#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 2.21 -0.34 2.12 1.02 -1.26 -4.96 119.74 118.53 1j3d s LYS 2 Ca 0.00 -1.10 0.12 0.00 0.02 0.00 0.00 55.97 55.00 1j3d s LYS 2 Cb 0.00 -2.49 0.46 0.00 -0.52 0.00 0.00 37.83 35.28 1j3d s LYS 2 CO 0.00 -0.97 1.10 1.17 -0.92 0.00 0.00 175.35 175.73 1j3d n LYS 3 N -2.46 2.69 -1.30 1.68 3.00 -1.26 -5.11 118.16 115.40 1j3d n LYS 3 Ca 0.12 -3.96 0.15 0.00 -0.00 0.00 0.00 58.31 54.63 1j3d n LYS 3 Cb 0.60 -1.93 -0.06 0.00 0.00 0.00 0.00 35.03 33.64 1j3d n LYS 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1j3d n ASP 4 N -0.49 -7.19 0.07 3.14 9.92 -1.26 -3.29 116.55 117.45 1j3d n ASP 4 Ca 0.28 0.92 -0.19 0.00 -0.53 0.00 0.00 54.79 55.27 1j3d n ASP 4 Cb 0.81 -4.23 -0.10 0.00 -0.64 0.00 0.00 41.12 36.97 1j3d n ASP 4 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1j3d h PRO 5 N -1.35 0.58 -0.85 -0.24 0.13 -1.99 -3.28 132.00 125.00 1j3d h PRO 5 Ca -0.09 -0.68 0.01 0.00 -0.87 0.00 0.00 66.00 64.37 1j3d h PRO 5 Cb 1.30 0.20 -0.04 0.00 0.13 0.00 0.00 31.00 32.59 1j3d h PRO 5 CO 0.04 1.28 0.55 -0.91 -0.23 0.00 0.00 178.00 178.73 1j3d h ASN 6 N 0.30 0.98 -3.43 1.44 -0.26 -2.06 -3.42 115.58 109.13 1j3d h ASN 6 Ca -0.13 -0.03 -0.50 0.00 -0.56 0.00 0.00 56.30 55.08 1j3d h ASN 6 Cb 1.74 -0.25 0.01 0.00 -1.06 0.00 0.00 38.32 38.77 1j3d h ASN 6 CO 0.20 0.72 0.02 0.00 -1.06 0.00 0.00 177.43 177.31 1j3d s ALA 7 N -6.10 3.47 0.74 -0.83 0.00 -1.21 -5.08 121.76 112.76 1j3d s ALA 7 Ca -0.13 -0.48 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 1j3d s ALA 7 Cb 0.16 -2.50 0.06 0.00 0.00 0.00 0.00 23.12 20.84 1j3d s ALA 7 CO 0.80 -0.07 1.09 -1.25 0.00 0.00 0.00 175.76 176.32 1j3d s PRO 8 N -4.14 2.28 0.37 0.00 0.04 -1.26 -4.64 135.00 127.64 1j3d s PRO 8 Ca 0.47 0.04 0.03 0.00 0.04 0.00 0.00 61.00 61.58 1j3d s PRO 8 Cb -0.10 -2.06 0.03 0.00 0.04 0.00 0.00 34.50 32.40 1j3d s PRO 8 CO 0.36 -1.30 0.24 1.63 0.04 0.00 0.00 177.00 177.97 1j3d n LYS 9 N -3.07 0.97 -1.65 4.56 4.01 -1.26 -4.61 118.16 117.12 1j3d n LYS 9 Ca 0.07 -2.33 -0.38 0.00 -0.51 0.00 0.00 58.31 55.17 1j3d n LYS 9 Cb 0.60 0.30 0.05 0.00 -0.51 0.00 0.00 35.03 35.47 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 -1.30 1.01 -1.79 1.97 1.74 -1.26 -4.95 116.66 112.07 1j3d n ARG 10 Ca -0.03 0.39 -0.32 0.00 -0.77 0.00 0.00 57.85 57.12 1j3d n ARG 10 Cb 0.42 -2.27 0.04 0.00 -1.02 0.00 0.00 32.46 29.63 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 -2.88 2.96 0.87 5.56 0.04 -1.26 -5.04 135.00 135.25 1j3d s PRO 11 Ca 0.77 1.24 -0.15 0.00 0.04 0.00 0.00 61.00 62.90 1j3d s PRO 11 Cb -0.41 -1.98 0.21 0.00 0.04 0.00 0.00 34.50 32.36 1j3d s PRO 11 CO 0.46 -1.10 0.91 -0.35 0.04 0.00 0.00 177.00 176.95 1j3d n PRO 12 N -2.48 -2.05 -4.20 0.56 -0.04 -1.26 -5.02 135.00 120.51 1j3d n PRO 12 Ca 0.09 -1.43 -0.12 0.00 -0.04 0.00 0.00 63.50 62.01 1j3d n PRO 12 Cb 0.53 -1.18 -0.10 0.00 -0.04 0.00 