#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 3.33 -1.06 0.03 1.02 -1.26 -4.35 119.74 117.45 1j3d s LYS 2 Ca 0.00 -0.54 -0.14 0.00 0.02 0.00 0.00 55.97 55.31 1j3d s LYS 2 Cb 0.00 -2.70 -0.02 0.00 -0.52 0.00 0.00 37.83 34.58 1j3d s LYS 2 CO 0.00 0.09 0.81 1.17 -0.92 0.00 0.00 175.35 176.50 1j3d n LYS 3 N -1.76 -1.50 0.03 1.68 4.81 -1.26 -4.75 118.16 115.40 1j3d n LYS 3 Ca -0.04 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1j3d n LYS 3 Cb 0.57 -4.62 0.00 0.00 0.02 0.00 0.00 35.03 31.00 1j3d n LYS 3 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1j3d n ASP 4 N -2.72 -0.55 -4.56 3.14 8.00 -1.26 -4.96 116.55 113.64 1j3d n ASP 4 Ca -0.09 0.53 -0.35 0.00 0.71 0.00 0.00 54.79 55.59 1j3d n ASP 4 Cb 0.59 0.92 -0.04 0.00 -0.02 0.00 0.00 41.12 42.58 1j3d n ASP 4 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1j3d s PRO 5 N -2.00 2.82 -1.19 -0.24 0.04 -1.26 -3.77 135.00 129.40 1j3d s PRO 5 Ca 0.00 -0.12 -0.01 0.00 0.04 0.00 0.00 61.00 60.91 1j3d s PRO 5 Cb 0.00 -4.77 0.01 0.00 0.04 0.00 0.00 34.50 29.78 1j3d s PRO 5 CO 0.00 -2.82 0.10 0.09 0.04 0.00 0.00 177.00 174.40 1j3d n ASN 6 N 12.19 -4.23 -4.94 6.66 3.02 -1.26 -4.95 115.26 121.74 1j3d n ASN 6 Ca 0.28 0.07 -0.20 0.00 -0.03 0.00 0.00 54.58 54.70 1j3d n ASN 6 Cb 0.50 -3.56 -0.02 0.00 -0.61 0.00 0.00 39.78 36.09 1j3d n ASN 6 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j3d s ALA 7 N -2.73 4.07 0.26 5.41 0.00 -1.25 -5.08 121.76 122.43 1j3d s ALA 7 Ca 0.07 -1.50 -0.30 0.00 0.00 0.00 0.00 51.96 50.23 1j3d s ALA 7 Cb -0.03 -1.52 -0.09 0.00 0.00 0.00 0.00 23.12 21.48 1j3d s ALA 7 CO 0.08 0.01 1.03 -1.25 0.00 0.00 0.00 175.76 175.64 1j3d s PRO 8 N -4.09 4.73 1.13 0.00 0.04 -1.26 -4.65 135.00 130.90 1j3d s PRO 8 Ca 0.42 1.66 -0.15 0.00 0.04 0.00 0.00 61.00 62.98 1j3d s PRO 8 Cb -0.08 -3.23 0.25 0.00 0.04 0.00 0.00 34.50 31.48 1j3d s PRO 8 CO 0.29 0.34 1.06 0.15 0.04 0.00 0.00 177.00 178.88 1j3d s LYS 9 N -1.26 -0.62 0.52 4.56 1.02 -1.26 -4.83 119.74 117.88 1j3d s LYS 9 Ca 0.43 0.46 -0.22 0.00 0.02 0.00 0.00 55.97 56.66 1j3d s LYS 9 Cb -0.29 -1.62 -0.06 0.00 -0.52 0.00 0.00 37.83 35.34 1j3d s LYS 9 CO 0.37 -3.42 1.30 2.89 -0.92 0.00 0.00 175.35 175.56 1j3d n ARG 10 N -4.65 1.66 -2.75 1.68 1.85 -1.26 -4.94 116.66 108.25 1j3d n ARG 10 Ca 0.06 0.61 -0.42 0.00 -1.00 0.00 0.00 57.85 57.10 1j3d n ARG 10 Cb 0.57 -2.49 -0.04 0.00 -1.05 0.00 0.00 32.46 29.46 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 -2.72 4.58 0.00 2.89 0.04 -1.26 -5.05 135.00 133.48 1j3d s PRO 11 Ca 0.70 1.38 0.00 0.00 0.04 0.00 0.00 61.00 63.11 1j3d s PRO 11 Cb -0.44 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.67 1j3d s PRO 11 CO 0.51 0.03 0.00 -0.35 0.04 0.00 0.00 177.00 177.23 1j3d n PRO 12 N 3.59 -0.77 -2.47 0.56 -0.04 -1.26 -4.99 135.00 129.63 1j3d n PRO 12 Ca 0.04 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.49 1j3d n PRO 12 Cb 0.51 