#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j02 s ILE 3 N 0.00 1.78 0.34 0.52 -0.00 -1.26 -5.10 121.20 117.47 2j02 s ILE 3 Ca 0.00 -0.98 -0.28 0.00 -0.00 0.00 0.00 60.65 59.39 2j02 s ILE 3 Cb 0.00 -1.76 -0.12 0.00 -0.00 0.00 0.00 42.46 40.58 2j02 s ILE 3 CO 0.00 0.30 1.31 0.35 -0.00 0.00 0.00 174.94 176.90 2j02 n THR 4 N 4.66 1.91 -0.30 8.37 -2.24 -1.26 -4.74 114.28 120.67 2j02 n THR 4 Ca -0.17 -0.48 0.10 0.00 -2.27 0.00 0.00 64.05 61.23 2j02 n THR 4 Cb 0.48 -1.59 0.26 0.00 -2.10 0.00 0.00 70.33 67.37 2j02 n THR 4 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2j02 h LYS 5 N 2.73 0.52 -0.59 -0.78 1.57 -1.99 0.18 116.57 118.22 2j02 h LYS 5 Ca -0.46 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.37 2j02 h LYS 5 Cb 1.28 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 33.41 2j02 h LYS 5 CO 0.64 0.35 0.24 0.93 -0.57 0.00 0.00 179.45 181.04 2j02 h GLU 6 N 0.54 0.43 -0.07 3.15 5.08 -2.00 -0.57 114.58 121.14 2j02 h GLU 6 Ca 0.50 -0.03 -0.24 0.00 -1.00 0.00 0.00 59.36 58.60 2j02 h GLU 6 Cb 0.82 -0.10 0.02 0.00 0.50 0.00 0.00 28.75 29.98 2j02 h GLU 6 CO -0.43 0.28 -0.88 1.49 -1.00 0.00 0.00 179.01 178.48 2j02 h GLU 7 N 0.44 0.72 -0.69 2.33 4.81 -1.12 -3.05 114.58 118.02 2j02 h GLU 7 Ca 0.29 -0.68 0.11 0.00 -0.13 0.00 0.00 59.36 58.95 2j02 h GLU 7 Cb 0.31 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 2j02 h GLU 7 CO -0.26 1.27 0.28 -0.22 -0.73 0.00 0.00 179.01 179.35 2j02 h LYS 8 N 0.42 0.45 0.76 1.92 3.64 -0.43 -2.41 116.57 120.92 2j02 h LYS 8 Ca -0.09 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 2j02 h LYS 8 Cb 1.53 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.24 2j02 h LYS 8 CO 0.18 0.30 -0.48 1.96 -2.27 0.00 0.00 179.45 179.13 2j02 h GLN 9 N 0.46 -1.12 -0.52 1.90 1.08 -1.10 -2.61 115.11 113.20 2j02 h GLN 9 Ca 0.36 0.08 0.12 0.00 -1.45 0.00 0.00 58.65 57.75 2j02 h GLN 9 Cb 0.47 0.26 -0.10 0.00 -0.05 0.00 0.00 27.48 28.06 2j02 h GLN 9 CO -0.34 -0.75 -0.07 1.17 -0.95 0.00 0.00 178.83 177.89 2j02 n LYS 10 N -5.48 -0.04 0.00 1.46 3.00 -0.92 0.13 118.16 116.30 2j02 n LYS 10 Ca -0.14 0.79 0.00 0.00 -0.00 0.00 0.00 58.31 58.96 2j02 n LYS 10 Cb 0.49 -1.21 0.00 0.00 0.00 0.00 0.00 35.03 34.30 2j02 n LYS 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2j02 n VAL 11 N -4.75 0.00 -0.32 3.15 0.31 -1.01 -1.56 118.33 114.16 2j02 n VAL 11 Ca 0.10 1.49 -0.08 0.00 -0.01 0.00 0.00 64.34 65.84 2j02 n VAL 11 Cb 0.31 -2.43 -0.08 0.00 -0.91 0.00 0.00 33.84 30.74 2j02 n VAL 11 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2j02 n ILE 12 N -2.08 -0.51 0.00 2.52 5.41 0.34 0.17 119.36 125.21 2j02 n ILE 12 Ca 0.00 2.05 0.22 0.00 1.00 0.00 0.00 62.75 66.02 2j02 n ILE 12 Cb 0.00 -2.55 0.73 0.00 -0.71 0.00 0.00 39.64 37.11 2j02 n ILE 12 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2j02 h GLN 13 N 0.00 0.00 0.00 0.38 4.20 -0.95 -0.14 115.11 118.60 2j02 h GLN 13 Ca 0.12 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 2j02 h GLN 13 Cb 0.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2j02 h GLN 13 CO -0.71 0.00 -0.39 1.49 -0.67 0.00 0.00 178.83 178.55 2j02 h GLU 14 N 0.00 0.00 -0.00 1.46 4.57 0.28 -3.35 114.58 117.55 2j02 h GLU 14 Ca 0.27 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.45 2j02 h GLU 14 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2j02 h GLU 14 CO -0.00 0.39 -0.33 1.19 -1.18 0.00 0.00 179.01 179.07 2j02 n PHE 15 N -3.26 0.00 -1.68 0.92 3.01 -0.21 -5.01 117.46 111.23 2j02 n PHE 15 Ca 0.02 0.00 -0.52 0.00 1.01 0.00 0.00 57.45 57.96 2j02 n PHE 15 Cb 0.64 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 40.05 2j02 n PHE 15 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2j02 n ALA 16 N -1.12 0.41 0.24 4.37 0.00 -0.34 -4.61 120.51 119.45 2j02 n ALA 16 Ca 0.01 0.35 0.03 0.00 0.00 0.00 0.00 53.44 53.84 2j02 n ALA 16 Cb 0.12 -2.36 0.14 0.00 