0.00 33.50 32.70 1j3d n PRO 12 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1j3d s SER 13 N -4.12 0.32 0.27 3.54 0.01 -1.26 -4.80 113.70 107.66 1j3d s SER 13 Ca 0.56 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.48 1j3d s SER 13 Cb -0.04 0.33 0.54 0.00 0.21 0.00 0.00 66.02 67.07 1j3d s SER 13 CO 0.41 -0.80 1.80 0.00 0.41 0.00 0.00 173.24 175.07 1j3d h ALA 14 N 2.65 1.40 0.00 1.44 0.00 -1.89 0.24 119.26 123.11 1j3d h ALA 14 Ca -0.36 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1j3d h ALA 14 Cb 1.24 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1j3d h ALA 14 CO 0.55 0.07 -0.01 0.35 0.00 0.00 0.00 179.25 180.22 1j3d h PHE 15 N 0.82 0.00 0.00 0.00 3.57 -1.96 -3.14 116.94 116.23 1j3d h PHE 15 Ca 0.48 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.84 1j3d h PHE 15 Cb 0.57 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1j3d h PHE 15 CO -0.04 0.01 -0.67 0.35 -2.23 0.00 0.00 178.31 175.73 1j3d h PHE 16 N 0.00 0.00 0.00 0.41 3.57 -1.33 -2.68 116.94 116.91 1j3d h PHE 16 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1j3d h PHE 16 Cb 0.70 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.44 1j3d h PHE 16 CO 0.00 0.67 0.00 1.28 -2.23 0.00 0.00 178.31 178.03 1j3d n LEU 17 N -3.72 0.27 -0.28 0.59 7.99 -1.15 -0.75 117.00 119.94 1j3d n LEU 17 Ca -0.01 0.68 -0.01 0.00 -0.01 0.00 0.00 56.01 56.66 1j3d n LEU 17 Cb 0.66 -0.40 0.03 0.00 -0.11 0.00 0.00 43.42 43.60 1j3d n LEU 17 CO 0.43 -0.40 0.43 0.33 -1.51 0.00 0.00 177.39 176.66 1j3d n PHE 18 N -1.70 0.01 -0.16 -1.77 7.35 -1.24 0.80 117.46 120.74 1j3d n PHE 18 Ca 0.00 0.90 -0.10 0.00 -0.76 0.00 0.00 57.45 57.49 1j3d n PHE 18 Cb 0.00 -0.76 -0.00 0.00 0.35 0.00 0.00 39.48 39.07 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 0.69 0.00 0.00 0.00 0.87 0.26 0.87 113.55 116.24 1j3d h SER 20 Ca 0.13 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 1j3d h SER 20 Cb 0.52 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1j3d h SER 20 CO 0.03 0.00 -1.97 -1.84 -0.53 0.00 0.00 176.83 172.52 1j3d n GLU 21 N -3.74 0.64 0.01 2.24 0.28 -0.46 -4.49 120.64 115.12 1j3d n GLU 21 Ca -0.00 -0.18 -0.19 0.00 -0.16 0.00 0.00 57.16 56.63 1j3d n GLU 21 Cb 0.24 -1.49 -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 0.42 -0.89 -1.84 3.86 -0.41 -3.38 115.15 112.92 1j3d h HIS 22 Ca -0.03 -0.31 0.18 0.00 -1.16 0.00 0.00 60.37 59.05 1j3d h HIS 22 Cb 1.02 -0.02 -0.17 0.00 1.06 0.00 0.00 27.41 29.30 1j3d h HIS 22 CO 0.00 1.62 -0.22 -0.09 0.86 0.00 0.00 177.93 180.10 1j3d h ARG 23 N 0.06 0.00 0.00 2.45 2.43 -1.08 0.88 114.38 119.12 1j3d h ARG 23 Ca -0.38 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.76 1j3d h ARG 23 Cb 2.04 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.58 1j3d h ARG 23 CO 0.10 0.00 -0.14 -1.00 -1.51 0.00 0.00 179.97 177.42 1j3d h PRO 24 N 0.00 0.00 -0.00 0.20 0.13 -1.82 -2.84 