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.07 1j3d n PRO 12 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1j3d n SER 13 N -2.97 -1.22 0.00 3.54 3.41 -1.26 -4.76 113.62 110.36 1j3d n SER 13 Ca 0.00 -2.01 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 1j3d n SER 13 Cb 0.00 0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1j3d n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j3d n ALA 14 N -1.26 0.00 0.28 7.33 0.00 -1.26 -4.16 120.51 121.45 1j3d n ALA 14 Ca -0.15 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.47 1j3d n ALA 14 Cb 0.81 0.00 0.95 0.00 0.00 0.00 0.00 19.45 21.22 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 -1.96 -1.08 116.94 117.47 1j3d h PHE 15 Ca 0.00 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.31 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 0.00 -0.89 0.35 -2.23 0.00 0.00 178.31 175.54 1j3d h PHE 16 N 0.00 0.11 0.00 0.41 3.57 -1.95 -2.72 116.94 116.36 1j3d h PHE 16 Ca 0.03 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1j3d h PHE 16 Cb 0.22 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1j3d h PHE 16 CO 0.00 0.92 0.00 1.28 -2.23 0.00 0.00 178.31 178.28 1j3d n LEU 17 N -3.55 0.31 -0.33 0.59 4.32 -0.42 0.17 117.00 118.10 1j3d n LEU 17 Ca -0.02 0.64 -0.02 0.00 -0.02 0.00 0.00 56.01 56.59 1j3d n LEU 17 Cb 0.83 -0.24 0.01 0.00 -1.62 0.00 0.00 43.42 42.41 1j3d n LEU 17 CO 0.46 -0.24 0.48 0.33 -1.22 0.00 0.00 177.39 177.21 1j3d n PHE 18 N -1.22 -0.05 0.12 -1.77 7.35 -1.20 0.19 117.46 120.88 1j3d n PHE 18 Ca 0.00 1.05 -0.13 0.00 -0.76 0.00 0.00 57.45 57.62 1j3d n PHE 18 Cb 0.00 -0.77 -0.06 0.00 0.35 0.00 0.00 39.48 39.00 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 -0.43 0.22 0.69 0.00 0.87 0.40 -0.09 113.55 115.21 1j3d h SER 20 Ca 0.02 0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.42 1j3d h SER 20 Cb 0.44 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 1j3d h SER 20 CO -0.11 0.12 -1.42 -1.84 -0.53 0.00 0.00 176.83 173.04 1j3d n GLU 21 N -4.43 0.62 -0.81 2.24 0.28 0.23 -4.01 120.64 114.76 1j3d n GLU 21 Ca 0.12 0.23 0.07 0.00 -0.16 0.00 0.00 57.16 57.41 1j3d n GLU 21 Cb 0.54 -1.81 0.37 0.00 1.43 0.00 0.00 31.44 31.97 1j3d n GLU 21 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1j3d n HIS 22 N -2.90 1.85 0.01 -1.84 8.25 0.70 -4.49 115.22 116.80 1j3d n HIS 22 Ca -0.10 -0.79 -0.21 0.00 -0.26 0.00 0.00 57.72 56.37 1j3d n HIS 22 Cb 0.85 -0.48 -0.14 0.00 1.12 0.00 0.00 29.99 31.34 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 3.45 0.24 0.00 -0.41 2.43 -1.18 -3.29 114.38 115.62 1j3d h ARG 23 Ca 0.01 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1j3d h ARG 23 Cb 1.88 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1j3d h ARG 23 CO 0.44 1.20 0.00 -0.35 -1.51 0.00 0.00 179.97 179.75 1j3d n PRO 24 N -4.01 0.34 0.04 0.20 -0.04 -1.26 -3.25 135.00 127.01 1j3d n PRO 24 Ca -0.22 0.05 -0.18 0.00 -0.04 0.00 0.00 63.50 63.11 