#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 -2.53 -1.83 0.03 4.01 -1.26 -4.96 118.16 111.63 1j3d n LYS 2 Ca 0.00 2.18 -0.31 0.00 -0.51 0.00 0.00 58.31 59.67 1j3d n LYS 2 Cb 0.00 -3.82 0.02 0.00 -0.51 0.00 0.00 35.03 30.72 1j3d n LYS 2 CO 0.00 0.00 0.00 -1.59 -1.11 0.00 0.00 177.40 174.70 1j3d s LYS 3 N -1.28 3.48 0.69 1.97 -2.85 -1.26 -5.07 119.74 115.43 1j3d s LYS 3 Ca -0.03 0.79 -0.05 0.00 -1.00 0.00 0.00 55.97 55.69 1j3d s LYS 3 Cb 0.00 -2.06 0.08 0.00 -2.06 0.00 0.00 37.83 33.78 1j3d s LYS 3 CO 0.51 -0.66 0.98 -0.51 0.10 0.00 0.00 175.35 175.77 1j3d s ASP 4 N -4.08 4.71 0.34 0.03 1.01 -1.26 -4.98 116.67 112.44 1j3d s ASP 4 Ca 0.56 0.21 0.15 0.00 0.71 0.00 0.00 52.55 54.18 1j3d s ASP 4 Cb -0.12 -0.82 0.59 0.00 1.01 0.00 0.00 42.92 43.59 1j3d s ASP 4 CO 0.54 -1.63 1.71 1.55 0.21 0.00 0.00 175.17 177.55 1j3d h PRO 5 N -0.52 0.00 0.04 8.23 0.13 -2.00 -3.13 132.00 134.74 1j3d h PRO 5 Ca -0.43 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.42 1j3d h PRO 5 Cb 1.30 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1j3d h PRO 5 CO 0.54 0.46 -1.52 -0.91 -0.23 0.00 0.00 178.00 176.34 1j3d h ASN 6 N 0.00 0.13 -4.25 1.44 4.21 -2.05 -3.47 115.58 111.59 1j3d h ASN 6 Ca -0.00 -0.20 -0.51 0.00 1.21 0.00 0.00 56.30 56.79 1j3d h ASN 6 Cb 0.92 -0.04 0.16 0.00 -1.12 0.00 0.00 38.32 38.24 1j3d h ASN 6 CO 0.06 1.17 0.27 0.00 -1.29 0.00 0.00 177.43 177.64 1j3d s ALA 7 N -2.63 1.85 0.19 -0.83 0.00 -1.18 -4.98 121.76 114.18 1j3d s ALA 7 Ca -0.06 0.34 -0.30 0.00 0.00 0.00 0.00 51.96 51.94 1j3d s ALA 7 Cb 0.08 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.80 1j3d s ALA 7 CO 0.83 -2.22 0.97 -1.25 0.00 0.00 0.00 175.76 174.08 1j3d s PRO 8 N -4.81 4.77 0.82 0.00 0.04 -1.26 -4.75 135.00 129.82 1j3d s PRO 8 Ca 0.63 1.51 -0.14 0.00 0.04 0.00 0.00 61.00 63.04 1j3d s PRO 8 Cb -0.19 -3.31 0.20 0.00 0.04 0.00 0.00 34.50 31.24 1j3d s PRO 8 CO 0.57 0.36 0.80 1.63 0.04 0.00 0.00 177.00 180.40 1j3d n LYS 9 N 2.02 -2.17 -1.75 4.56 4.01 -1.26 -4.95 118.16 118.61 1j3d n LYS 9 Ca -0.00 -1.27 -0.41 0.00 -0.51 0.00 0.00 58.31 56.12 1j3d n LYS 9 Cb 0.48 -1.11 0.01 0.00 -0.51 0.00 0.00 35.03 33.90 1j3d n LYS 9 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1j3d n ARG 10 N -3.66 2.34 -2.67 1.97 1.74 -1.26 -4.95 116.66 110.17 1j3d n ARG 10 Ca 0.11 0.83 -0.39 0.00 -0.77 0.00 0.00 57.85 57.62 1j3d n ARG 10 Cb 0.41 -2.58 -0.05 0.00 -1.02 0.00 0.00 32.46 29.22 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 -2.23 4.71 0.00 5.56 0.04 -1.26 -5.06 135.00 136.77 1j3d s PRO 11 Ca 0.58 1.55 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1j3d s PRO 11 Cb -0.48 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1j3d s PRO 11 CO 0.60 0.36 0.00 -0.35 0.04 0.00 0.00 177.00 177.65 1j3d n PRO 12 N 1.16 -0.47 -2.42 0.56 -0.04 -1.26 -5.05 135.00 127.49 1j3d n PRO 12 Ca -0.01 