132.00 127.67 1j3d h PRO 24 Ca 0.43 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 65.32 1j3d h PRO 24 Cb 0.65 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.78 1j3d h PRO 24 CO -0.91 0.14 -0.96 -0.22 -0.23 0.00 0.00 178.00 175.82 1j3d h LYS 25 N 0.00 0.47 0.00 0.86 1.63 0.53 -3.05 116.57 117.01 1j3d h LYS 25 Ca -0.00 -0.50 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 1j3d h LYS 25 Cb 0.59 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1j3d h LYS 25 CO 0.02 1.15 0.00 -0.89 -3.45 0.00 0.00 179.45 176.28 1j3d n ILE 26 N -3.77 0.81 0.21 2.00 2.08 -0.21 -2.64 119.36 117.84 1j3d n ILE 26 Ca -0.07 0.20 0.11 0.00 0.56 0.00 0.00 62.75 63.54 1j3d n ILE 26 Cb 0.84 -0.92 0.20 0.00 -0.75 0.00 0.00 39.64 39.01 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 0.10 0.38 1.57 -1.46 -2.51 116.57 114.65 1j3d h LYS 27 Ca 0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1j3d h LYS 27 Cb 0.31 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.64 1j3d h LYS 27 CO 0.00 0.08 -1.04 1.03 -0.57 0.00 0.00 179.45 178.94 1j3d h SER 28 N 0.00 0.74 -0.32 0.86 0.87 -1.64 -3.28 113.55 110.78 1j3d h SER 28 Ca -0.00 -0.83 0.00 0.00 -1.23 0.00 0.00 61.79 59.73 1j3d h SER 28 Cb 1.01 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 1j3d h SER 28 CO 0.01 1.50 0.00 -0.62 -0.53 0.00 0.00 176.83 177.19 1j3d n GLU 29 N -3.94 2.08 -3.04 2.24 -0.58 -1.24 -4.59 120.64 111.57 1j3d n GLU 29 Ca -0.13 -1.64 -0.14 0.00 -0.42 0.00 0.00 57.16 54.83 1j3d n GLU 29 Cb 0.90 -1.43 -0.04 0.00 -0.57 0.00 0.00 31.44 30.30 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 -1.59 -0.50 -0.40 -0.32 3.76 -0.95 -5.09 115.29 110.20 1j3d s HIS 30 Ca 0.34 -1.26 -0.28 0.00 -0.15 0.00 0.00 55.06 53.72 1j3d s HIS 30 Cb 0.19 -0.20 -0.03 0.00 1.11 0.00 0.00 32.58 33.66 1j3d s HIS 30 CO 0.27 -1.09 1.92 -1.25 -0.85 0.00 0.00 174.74 173.74 1j3d s PRO 31 N 0.59 3.03 0.00 8.40 0.04 -1.25 -1.71 135.00 144.09 1j3d s PRO 31 Ca 0.30 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.64 1j3d s PRO 31 Cb 0.01 -4.30 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1j3d s PRO 31 CO -0.11 -2.23 0.00 0.41 0.04 0.00 0.00 177.00 175.11 1j3d n GLY 32 N 5.58 2.23 3.72 0.56 0.00 -1.26 -5.07 105.19 110.95 1j3d n GLY 32 Ca 0.24 0.00 -0.61 0.00 0.00 0.00 0.00 46.02 45.65 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 1.93 0.00 0.99 -0.00 -0.70 -4.95 117.00 114.27 1j3d n LEU 33 Ca 0.00 1.12 0.00 0.00 -0.00 0.00 0.00 56.01 57.13 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 -0.60 0.00 -1.54 -0.00 0.00 0.00 177.39 175.25 1j3d n SER 34 N 4.81 0.00 -0.98 1.96 3.41 -1.26 -4.95 113.62 116.61 1j3d n SER 34 Ca 0.28 -0.55 0.04 0.00 -0.26 0.00 0.00 58.87 58.38 1j3d n SER 34 Cb 0.06 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.19 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 -0.97 1.02 -0.07 -1.33 