1j3d n PRO 24 Cb 0.86 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.68 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 0.25 0.00 0.54 1.63 -1.83 -3.32 116.57 113.85 1j3d h LYS 25 Ca 0.00 -0.43 0.00 0.00 -0.85 0.00 0.00 60.65 59.37 1j3d h LYS 25 Cb 0.25 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1j3d h LYS 25 CO 0.00 1.10 0.00 0.82 -3.45 0.00 0.00 179.45 177.92 1j3d h ILE 26 N 0.07 0.00 0.00 2.00 1.08 -1.62 -2.80 117.51 116.24 1j3d h ILE 26 Ca -0.32 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1j3d h ILE 26 Cb 2.04 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 36.98 1j3d h ILE 26 CO 0.13 0.00 -0.09 0.29 -0.69 0.00 0.00 178.15 177.80 1j3d n LYS 27 N -2.42 0.24 -0.05 2.37 5.02 -1.24 -2.76 118.16 119.33 1j3d n LYS 27 Ca 0.03 0.17 -0.14 0.00 -2.02 0.00 0.00 58.31 56.36 1j3d n LYS 27 Cb 0.29 -1.76 -0.12 0.00 -0.02 0.00 0.00 35.03 33.43 1j3d n LYS 27 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1j3d h SER 28 N 0.00 -0.00 -0.21 4.39 0.87 -1.64 -3.29 113.55 113.67 1j3d h SER 28 Ca 0.00 -0.79 0.00 0.00 -1.23 0.00 0.00 61.79 59.77 1j3d h SER 28 Cb 0.71 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1j3d h SER 28 CO 0.00 0.80 0.00 -0.62 -0.53 0.00 0.00 176.83 176.48 1j3d n GLU 29 N -4.71 1.74 -3.19 2.24 -0.58 -1.25 -4.53 120.64 110.36 1j3d n GLU 29 Ca -0.09 -1.13 -0.17 0.00 -0.42 0.00 0.00 57.16 55.35 1j3d n GLU 29 Cb 0.39 -1.37 -0.06 0.00 -0.57 0.00 0.00 31.44 29.83 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 -1.73 -0.12 0.07 -0.32 3.76 -1.11 -5.11 115.29 110.73 1j3d s HIS 30 Ca 0.30 -1.38 -0.31 0.00 -0.15 0.00 0.00 55.06 53.53 1j3d s HIS 30 Cb 0.16 -0.40 -0.08 0.00 1.11 0.00 0.00 32.58 33.38 1j3d s HIS 30 CO 0.24 -1.00 1.55 -1.25 -0.85 0.00 0.00 174.74 173.43 1j3d s PRO 31 N 0.69 4.23 0.00 8.40 0.04 -1.25 -1.94 135.00 145.18 1j3d s PRO 31 Ca 0.28 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.53 1j3d s PRO 31 Cb -0.03 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 31.01 1j3d s PRO 31 CO -0.10 -0.65 0.00 0.41 0.04 0.00 0.00 177.00 176.70 1j3d n GLY 32 N 3.83 2.37 3.54 0.56 0.00 -1.26 -4.99 105.19 109.25 1j3d n GLY 32 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 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 1.70 0.00 0.99 -0.00 -0.82 -4.92 117.00 113.95 1j3d n LEU 33 Ca 0.00 -0.72 -0.25 0.00 -0.00 0.00 0.00 56.01 55.04 1j3d n LEU 33 Cb 0.00 -1.47 0.23 0.00 -0.00 0.00 0.00 43.42 42.19 1j3d n LEU 33 CO 0.00 -1.78 0.37 -1.54 -0.00 0.00 0.00 177.39 174.43 1j3d n SER 34 N 15.50 -3.18 0.00 1.96 3.41 -1.26 -4.79 113.62 125.26 1j3d n SER 34 Ca 0.45 -0.85 0.10 0.00 -0.26 0.00 0.00 58.87 58.31 1j3d n SER 34 Cb 0.43 -0.84 0.48 0.00 -0.26 0.00 0.00 64.21 64.02 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 -5.07 0.47 0.10 -1.33 5.41 -1.26 -3.18 119.36 114.50 1j3d n ILE 35 Ca 0.12 0.12 -0.04 0.00 1.00 0.00 0.00 62.75 63.95 1j3d n ILE 35 Cb 