0.55 0.93 -2.27 0.00 0.00 179.45 179.83 1j3d h GLU 66 N -0.53 0.77 0.00 1.90 4.39 -0.67 -0.18 114.58 120.26 1j3d h GLU 66 Ca -0.14 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1j3d h GLU 66 Cb 1.50 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 1j3d h GLU 66 CO 0.09 0.51 -0.46 1.17 -1.16 0.00 0.00 179.01 179.16 1j3d n LYS 67 N -4.52 0.14 0.04 2.33 4.81 -0.96 -4.01 118.16 115.99 1j3d n LYS 67 Ca 0.14 0.05 -0.20 0.00 -0.87 0.00 0.00 58.31 57.43 1j3d n LYS 67 Cb 0.32 -1.59 -0.13 0.00 0.02 0.00 0.00 35.03 33.65 1j3d n LYS 67 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1j3d h TYR 68 N 0.00 0.66 -0.27 5.64 -1.99 -0.54 -2.66 116.97 117.80 1j3d h TYR 68 Ca 0.00 -0.43 0.03 0.00 2.00 0.00 0.00 58.73 60.34 1j3d h TYR 68 Cb 0.62 -0.05 -0.03 0.00 2.00 0.00 0.00 36.73 39.27 1j3d h TYR 68 CO 0.00 1.29 0.08 0.93 -0.00 0.00 0.00 178.16 180.46 1j3d h GLU 69 N -0.16 0.19 0.04 4.88 5.08 -1.57 0.87 114.58 123.89 1j3d h GLU 69 Ca -0.13 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1j3d h GLU 69 Cb 1.60 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.80 1j3d h GLU 69 CO 0.16 0.12 -0.02 0.87 -1.00 0.00 0.00 179.01 179.14 1j3d h LYS 70 N 0.19 -0.05 -0.52 2.33 1.57 -1.70 0.21 116.57 118.60 1j3d h LYS 70 Ca 0.12 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.98 1j3d h LYS 70 Cb 0.11 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 1j3d h LYS 70 CO -0.14 0.09 0.17 -0.44 -0.57 0.00 0.00 179.45 178.55 1j3d h ASP 71 N -0.17 0.14 -0.13 0.86 3.32 -1.07 0.05 116.42 119.41 1j3d h ASP 71 Ca -0.01 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.05 1j3d h ASP 71 Cb 0.16 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1j3d h ASP 71 CO 0.01 0.10 -0.11 0.40 -1.72 0.00 0.00 179.24 177.93 1j3d h ILE 72 N 0.33 1.22 -0.17 0.35 1.08 0.10 -0.69 117.51 119.73 1j3d h ILE 72 Ca 0.25 -0.96 -0.08 0.00 -0.39 0.00 0.00 64.86 63.68 1j3d h ILE 72 Cb 0.30 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 1j3d h ILE 72 CO -0.28 0.31 -0.25 0.00 -0.69 0.00 0.00 178.15 177.25 1j3d h ALA 73 N 1.45 1.25 0.00 1.87 0.00 0.12 0.65 119.26 124.61 1j3d h ALA 73 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1j3d h ALA 73 Cb 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1j3d h ALA 73 CO 0.03 0.50 -0.52 0.00 0.00 0.00 0.00 179.25 179.25 1j3d n ALA 74 N -2.48 3.28 -0.05 0.00 0.00 -0.33 -3.73 120.51 117.20 1j3d n ALA 74 Ca -0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.11 1j3d n ALA 74 Cb 0.38 -1.15 -0.12 0.00 0.00 0.00 0.00 19.45 18.55 1j3d n ALA 74 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1j3d n TYR 75 N -1.70 0.00 1.24 0.00 4.19 -0.31 -4.35 117.16 116.23 1j3d n TYR 75 Ca 0.05 0.00 0.14 0.00 3.31 0.00 0.00 57.90 61.40 1j3d n TYR 75 Cb 0.37 -0.61 0.64 0.00 0.49 0.00 0.00 39.34 40.23 1j3d n TYR 75 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1j3d n ARG 76 N -2.38 0.29 -3.13 2.98 0.63 0.22 -4.60 116.66 110.68 1j3d n ARG 76 Ca -0.17 -0.04 0.02 0.00 -0.92 0.00 0.00 57.85 56.74 1j3d n ARG 76 Cb 0.78 -1.50 -0.01 0.00 0.45 0.00 0.00 32.46 32.19 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 -2.74 -2.77 -2.80 5.13 0.00 -1.24 -5.07 121.76 112.28 1j3d s ALA 77 Ca 0.22 0.57 0.22 0.00 0.00 0.00 0.00 51.96 52.98 1j3d s ALA 77 Cb 0.20 -2.75 0.18 0.00 0.00 0.00 0.00 23.12 20.74 1j3d s ALA 77 CO 0.51 -2.19 1.21 1.63 0.00 0.00 0.00 175.76 176.92