2.08 -1.26 -3.90 119.36 114.94 1j3d n ILE 35 Ca 0.00 -0.60 -0.06 0.00 0.56 0.00 0.00 62.75 62.65 1j3d n ILE 35 Cb 0.00 -0.16 -0.02 0.00 -0.75 0.00 0.00 39.64 38.72 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 0.59 -0.71 0.07 7.39 0.00 -1.26 -3.53 105.19 107.75 1j3d n GLY 36 Ca 0.13 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.82 0.09 -0.98 1.61 3.32 -1.97 -1.55 116.42 116.12 1j3d h ASP 37 Ca 0.00 -0.23 0.05 0.00 0.02 0.00 0.00 57.03 56.87 1j3d h ASP 37 Cb 0.62 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.08 1j3d h ASP 37 CO 0.00 0.29 0.64 0.74 -1.72 0.00 0.00 179.24 179.19 1j3d h THR 38 N -0.12 1.14 -0.15 0.35 2.02 -1.81 0.29 112.91 114.63 1j3d h THR 38 Ca 0.02 -0.41 -0.08 0.00 0.77 0.00 0.00 66.41 66.70 1j3d h THR 38 Cb 0.24 -0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 1j3d h THR 38 CO 0.00 0.22 -0.27 0.00 0.37 0.00 0.00 175.52 175.84 1j3d h ALA 39 N 1.41 1.27 0.00 6.16 0.00 -1.56 0.14 119.26 126.69 1j3d h ALA 39 Ca 0.40 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1j3d h ALA 39 Cb 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1j3d h ALA 39 CO -0.14 0.49 -0.74 0.87 0.00 0.00 0.00 179.25 179.73 1j3d h LYS 40 N 0.24 0.00 0.00 0.00 1.57 -0.17 -2.64 116.57 115.57 1j3d h LYS 40 Ca 0.04 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1j3d h LYS 40 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1j3d h LYS 40 CO 0.04 0.74 -0.99 -0.22 -0.57 0.00 0.00 179.45 178.45 1j3d h LYS 41 N 0.00 0.00 0.00 3.15 3.64 -0.60 -3.29 116.57 119.48 1j3d h LYS 41 Ca -0.01 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1j3d h LYS 41 Cb 1.41 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.23 1j3d h LYS 41 CO 0.10 0.09 -0.14 -0.07 -2.27 0.00 0.00 179.45 177.16 1j3d h LEU 42 N 0.00 0.00 -1.95 5.20 4.07 -0.74 -2.95 115.31 118.95 1j3d h LEU 42 Ca -0.04 -0.07 0.19 0.00 0.08 0.00 0.00 57.88 58.05 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 0.01 0.61 0.57 1.23 -1.08 0.00 0.00 178.44 179.78 1j3d h GLY 43 N -1.00 0.00 0.99 0.83 0.00 -1.67 1.00 103.07 103.21 1j3d h GLY 43 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.15 1j3d h GLY 43 CO -0.00 0.00 -0.61 -2.09 0.00 0.00 0.00 176.54 173.84 1j3d h GLU 44 N 0.00 0.62 -0.04 4.80 4.22 -1.66 -2.94 114.58 119.57 1j3d h GLU 44 Ca 0.32 -0.51 -0.24 0.00 0.08 0.00 0.00 59.36 59.01 1j3d h GLU 44 Cb 1.45 0.11 0.02 0.00 0.50 0.00 0.00 28.75 30.82 1j3d h GLU 44 CO -0.00 1.13 -0.89 0.52 -2.18 0.00 0.00 179.01 177.58 1j3d h MET 45 N 0.27 0.68 -0.81 1.92 2.86 -0.07 -3.24 114.93 116.54 1j3d h MET 45 Ca -0.04 -0.67 0.16 0.00 -2.06 0.00 0.00 59.70 57.08 1j3d h MET 45 Cb 1.25 0.18 -0.10 0.00 0.06 0.00 0.00 31.60 32.99 1j3d h MET 45 CO 0.13 1.27 0.35 2.35 1.06 0.00 0.00 176.91 182.07 1j3d h TRP 46 N 0.35 0.60 0.00 -0.22 -0.00 0.73 0.82 115.95 118.23 1j3d h TRP 46 Ca -0.10 