0.50 -0.78 -0.02 0.00 -0.71 0.00 0.00 39.64 38.63 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 3.34 -0.27 1.14 7.39 0.00 -1.99 0.11 103.07 112.80 1j3d h GLY 36 Ca 0.00 0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 1j3d h GLY 36 CO 0.00 -0.10 0.02 -0.55 0.00 0.00 0.00 176.54 175.91 1j3d h ASP 37 N -0.29 1.00 -0.27 0.19 3.32 -1.93 -2.43 116.42 116.02 1j3d h ASP 37 Ca -0.03 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 56.77 1j3d h ASP 37 Cb 0.20 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1j3d h ASP 37 CO 0.04 1.04 0.18 0.74 -1.72 0.00 0.00 179.24 179.53 1j3d h THR 38 N 0.95 1.03 0.00 0.35 2.02 -1.60 -0.15 112.91 115.51 1j3d h THR 38 Ca 0.17 -0.10 -0.09 0.00 0.77 0.00 0.00 66.41 67.16 1j3d h THR 38 Cb 0.52 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1j3d h THR 38 CO 0.03 0.05 -0.45 0.00 0.37 0.00 0.00 175.52 175.52 1j3d h ALA 39 N 1.84 0.85 0.15 6.16 0.00 -0.28 -0.91 119.26 127.08 1j3d h ALA 39 Ca 0.11 -0.41 -0.29 0.00 0.00 0.00 0.00 54.91 54.31 1j3d h ALA 39 Cb 0.06 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1j3d h ALA 39 CO -0.02 0.57 -1.29 0.87 0.00 0.00 0.00 179.25 179.38 1j3d h LYS 40 N 0.00 0.42 0.18 0.00 1.57 -0.82 -2.90 116.57 115.01 1j3d h LYS 40 Ca -0.00 -0.65 -0.01 0.00 -1.87 0.00 0.00 60.65 58.11 1j3d h LYS 40 Cb 1.10 0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1j3d h LYS 40 CO 0.06 1.30 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.93 1j3d h LYS 41 N 0.14 -0.23 -0.43 3.15 3.64 -1.13 -2.91 116.57 118.80 1j3d h LYS 41 Ca -0.17 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.31 1j3d h LYS 41 Cb 1.99 0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 33.77 1j3d h LYS 41 CO 0.23 0.19 -0.18 -0.07 -2.27 0.00 0.00 179.45 177.34 1j3d h LEU 42 N -0.86 -0.63 -2.02 5.20 4.07 -1.29 0.24 115.31 120.03 1j3d h LEU 42 Ca -0.02 0.15 0.02 0.00 0.08 0.00 0.00 57.88 58.11 1j3d h LEU 42 Cb 0.52 0.35 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 1j3d h LEU 42 CO 0.04 -0.21 0.06 1.23 -1.08 0.00 0.00 178.44 178.47 1j3d h GLY 43 N -0.09 0.00 1.36 0.83 0.00 -1.60 1.05 103.07 104.61 1j3d h GLY 43 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.38 1j3d h GLY 43 CO -0.49 0.00 -0.48 -2.09 0.00 0.00 0.00 176.54 173.48 1j3d h GLU 44 N 0.00 0.69 0.13 4.80 4.81 -0.37 -2.35 114.58 122.29 1j3d h GLU 44 Ca 0.04 -0.40 -0.20 0.00 -0.13 0.00 0.00 59.36 58.67 1j3d h GLU 44 Cb 0.15 0.03 0.02 0.00 0.63 0.00 0.00 28.75 29.57 1j3d h GLU 44 CO -0.00 1.01 -0.90 0.52 -0.73 0.00 0.00 179.01 178.91 1j3d h MET 45 N 0.55 0.28 -0.28 1.92 2.86 0.39 -3.26 114.93 117.39 1j3d h MET 45 Ca 0.03 -0.47 0.07 0.00 -2.06 0.00 0.00 59.70 57.26 1j3d h MET 45 Cb 1.03 0.18 -0.07 0.00 0.06 0.00 0.00 31.60 32.79 1j3d h MET 45 CO 0.10 1.23 -0.24 2.35 1.06 0.00 0.00 176.91 181.41 1j3d h TRP 46 N -0.39 -0.63 0.00 -0.22 2.91 0.10 0.59 115.95 118.31 1j3d h TRP 46 Ca -0.17 