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.43 1j3d n PRO 12 Cb 0.47 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.02 1j3d n PRO 12 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1j3d n SER 13 N -2.51 -1.19 0.00 3.54 7.64 -1.26 -4.92 113.62 114.92 1j3d n SER 13 Ca 0.00 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 57.94 1j3d n SER 13 Cb 0.00 0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 1j3d n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1j3d n ALA 14 N -0.98 0.00 0.28 -0.43 0.00 -1.26 -3.92 120.51 114.19 1j3d n ALA 14 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.44 1j3d n ALA 14 Cb 0.77 0.00 0.81 0.00 0.00 0.00 0.00 19.45 21.03 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 -0.11 0.00 3.57 -1.96 -1.34 116.94 117.10 1j3d h PHE 15 Ca 0.00 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 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 0.00 -0.41 0.35 -2.23 0.00 0.00 178.31 176.02 1j3d h PHE 16 N 0.00 0.28 0.03 0.41 3.04 -1.94 -2.11 116.94 116.65 1j3d h PHE 16 Ca 0.01 -0.08 -0.00 0.00 3.98 0.00 0.00 57.97 61.88 1j3d h PHE 16 Cb 0.02 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.47 1j3d h PHE 16 CO 0.00 0.62 -0.01 -0.07 -2.02 0.00 0.00 178.31 176.82 1j3d h LEU 17 N 0.20 -0.03 -0.81 0.59 4.07 -1.57 0.89 115.31 118.65 1j3d h LEU 17 Ca 0.02 0.00 0.09 0.00 0.08 0.00 0.00 57.88 58.07 1j3d h LEU 17 Cb 0.81 0.01 -0.11 0.00 1.08 0.00 0.00 40.66 42.45 1j3d h LEU 17 CO 0.06 -0.01 -0.42 0.33 -1.08 0.00 0.00 178.44 177.32 1j3d n PHE 18 N -2.14 -0.21 -0.26 1.13 7.35 -1.15 0.63 117.46 122.81 1j3d n PHE 18 Ca -0.00 1.01 -0.07 0.00 -0.76 0.00 0.00 57.45 57.63 1j3d n PHE 18 Cb 0.01 -0.65 0.05 0.00 0.35 0.00 0.00 39.48 39.24 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 1.04 0.33 0.64 0.00 0.87 0.28 0.16 113.55 116.87 1j3d h SER 20 Ca 0.23 -0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.53 1j3d h SER 20 Cb 0.29 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 1j3d h SER 20 CO -0.01 0.23 -1.51 1.05 -0.53 0.00 0.00 176.83 176.06 1j3d h GLU 21 N 0.38 0.00 -0.65 2.24 4.11 -0.57 -3.34 114.58 116.75 1j3d h GLU 21 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.59 1j3d h GLU 21 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1j3d h GLU 21 CO -0.04 0.54 0.00 0.72 0.07 0.00 0.00 179.01 180.30 1j3d n HIS 22 N -3.07 1.46 0.02 2.06 8.25 -0.46 -4.41 115.22 119.06 1j3d n HIS 22 Ca -0.12 -0.57 -0.18 0.00 -0.26 0.00 0.00 57.72 56.59 1j3d n HIS 22 Cb 0.99 -0.26 -0.13 0.00 1.12 0.00 0.00 29.99 31.71 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 3.80 0.29 0.00 -0.41 2.43 -1.10 -3.15 114.38 116.25 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 1.43 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.11 1j3d h ARG 23 CO 0.25 1.14 0.00 -0.35 -1.51 0.00 0.00 179.97 179.49 1j3d n PRO 24 N -4.24 0.31 -0.03 0.20 -0.04 -1.26 -3.14 135.00 126.79 1j3d n PRO 24 Ca -0.12 0.08 -0.21 0.00 -0.04 0.00 0.00 63.50 63.21 1j3d n PRO 24 Cb 0.71 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.54 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 0.16 0.00 0.54 1.63 -1.81 -3.30 116.57 113.79 1j3d h LYS 25 Ca 0.00 -0.28 -0.03 0.00 -0.85 0.00 0.00 60.65 59.49 1j3d h LYS 25 Cb 0.20 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.93 1j3d h LYS 25 CO 0.00 1.13 -0.14 0.82 -3.45 0.00 0.00 179.45 177.81 1j3d h ILE 26 N -0.44 0.52 0.00 2.00 1.08 -1.53 -1.81 117.51 117.32 1j3d h ILE 26 Ca -0.35 -0.70 -0.06 0.00 -0.39 0.00 0.00 64.86 63.36 1j3d h ILE 26 Cb 1.67 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 36.88 1j3d h ILE 26 CO -0.03 0.14 -0.30 0.11 -0.69 0.00 0.00 178.15 177.38 1j3d h LYS 27 N 0.00 0.00 -0.03 2.37 1.57 -1.67 -1.86 116.57 116.95 1j3d h LYS 27 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1j3d h LYS 27 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1j3d h LYS 27 CO 0.02 0.30 -0.12 0.77 -0.57 0.00 0.00 179.45 179.84 1j3d h SER 28 N 0.00 0.16 0.09 0.86 0.02 -1.40 -2.94 113.55 110.34 1j3d h SER 28 Ca -0.00 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 1j3d h SER 28 Cb 0.91 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1j3d h SER 28 CO 0.04 0.78 0.00 -0.62 -1.14 0.00 0.00 176.83 175.89 1j3d n GLU 29 N -4.64 0.89 -3.17 3.45 -0.58 -1.19 -4.26 120.64 111.15 1j3d n GLU 29 Ca -0.09 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.49 1j3d n GLU 29 Cb 0.39 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.71 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 -2.09 -0.17 -0.46 -0.32 3.76 -0.70 -5.09 115.29 110.22 1j3d s HIS 30 Ca 0.44 -1.37 -0.27 0.00 -0.15 0.00 0.00 55.06 53.71 1j3d s HIS 30 Cb 0.21 -0.37 -0.04 0.00 1.11 0.00 0.00 32.58 33.49 1j3d s HIS 30 CO 0.38 -1.02 2.13 -1.25 -0.85 0.00 0.00 174.74 174.13 1j3d s PRO 31 N 0.65 2.60 0.00 8.40 0.04 -1.12 -2.76 135.00 142.81 1j3d s PRO 31 Ca 0.28 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.60 1j3d s PRO 31 Cb -0.02 -4.44 0.00 0.00 0.04 0.00 0.00 34.50 30.09 1j3d s PRO 31 CO -0.11 -2.72 0.00 0.41 0.04 0.00 0.00 177.00 174.62 1j3d n GLY 32 N 5.79 0.85 3.73 0.56 0.00 -1.26 -5.10 105.19 109.76 1j3d n GLY 32 Ca 0.29 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.31 3.60 0.68 0.99 1.98 -1.11 -5.11 118.68 118.40 1j3d s LEU 33 Ca 0.00 -0.14 -0.11 0.00 -2.89 0.00 0.00 54.13 50.99 1j3d s LEU 33 Cb 0.00 -2.29 -0.00 0.00 0.66 0.00 0.00 46.19 44.55 1j3d s LEU 33 CO 0.00 0.15 1.07 -0.94 -1.89 0.00 0.00 176.35 174.74 1j3d s SER 34 N -2.53 5.67 0.00 3.68 1.04 -1.26 -4.94 113.70 115.36 1j3d s SER 34 Ca 0.28 1.25 0.25 0.00 0.48 0.00 0.00 55.95 58.21 1j3d s SER 34 Cb -0.11 -2.13 1.36 0.00 0.10 0.00 0.00 66.02 65.23 1j3d s SER 34 CO 0.20 -1.21 1.85 -0.38 0.98 0.00 0.00 173.24 174.68 1j3d n