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.83 1j3d h TRP 46 Cb 1.55 -0.14 0.00 0.00 -0.00 0.00 0.00 29.16 30.57 1j3d h TRP 46 CO 0.11 0.06 0.00 0.45 -0.00 0.00 0.00 178.44 179.06 1j3d n SER 47 N -4.98 0.00 -0.02 2.65 2.88 -1.11 -2.57 113.62 110.47 1j3d n SER 47 Ca 0.17 -0.27 0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1j3d n SER 47 Cb 0.48 -0.16 -0.05 0.00 -0.75 0.00 0.00 64.21 63.73 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 -1.16 3.59 -2.37 -1.46 -0.58 0.27 -5.00 120.64 113.94 1j3d n GLU 48 Ca 0.12 -0.06 -0.36 0.00 -0.42 0.00 0.00 57.16 56.44 1j3d n GLU 48 Cb 0.12 -0.98 -0.02 0.00 -0.57 0.00 0.00 31.44 29.99 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 -1.88 3.82 0.00 3.49 1.11 -0.54 -5.05 119.66 120.62 1j3d s GLN 49 Ca 0.04 1.63 0.00 0.00 0.01 0.00 0.00 55.36 57.05 1j3d s GLN 49 Cb 0.08 -2.35 0.00 0.00 -1.01 0.00 0.00 33.01 29.72 1j3d s GLN 49 CO 0.39 -0.47 0.00 -1.13 0.01 0.00 0.00 175.29 174.09 1j3d n SER 50 N -0.54 0.00 0.03 5.90 3.41 -1.26 -4.85 113.62 116.31 1j3d n SER 50 Ca 0.07 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.78 1j3d n SER 50 Cb 0.49 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.84 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 1.79 -0.05 7.33 0.00 -1.26 -3.17 120.51 122.15 1j3d n ALA 51 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 1j3d n ALA 51 Cb 0.00 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.07 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 -2.22 0.00 3.64 -2.01 -3.23 116.57 113.10 1j3d h LYS 52 Ca 0.00 -0.19 -0.57 0.00 -1.27 0.00 0.00 60.65 58.63 1j3d h LYS 52 Cb 0.33 0.01 -0.42 0.00 -0.41 0.00 0.00 32.23 31.74 1j3d h LYS 52 CO 0.00 0.74 -0.76 -0.25 -2.27 0.00 0.00 179.45 176.91 1j3d n ASP 53 N -4.56 3.74 0.00 4.20 9.92 -1.20 -4.72 116.55 123.93 1j3d n ASP 53 Ca -0.06 -3.55 0.00 0.00 -0.53 0.00 0.00 54.79 50.65 1j3d n ASP 53 Cb 0.36 -0.57 0.00 0.00 -0.64 0.00 0.00 41.12 40.27 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 -0.14 0.00 0.04 -1.24 4.81 -1.19 -4.68 118.16 115.75 1j3d n LYS 54 Ca 0.30 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.62 1j3d n LYS 54 Cb 0.45 0.00 -0.09 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 -0.14 0.00 1.64 1.08 -1.73 -3.17 115.11 112.79 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 0.32 0.00 -0.35 -0.95 0.00 0.00 178.83 177.85 1j3d n PRO 56 N -4.91 0.30 0.01 1.46 -0.04 -1.26 -3.13 135.00 127.43 1j3d n PRO 56 Ca -0.08 0.09 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1j3d n PRO 56 Cb 0.27 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.09 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 0.21 0.00 0.54 0.05 -1.91 -3.22 116.97 112.65 1j3d h TYR 57 Ca 0.00 -0.16 -0.00 0.00 0.05 0.00 0.00 58.73 58.62 1j3d h TYR 57 Cb 0.19 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 1j3d h TYR 57 CO 0.00 1.26 -0.01 0.93 -1.05 0.00 0.00 178.16 179.29 1j3d h GLU 58 N 0.03 0.00 0.00 4.88 5.08 -1.52 -3.06 114.58 120.00 1j3d h GLU 58 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1j3d h GLU 58 Cb 2.