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.89 1j3d h TRP 46 Cb 1.64 0.32 0.00 0.00 -0.51 0.00 0.00 29.16 30.61 1j3d h TRP 46 CO 0.19 -0.32 0.00 0.45 -1.03 0.00 0.00 178.44 177.73 1j3d n SER 47 N -5.38 0.36 -0.00 2.65 2.88 -0.89 -1.05 113.62 112.20 1j3d n SER 47 Ca -0.00 0.66 0.09 0.00 -1.33 0.00 0.00 58.87 58.29 1j3d n SER 47 Cb 0.29 -0.71 -0.12 0.00 -0.75 0.00 0.00 64.21 62.92 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 -1.98 0.56 -1.91 -1.46 -0.58 0.18 -4.96 120.64 110.50 1j3d n GLU 48 Ca -0.00 -0.05 -0.40 0.00 -0.42 0.00 0.00 57.16 56.29 1j3d n GLU 48 Cb 0.05 -1.44 0.01 0.00 -0.57 0.00 0.00 31.44 29.49 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 -2.99 3.83 0.00 3.49 -1.52 0.12 -5.01 119.66 117.57 1j3d s GLN 49 Ca 0.03 2.32 0.00 0.00 -1.95 0.00 0.00 55.36 55.76 1j3d s GLN 49 Cb 0.14 -2.72 0.00 0.00 -0.22 0.00 0.00 33.01 30.21 1j3d s GLN 49 CO 0.81 -0.66 0.00 -1.13 -0.25 0.00 0.00 175.29 174.06 1j3d n SER 50 N -0.02 0.00 -0.38 5.90 3.41 -1.26 -4.88 113.62 116.40 1j3d n SER 50 Ca 0.04 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.73 1j3d n SER 50 Cb 0.42 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.37 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 3.19 0.04 7.33 0.00 -1.26 -4.14 120.51 122.67 1j3d n ALA 51 Ca 0.00 -0.55 -0.19 0.00 0.00 0.00 0.00 53.44 52.70 1j3d n ALA 51 Cb 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 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 1.87 0.43 -2.09 0.00 3.64 -2.01 -3.26 116.57 115.15 1j3d h LYS 52 Ca 0.00 -0.56 -0.57 0.00 -1.27 0.00 0.00 60.65 58.25 1j3d h LYS 52 Cb 0.57 0.18 -0.42 0.00 -0.41 0.00 0.00 32.23 32.15 1j3d h LYS 52 CO 0.00 1.22 -0.72 -0.25 -2.27 0.00 0.00 179.45 177.42 1j3d n ASP 53 N -4.08 4.11 0.00 4.20 9.92 -1.26 -4.71 116.55 124.72 1j3d n ASP 53 Ca -0.12 -3.61 0.00 0.00 -0.53 0.00 0.00 54.79 50.53 1j3d n ASP 53 Cb 0.80 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 40.73 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 -0.24 0.00 0.16 -1.24 4.81 -1.26 -4.74 118.16 115.66 1j3d n LYS 54 Ca 0.31 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.63 1j3d n LYS 54 Cb 0.48 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.45 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 -0.43 0.00 1.64 1.08 -1.73 -2.96 115.11 112.71 1j3d h GLN 55 Ca 0.00 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1j3d h GLN 55 Cb 0.00 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1j3d h GLN 55 CO 0.00 -0.11 0.00 -0.35 -0.95 0.00 0.00 178.83 177.42 1j3d n PRO 56 N -5.12 0.37 0.03 1.46 -0.04 -1.26 -3.31 135.00 127.12 1j3d n PRO 56 Ca -0.09 0.08 -0.22 0.00 -0.04 0.00 0.00 63.50 63.22 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 0.54 0.00 0.54 -1.99 -1.89 -3.24 116.97 110.92 1j3d h TYR 57 Ca 0.00 -0.39 -0.07 0.00 2.00 0.00 0.00 58.73 60.27 1j3d h TYR 57 Cb 0.15 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 