ILE 35 N -2.94 0.13 -0.04 -1.02 5.41 -1.26 -3.37 119.36 116.28 1j3d n ILE 35 Ca 0.07 0.03 -0.22 0.00 1.00 0.00 0.00 62.75 63.63 1j3d n ILE 35 Cb 0.56 -0.63 -0.13 0.00 -0.71 0.00 0.00 39.64 38.73 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 4.05 0.18 0.74 7.39 0.00 -1.97 -3.12 103.07 110.35 1j3d h GLY 36 Ca 0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 1j3d h GLY 36 CO 0.00 0.41 -0.12 -0.55 0.00 0.00 0.00 176.54 176.28 1j3d h ASP 37 N -0.38 -0.29 -0.00 0.19 5.19 -1.96 0.20 116.42 119.37 1j3d h ASP 37 Ca -0.39 -0.17 -0.04 0.00 -0.62 0.00 0.00 57.03 55.82 1j3d h ASP 37 Cb 1.73 0.07 -0.01 0.00 0.18 0.00 0.00 39.33 41.30 1j3d h ASP 37 CO -0.03 0.01 -0.08 0.00 -3.12 0.00 0.00 179.24 176.02 1j3d h THR 38 N -0.61 1.14 -0.02 0.35 1.03 -1.76 -1.61 112.91 111.43 1j3d h THR 38 Ca -0.03 -0.60 -0.21 0.00 -0.01 0.00 0.00 66.41 65.56 1j3d h THR 38 Cb 0.44 1.13 -0.00 0.00 -1.07 0.00 0.00 68.15 68.64 1j3d h THR 38 CO 0.06 0.19 -0.88 0.00 -0.01 0.00 0.00 175.52 174.88 1j3d h ALA 39 N 1.73 0.45 -0.35 0.00 0.00 -1.45 -0.68 119.26 118.94 1j3d h ALA 39 Ca 0.04 -0.68 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 1j3d h ALA 39 Cb 0.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1j3d h ALA 39 CO 0.01 0.82 0.04 0.87 0.00 0.00 0.00 179.25 180.99 1j3d h LYS 40 N 0.22 0.59 0.07 0.00 1.57 -0.01 -0.95 116.57 118.06 1j3d h LYS 40 Ca -0.06 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1j3d h LYS 40 Cb 1.50 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1j3d h LYS 40 CO 0.15 0.68 -0.03 -0.22 -0.57 0.00 0.00 179.45 179.46 1j3d h LYS 41 N 0.42 -0.09 -0.26 3.15 3.64 -1.31 -3.01 116.57 119.11 1j3d h LYS 41 Ca 0.10 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.55 1j3d h LYS 41 Cb 0.39 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.15 1j3d h LYS 41 CO 0.01 0.20 -0.34 -0.07 -2.27 0.00 0.00 179.45 176.99 1j3d h LEU 42 N -0.38 -1.08 -1.97 5.20 4.07 -1.02 0.18 115.31 120.31 1j3d h LEU 42 Ca -0.01 0.17 0.22 0.00 0.08 0.00 0.00 57.88 58.34 1j3d h LEU 42 Cb 0.33 0.48 -0.03 0.00 1.08 0.00 0.00 40.66 42.52 1j3d h LEU 42 CO 0.01 -0.35 0.58 1.23 -1.08 0.00 0.00 178.44 178.84 1j3d h GLY 43 N -0.34 0.00 1.43 0.83 0.00 -1.17 0.87 103.07 104.70 1j3d h GLY 43 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.31 1j3d h GLY 43 CO -0.45 0.00 -0.45 -2.09 0.00 0.00 0.00 176.54 173.55 1j3d h GLU 44 N 0.00 0.61 0.19 4.80 4.81 -0.53 -2.61 114.58 121.85 1j3d h GLU 44 Ca 0.36 -0.34 -0.25 0.00 -0.13 0.00 0.00 59.36 58.99 1j3d h GLU 44 Cb 1.51 0.02 0.03 0.00 0.63 0.00 0.00 28.75 30.94 1j3d h GLU 44 CO -0.00 0.94 -1.12 0.52 -0.73 0.00 0.00 179.01 178.62 1j3d h MET 45 N 0.49 0.40 -0.71 1.92 2.86 0.97 -3.28 114.93 117.58 1j3d h MET 45 Ca 0.03 -0.69 0.14 0.00 -2.06 0.00 0.00 59.70 57.12 1j3d h MET 45 Cb 0.98 0.26 -0.10 0.00 0.06 0.00 0.00 31.60 32.80 1j3d h MET 45 CO 0.09 1.33 0.23 2.35 