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.25 1j3d h GLU 58 CO 0.10 0.01 -0.39 1.04 -1.00 0.00 0.00 179.01 178.78 1j3d n GLN 59 N -3.10 0.05 0.02 2.33 6.02 -1.21 -1.04 117.38 120.44 1j3d n GLN 59 Ca 0.04 0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 56.97 1j3d n GLN 59 Cb 0.53 -1.54 -0.13 0.00 1.02 0.00 0.00 30.24 30.13 1j3d n GLN 59 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1j3d h LYS 60 N 0.00 0.01 0.00 -1.09 3.64 -1.54 -3.30 116.57 114.29 1j3d h LYS 60 Ca 0.00 -0.01 -0.25 0.00 -1.27 0.00 0.00 60.65 59.12 1j3d h LYS 60 Cb 0.54 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 1j3d h LYS 60 CO 0.00 0.75 -2.08 0.00 -2.27 0.00 0.00 179.45 175.84 1j3d n ALA 61 N -2.46 1.86 -0.33 5.00 0.00 -1.21 -3.90 120.51 119.47 1j3d n ALA 61 Ca -0.09 -0.98 -0.01 0.00 0.00 0.00 0.00 53.44 52.37 1j3d n ALA 61 Cb 1.00 -0.49 0.12 0.00 0.00 0.00 0.00 19.45 20.08 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 1.29 1.20 0.29 0.00 0.00 -1.22 -0.80 119.26 120.03 1j3d h ALA 62 Ca -0.34 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1j3d h ALA 62 Cb 1.84 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1j3d h ALA 62 CO 0.03 0.43 -0.14 -0.22 0.00 0.00 0.00 179.25 179.36 1j3d h LYS 63 N 1.13 -0.37 -1.06 0.00 3.64 -1.74 -2.85 116.57 115.31 1j3d h LYS 63 Ca 0.36 0.03 0.31 0.00 -1.27 0.00 0.00 60.65 60.08 1j3d h LYS 63 Cb 0.02 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 1j3d h LYS 63 CO -0.12 -0.03 0.87 -0.07 -2.27 0.00 0.00 179.45 177.83 1j3d h LEU 64 N -0.91 0.00 0.02 5.20 -0.00 -1.63 0.41 115.31 118.41 1j3d h LEU 64 Ca -0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1j3d h LEU 64 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1j3d h LEU 64 CO 0.06 0.00 -0.01 0.50 -0.00 0.00 0.00 178.44 178.99 1j3d h LYS 65 N 0.00 -0.03 -0.07 1.13 3.64 -1.04 -1.93 116.57 118.27 1j3d h LYS 65 Ca 0.51 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.87 1j3d h LYS 65 Cb 2.24 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 34.06 1j3d h LYS 65 CO -0.01 0.56 -0.02 1.49 -2.27 0.00 0.00 179.45 179.21 1j3d h GLU 66 N -0.65 0.10 0.00 1.90 4.81 -0.07 -0.95 114.58 119.72 1j3d h GLU 66 Ca -0.00 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1j3d h GLU 66 Cb 0.61 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 1j3d h GLU 66 CO 0.00 0.13 -0.08 0.87 -0.73 0.00 0.00 179.01 179.20 1j3d h LYS 67 N 0.10 0.00 -0.19 1.92 1.79 -0.81 -3.16 116.57 116.22 1j3d h LYS 67 Ca 0.02 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.40 1j3d h LYS 67 Cb 0.10 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1j3d h LYS 67 CO 0.00 0.08 -0.31 -0.92 -1.08 0.00 0.00 179.45 