1j3d h TYR 57 CO 0.00 1.64 -0.32 1.05 -0.00 0.00 0.00 178.16 180.54 1j3d h GLU 58 N -0.11 0.00 0.05 4.88 -0.00 -1.52 -3.17 114.58 114.73 1j3d h GLU 58 Ca -0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.01 1j3d h GLU 58 Cb 1.92 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.67 1j3d h GLU 58 CO 0.10 0.32 -0.03 1.96 -0.00 0.00 0.00 179.01 181.36 1j3d h GLN 59 N 0.00 -0.07 -0.64 1.06 1.08 -1.70 -1.03 115.11 113.82 1j3d h GLN 59 Ca -0.00 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.39 1j3d h GLN 59 Cb 1.05 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.47 1j3d h GLN 59 CO 0.04 -0.05 0.74 -0.22 -0.95 0.00 0.00 178.83 178.39 1j3d h LYS 60 N -0.24 0.00 0.12 1.46 3.64 -1.70 0.16 116.57 120.01 1j3d h LYS 60 Ca -0.01 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.02 1j3d h LYS 60 Cb 0.06 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 -1.87 0.00 -2.27 0.00 0.00 179.45 175.33 1j3d h ALA 61 N 1.12 0.40 -0.49 5.00 0.00 -1.62 -3.21 119.26 120.46 1j3d h ALA 61 Ca 0.30 -1.32 0.01 0.00 0.00 0.00 0.00 54.91 53.90 1j3d h ALA 61 Cb 1.78 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 20.13 1j3d h ALA 61 CO -0.00 1.27 0.32 0.00 0.00 0.00 0.00 179.25 180.84 1j3d h ALA 62 N 0.24 0.63 0.00 0.00 0.00 0.69 0.20 119.26 121.01 1j3d h ALA 62 Ca -0.37 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1j3d h ALA 62 Cb 2.05 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1j3d h ALA 62 CO 0.11 0.04 0.00 0.36 0.00 0.00 0.00 179.25 179.77 1j3d n LYS 63 N -4.77 0.01 -0.06 0.00 2.85 -0.80 -2.68 118.16 112.71 1j3d n LYS 63 Ca 0.03 0.10 -0.14 0.00 -1.05 0.00 0.00 58.31 57.24 1j3d n LYS 63 Cb 0.04 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 32.78 1j3d n LYS 63 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1j3d n LEU 64 N -1.50 1.54 0.09 -5.58 4.77 -0.46 -3.68 117.00 112.18 1j3d n LEU 64 Ca 0.06 0.14 -0.12 0.00 -0.03 0.00 0.00 56.01 56.06 1j3d n LEU 64 Cb 0.27 -0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 40.99 1j3d n LEU 64 CO 0.22 0.65 0.48 0.50 -1.33 0.00 0.00 177.39 177.90 1j3d h LYS 65 N 0.02 -0.27 -0.04 3.23 3.64 -0.63 -2.05 116.57 120.47 1j3d h LYS 65 Ca -0.45 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 58.96 1j3d h LYS 65 Cb 2.06 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 33.93 1j3d h LYS 65 CO 0.03 0.12 0.04 1.49 -2.27 0.00 0.00 179.45 178.87 1j3d h GLU 66 N -0.79 0.00 0.00 1.90 4.81 -1.72 -1.14 114.58 117.64 1j3d h GLU 66 Ca -0.03 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.09 1j3d h GLU 66 Cb 0.51 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1j3d h GLU 66 CO 0.05 0.00 -0.73 0.87 -0.73 0.00 0.00 179.01 178.47 1j3d h LYS 67 N 0.00 0.00 -0.35 1.92 1.57 -1.62 -3.32 116.57 114.77 1j3d h LYS 67 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1j3d h LYS 67 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1j3d h LYS 