1.06 0.00 0.00 176.91 181.97 1j3d h TRP 46 N -0.15 0.38 0.00 -0.22 -0.00 -0.00 0.90 115.95 116.86 1j3d h TRP 46 Ca -0.20 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.73 1j3d h TRP 46 Cb 1.87 -0.06 0.00 0.00 -0.00 0.00 0.00 29.16 30.97 1j3d h TRP 46 CO 0.17 0.00 0.00 0.45 -0.00 0.00 0.00 178.44 179.06 1j3d n SER 47 N -5.07 0.00 -0.00 2.65 2.88 -0.99 -1.97 113.62 111.12 1j3d n SER 47 Ca 0.13 0.49 0.06 0.00 -1.33 0.00 0.00 58.87 58.22 1j3d n SER 47 Cb 0.40 -0.49 -0.08 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 -1.49 2.03 -1.72 -1.46 -0.58 0.28 -4.99 120.64 112.70 1j3d n GLU 48 Ca 0.03 -0.03 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 1j3d n GLU 48 Cb 0.13 -1.18 0.03 0.00 -0.57 0.00 0.00 31.44 29.85 1j3d n GLU 48 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1j3d n GLN 49 N -1.49 1.87 0.00 3.49 1.13 0.59 -5.01 117.38 117.96 1j3d n GLN 49 Ca 0.01 0.67 0.00 0.00 -1.94 0.00 0.00 57.00 55.74 1j3d n GLN 49 Cb 0.25 -2.49 0.00 0.00 0.11 0.00 0.00 30.24 28.11 1j3d n GLN 49 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1j3d n SER 50 N -0.31 0.00 0.00 1.08 3.41 -1.26 -4.84 113.62 111.70 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 0.42 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 64.96 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 2.21 0.01 7.33 0.00 -1.26 -3.08 120.51 122.72 1j3d n ALA 51 Ca 0.00 -0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.16 1j3d n ALA 51 Cb 0.00 -1.41 -0.10 0.00 0.00 0.00 0.00 19.45 17.94 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 0.51 -2.06 0.00 3.64 -2.01 -3.24 116.57 113.41 1j3d h LYS 52 Ca 0.00 -0.52 -0.56 0.00 -1.27 0.00 0.00 60.65 58.29 1j3d h LYS 52 Cb 0.32 0.14 -0.42 0.00 -0.41 0.00 0.00 32.23 31.87 1j3d h LYS 52 CO 0.00 1.16 -0.77 -0.25 -2.27 0.00 0.00 179.45 177.32 1j3d n ASP 53 N -4.12 3.80 0.00 4.20 9.92 -1.22 -4.73 116.55 124.40 1j3d n ASP 53 Ca -0.10 -3.54 0.00 0.00 -0.53 0.00 0.00 54.79 50.62 1j3d n ASP 53 Cb 0.72 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 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 -0.19 0.00 0.01 -1.24 4.81 -1.18 -4.63 118.16 115.75 1j3d n LYS 54 Ca 0.30 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.63 1j3d n LYS 54 Cb 0.50 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.46 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 -0.12 0.00 1.64 1.08 -1.71 -2.93 115.11 113.08 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 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1j3d h GLN 55 CO 0.00 0.40 0.00 -0.35 -0.95 0.00 0.00 178.83 177.93 1j3d n PRO 56 N -4.85 0.31 -0.03 1.46 -0.04 -1.26 -2.59 135.00 128.00 1j3d n PRO 56 Ca -0.08 0.08 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 1j3d n PRO 56 Cb 0.29 -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 -1.28 0.89 0.07 0.54 4.02 -1.21 -3.42 