177.23 1j3d h TYR 68 N 0.00 0.42 -0.67 -1.35 3.20 -0.34 -0.50 116.97 117.72 1j3d h TYR 68 Ca -0.00 -0.09 0.01 0.00 3.14 0.00 0.00 58.73 61.79 1j3d h TYR 68 Cb 0.93 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.07 1j3d h TYR 68 CO 0.00 0.64 0.44 0.93 -1.64 0.00 0.00 178.16 178.53 1j3d h GLU 69 N 0.32 0.86 0.11 1.82 5.08 -1.54 0.51 114.58 121.74 1j3d h GLU 69 Ca 0.04 -0.05 -0.28 0.00 -1.00 0.00 0.00 59.36 58.07 1j3d h GLU 69 Cb 0.70 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1j3d h GLU 69 CO 0.05 0.57 -1.33 0.87 -1.00 0.00 0.00 179.01 178.17 1j3d h LYS 70 N 0.88 0.24 0.17 2.33 1.57 -1.67 -1.99 116.57 118.10 1j3d h LYS 70 Ca 0.25 -0.41 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1j3d h LYS 70 Cb -0.07 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1j3d h LYS 70 CO -0.07 1.15 -0.08 -0.44 -0.57 0.00 0.00 179.45 179.44 1j3d h ASP 71 N 0.07 -0.20 0.01 0.86 3.32 -0.79 -2.46 116.42 117.23 1j3d h ASP 71 Ca -0.16 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 56.70 1j3d h ASP 71 Cb 1.98 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 41.56 1j3d h ASP 71 CO 0.18 -0.00 -0.17 0.40 -1.72 0.00 0.00 179.24 177.93 1j3d h ILE 72 N -0.39 1.21 -0.43 0.35 1.08 -0.09 -2.90 117.51 116.34 1j3d h ILE 72 Ca -0.02 -0.97 0.05 0.00 -0.39 0.00 0.00 64.86 63.53 1j3d h ILE 72 Cb 0.30 1.27 -0.04 0.00 -3.07 0.00 0.00 36.82 35.28 1j3d h ILE 72 CO 0.04 0.30 0.18 0.00 -0.69 0.00 0.00 178.15 177.98 1j3d h ALA 73 N 1.54 0.52 0.00 1.87 0.00 -0.98 1.02 119.26 123.24 1j3d h ALA 73 Ca 0.05 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1j3d h ALA 73 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1j3d h ALA 73 CO 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.08 1j3d h ALA 74 N 1.26 1.00 -0.00 0.00 0.00 -1.25 -2.62 119.26 117.65 1j3d h ALA 74 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1j3d h ALA 74 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1j3d h ALA 74 CO -0.17 0.00 -0.64 0.98 0.00 0.00 0.00 179.25 179.42 1j3d n TYR 75 N -2.60 0.00 0.19 0.00 4.19 -0.25 -4.28 117.16 114.42 1j3d n TYR 75 Ca 0.01 0.00 -0.09 0.00 3.31 0.00 0.00 57.90 61.14 1j3d n TYR 75 Cb 0.25 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 40.04 1j3d n TYR 75 CO 0.00 0.00 0.00 -0.09 0.91 0.00 0.00 176.86 177.68 1j3d h ARG 76 N 0.45 -0.55 0.00 2.98 2.43 0.14 -3.39 114.38 116.44 1j3d h ARG 76 Ca 0.00 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1j3d h ARG 76 Cb 0.41 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1j3d h ARG 76 CO 0.00 -0.36 0.00 0.00 -1.51 0.00 0.00 179.97 178.10 1j3d n ALA 77 N -2.74 -0.22 1.95 2.80 0.00 -1.24 -5.10 120.51 115.95 1j3d n ALA 77 Ca -0.07 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.52 1j3d n ALA 77 Cb 0.23 0.00 0.92 0.00 0.00 0.00 0.00 19.45 20.60 1j3d n ALA 77 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67