67 CO -0.00 0.44 -0.14 -0.92 -0.57 0.00 0.00 179.45 178.25 1j3d h TYR 68 N 0.00 0.82 -0.60 -1.35 3.20 -0.46 0.16 116.97 118.75 1j3d h TYR 68 Ca -0.04 -0.19 0.09 0.00 3.14 0.00 0.00 58.73 61.72 1j3d h TYR 68 Cb 1.42 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 1j3d h TYR 68 CO 0.00 0.90 0.40 0.93 -1.64 0.00 0.00 178.16 178.75 1j3d h GLU 69 N 0.50 0.45 0.09 1.82 5.08 -1.63 0.70 114.58 121.59 1j3d h GLU 69 Ca 0.08 -0.03 -0.32 0.00 -1.00 0.00 0.00 59.36 58.10 1j3d h GLU 69 Cb 0.67 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1j3d h GLU 69 CO 0.05 0.30 -1.70 0.87 -1.00 0.00 0.00 179.01 177.52 1j3d h LYS 70 N 0.46 0.20 0.57 2.33 1.57 -1.64 -2.93 116.57 117.13 1j3d h LYS 70 Ca 0.27 -0.34 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1j3d h LYS 70 Cb 0.45 0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.89 1j3d h LYS 70 CO -0.08 1.00 -0.28 -0.44 -0.57 0.00 0.00 179.45 179.09 1j3d h ASP 71 N 0.05 -0.65 -0.27 0.86 5.19 0.26 -2.10 116.42 119.76 1j3d h ASP 71 Ca -0.30 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 1j3d h ASP 71 Cb 2.02 0.17 -0.01 0.00 0.18 0.00 0.00 39.33 41.69 1j3d h ASP 71 CO 0.12 -0.33 0.18 0.40 -3.12 0.00 0.00 179.24 176.49 1j3d h ILE 72 N -0.98 1.07 0.28 0.35 1.08 0.22 -0.49 117.51 119.05 1j3d h ILE 72 Ca -0.08 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.24 1j3d h ILE 72 Cb 0.65 0.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.08 1j3d h ILE 72 CO 0.13 0.07 -0.14 0.00 -0.69 0.00 0.00 178.15 177.52 1j3d h ALA 73 N 1.83 -0.38 0.00 1.87 0.00 -1.34 0.52 119.26 121.75 1j3d h ALA 73 Ca 0.10 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1j3d h ALA 73 Cb -0.04 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1j3d h ALA 73 CO -0.02 -0.61 -0.37 0.00 0.00 0.00 0.00 179.25 178.25 1j3d h ALA 74 N 0.06 1.19 0.00 0.00 0.00 -1.16 -2.61 119.26 116.74 1j3d h ALA 74 Ca -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1j3d h ALA 74 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1j3d h ALA 74 CO 0.06 0.46 -0.37 -0.92 0.00 0.00 0.00 179.25 178.48 1j3d h TYR 75 N 0.00 0.00 0.00 0.00 5.03 -0.93 -2.29 116.97 118.78 1j3d h TYR 75 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1j3d h TYR 75 Cb 0.74 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.02 1j3d h TYR 75 CO 0.00 0.00 0.00 -2.13 -1.32 0.00 0.00 178.16 174.71 1j3d n ARG 76 N -2.82 0.00 -0.06 1.82 0.63 0.18 -4.52 116.66 111.89 1j3d n ARG 76 Ca 0.03 0.50 -0.06 0.00 -0.92 0.00 0.00 57.85 57.40 1j3d n ARG 76 Cb 0.52 -1.46 -0.09 0.00 0.45 0.00 0.00 32.46 31.89 1j3d n ARG 76 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1j3d n ALA 77 N -1.99 1.71 -0.32 5.13 0.00 -1.25 -5.11 120.51 118.69 1j3d n ALA 77 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.68 1j3d n ALA 77 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1j3d n ALA 77 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67