117.16 116.76 1j3d n TYR 57 Ca 0.10 0.31 0.06 0.00 -0.01 0.00 0.00 57.90 58.36 1j3d n TYR 57 Cb 0.17 -1.16 -0.04 0.00 -0.02 0.00 0.00 39.34 38.28 1j3d n TYR 57 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1j3d n GLU 58 N -3.03 0.61 0.00 -0.72 0.28 -1.11 -3.24 120.64 113.43 1j3d n GLU 58 Ca -0.20 0.16 0.13 0.00 -0.16 0.00 0.00 57.16 57.09 1j3d n GLU 58 Cb 1.06 -1.81 0.37 0.00 1.43 0.00 0.00 31.44 32.49 1j3d n GLU 58 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1j3d n GLN 59 N -2.76 0.69 -0.07 3.44 1.13 -1.07 -2.10 117.38 116.64 1j3d n GLN 59 Ca -0.05 -0.40 -0.04 0.00 -1.94 0.00 0.00 57.00 54.58 1j3d n GLN 59 Cb 0.69 -1.49 -0.15 0.00 0.11 0.00 0.00 30.24 29.40 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 -0.81 0.87 -0.04 -1.09 4.81 -1.22 -3.76 118.16 116.92 1j3d n LYS 60 Ca 0.11 -0.06 -0.04 0.00 -0.87 0.00 0.00 58.31 57.46 1j3d n LYS 60 Cb 0.34 -1.47 -0.14 0.00 0.02 0.00 0.00 35.03 33.78 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 -2.54 1.82 0.12 3.14 0.00 -1.20 -3.54 120.51 118.31 1j3d n ALA 61 Ca -0.23 -0.89 0.05 0.00 0.00 0.00 0.00 53.44 52.38 1j3d n ALA 61 Cb 0.94 -0.60 0.02 0.00 0.00 0.00 0.00 19.45 19.80 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 1.27 0.69 -0.00 0.00 0.00 -1.64 -2.64 119.26 116.95 1j3d h ALA 62 Ca -0.31 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1j3d h ALA 62 Cb 1.83 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1j3d h ALA 62 CO 0.04 0.46 -0.77 1.17 0.00 0.00 0.00 179.25 180.14 1j3d n LYS 63 N -2.99 0.20 -0.02 0.00 3.00 -1.25 -4.19 118.16 112.91 1j3d n LYS 63 Ca -0.01 -0.15 0.05 0.00 -0.00 0.00 0.00 58.31 58.20 1j3d n LYS 63 Cb 0.69 -1.50 -0.12 0.00 0.00 0.00 0.00 35.03 34.10 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 -1.27 0.00 0.01 3.14 0.00 -1.23 -4.41 117.00 113.24 1j3d n LEU 64 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 56.01 56.01 1j3d n LEU 64 Cb 0.35 0.06 0.14 0.00 0.00 0.00 0.00 43.42 43.98 1j3d n LEU 64 CO 0.38 0.06 0.64 0.50 0.00 0.00 0.00 177.39 178.97 1j3d h LYS 65 N 0.00 0.50 -0.05 1.96 3.64 -1.63 -2.70 116.57 118.30 1j3d h LYS 65 Ca -0.07 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 59.05 1j3d h LYS 65 Cb 0.93 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1j3d h LYS 65 CO 0.00 0.80 -0.10 0.93 -2.27 0.00 0.00 179.45 178.81 1j3d h GLU 66 N 0.42 0.07 0.00 1.90 5.08 -1.77 -1.90 114.58 118.37 1j3d h GLU 66 Ca 0.04 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1j3d h GLU 66 Cb 0.83 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1j3d h GLU 66 CO 0.07 0.17 -0.46 -0.22 -1.00 0.00 0.00 179.01 177.58 1j3d h LYS 67 N 0.06 0.00 -0.31 2.33 3.64 -1.71 -3.25 116.57 117.33 1j3d h LYS 67 Ca 0.01 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.26 1j3d h LYS 67 Cb 0.22 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1j3d h LYS 67 CO 0.01 0.46 -0.37 -0.92 -2.27 0.00 0.00 179.45 176.36 1j3d h TYR 68 N 0.00 0.85 -0.49 1.91 3.20 -1.13 0.16 116.97 121.46 1j3d h TYR 68 Ca -0.00 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.63 1j3d h TYR 68 Cb 1.34 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 39.40 1j3d h TYR 68 CO 0.00 0.98 0.32 0.93 -1.64 0.00 0.00 178.16 178.75 1j3d h GLU 69 N 0.59 0.65 0.07 1.82 5.08 -1.55 0.34 114.58 121.59 1j3d h GLU 69 Ca 0.06 -0.04 -0.33 0.00 -1.00 0.00 0.00 59.36 58.05 1j3d h GLU 69 Cb 0.90 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 1j3d h GLU 69 CO 0.08 0.44 -1.81 0.87 -1.00 0.00 0.00 179.01 177.59 1j3d h LYS 70 N 0.67 0.16 0.59 2.33 1.57 -1.62 -3.14 116.57 117.12 1j3d h LYS 70 Ca 0.18 -0.27 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1j3d h LYS 70 Cb -0.07 0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.35 1j3d h LYS 70 CO -0.04 0.91 -0.28 -0.44 -0.57 0.00 0.00 179.45 179.03 1j3d h ASP 71 N 0.04 -0.67 -0.81 0.86 3.32 -0.31 -2.62 116.42 116.24 1j3d h ASP 71 Ca -0.34 -0.02 0.08 0.00 0.02 0.00 0.00 57.03 56.78 1j3d h ASP 71 Cb 2.02 0.17 -0.07 0.00 0.22 0.00 0.00 39.33 41.68 1j3d h ASP 71 CO 0.10 -0.40 0.47 0.40 -1.72 0.00 0.00 179.24 178.09 1j3d h ILE 72 N -0.90 0.94 0.16 0.35 1.08 -0.50 -0.59 117.51 118.05 1j3d h ILE 72 Ca -0.08 -0.28 0.01 0.00 -0.39 0.00 0.00 64.86 64.13 1j3d h ILE 72 Cb 0.64 0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 1j3d h ILE 72 CO 0.13 0.15 -0.31 0.00 -0.69 0.00 0.00 178.15 177.43 1j3d h ALA 73 N 1.43 -0.55 -0.12 1.87 0.00 -1.47 0.92 119.26 121.34 1j3d h ALA 73 Ca 0.38 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 1j3d h ALA 73 Cb 0.31 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1j3d h ALA 73 CO -0.23 -0.86 -0.36 0.00 0.00 0.00 0.00 179.25 177.81 1j3d h ALA 74 N 0.09 1.18 -0.00 0.00 0.00 -1.21 -2.61 119.26 116.70 1j3d h ALA 74 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1j3d h ALA 74 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1j3d h ALA 74 CO -0.15 0.55 -0.23 0.98 0.00 0.00 0.00 179.25 180.40 1j3d n TYR 75 N -4.07 0.00 0.05 0.00 9.36 -0.25 -4.28 117.16 117.97 1j3d n TYR 75 Ca -0.01 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.18 1j3d n TYR 75 Cb 0.44 -0.33 -0.01 0.00 -0.63 0.00 0.00 39.34 38.80 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 0.13 -0.14 -3.73 2.98 2.43 0.13 -3.44 114.38 112.74 1j3d h ARG 76 Ca 0.00 0.01 -0.55 0.00 -0.81 0.00 0.00 59.98 58.63 1j3d h ARG 76 Cb 0.47 0.03 -0.40 0.00 -0.42 0.00 0.00 29.97 29.66 1j3d h ARG 76 CO 0.00 -0.09 -0.77 0.00 -1.51 0.00 0.00 179.97 177.60 1j3d s ALA 77 N -3.28 1.33 0.00 2.80 0.00 -1.25 -5.11 121.76 116.26 1j3d s ALA 77 Ca -0.02 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1j3d s ALA 77 Cb 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1j3d s ALA 77 CO 0.06 -1.29 0.00 1.17 0.00 0.00 0.00 175.76 175.71