0.00 0.00 0.00 19.45 17.35 2j02 n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2j02 n ARG 17 N 5.58 0.02 -3.56 0.00 5.12 -1.26 -4.74 116.66 117.82 2j02 n ARG 17 Ca 0.23 0.36 -0.07 0.00 -1.93 0.00 0.00 57.85 56.44 2j02 n ARG 17 Cb 0.23 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.00 2j02 n ARG 17 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2j02 s PHE 18 N -2.92 -0.24 0.25 -1.55 -0.12 -1.26 -5.13 117.98 107.00 2j02 s PHE 18 Ca 0.04 0.19 -0.28 0.00 -0.05 0.00 0.00 56.93 56.83 2j02 s PHE 18 Cb 0.04 0.52 -0.15 0.00 -0.63 0.00 0.00 43.02 42.80 2j02 s PHE 18 CO 0.12 -0.35 0.77 -2.30 -0.05 0.00 0.00 175.22 173.40 2j02 n PRO 19 N -0.05 0.68 0.00 1.99 -0.02 -1.26 -3.65 135.00 132.70 2j02 n PRO 19 Ca -0.04 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2j02 n PRO 19 Cb 0.60 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 2j02 n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j02 n GLY 20 N 1.60 1.69 3.17 -1.23 0.00 -1.26 -4.98 105.19 104.18 2j02 n GLY 20 Ca 0.14 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 2j02 n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2j02 n ASP 21 N 6.25 -6.79 0.03 1.61 4.64 -1.24 -4.89 116.55 116.16 2j02 n ASP 21 Ca 0.00 0.20 0.13 0.00 -1.38 0.00 0.00 54.79 53.74 2j02 n ASP 21 Cb 0.00 -3.63 0.38 0.00 -1.04 0.00 0.00 41.12 36.83 2j02 n ASP 21 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 2j02 n THR 22 N -0.27 0.19 -3.00 5.18 -2.24 -1.26 -4.80 114.28 108.08 2j02 n THR 22 Ca 0.02 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2j02 n THR 22 Cb 0.57 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 2j02 n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j02 n GLY 23 N 1.43 5.38 0.00 3.38 0.00 -1.26 -4.98 105.19 109.14 2j02 n GLY 23 Ca 0.05 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2j02 n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2j02 n SER 24 N 0.00 0.00 0.03 1.61 3.41 -1.26 -4.63 113.62 112.77 2j02 n SER 24 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 2j02 n SER 24 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2j02 n SER 24 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2j02 h THR 25 N 0.00 0.00 -0.68 6.66 2.02 -2.00 0.34 112.91 119.25 2j02 h THR 25 Ca 0.00 -0.01 0.11 0.00 0.77 0.00 0.00 66.41 67.29 2j02 h THR 25 Cb 0.00 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.29 2j02 h THR 25 CO 0.00 0.00 -0.24 -0.62 0.37 0.00 0.00 175.52 175.03 2j02 n GLU 26 N -2.20 -0.13 0.05 6.66 -0.58 -1.26 -0.62 120.64 122.55 2j02 n GLU 26 Ca -0.01 1.06 -0.02 0.00 -0.42 0.00 0.00 57.16 57.77 2j02 n GLU 26 Cb 0.03 -1.57 -0.01 0.00 -0.57 0.00 0.00 31.44 29.32 2j02 n GLU 26 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2j02 h VAL 27 N 0.00 0.00 -0.69 2.62 2.07 -1.80 -1.32 116.25 117.14 2j02 h VAL 27 Ca 0.26 -0.06 0.28 0.00 0.82 0.00 0.00 66.70 68.00 2j02 h VAL 27 Cb 0.43 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.08 2j02 h VAL 27 CO -0.69 0.00 0.33 0.00 0.02 0.00 0.00 177.57 177.24 2j02 n GLN 28 N -2.52 -0.04 0.19 1.57 6.02 0.12 0.66 117.38 123.37 2j02 n GLN 28 Ca -0.02 0.95 -0.08 0.00 -0.01 0.00 0.00 57.00 57.85 2j02 n GLN 28 Cb 0.05 -1.69 -0.04 0.00 1.02 0.00 0.00 30.24 29.58 2j02 n GLN 28 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2j02 h VAL 29 N 0.00 0.00 -0.91 5.09 2.07 -0.85 -1.43 116.25 120.22 2j02 h VAL 29 Ca 0.57 -0.32 0.22 0.00 0.82 0.00 0.00 66.70 67.99 2j02 h VAL 29 Cb 1.47 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 31.07 2j02 h VAL 29 CO -0.54 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.01 2j02 h ALA 30 N -1.44 0.92 0.74 1.67 0.00 0.14 0.54 119.26 121.83 2j02 h ALA 30 Ca -0.05 0.32 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2j02 h ALA 30 Cb 0.40 0.58 0.01 0.00 0.00 0.00 0.00 17.79 18.77 2j02 h ALA 30 CO 0.09 -0.48 -0.36 -0.07 0.00 0.00 0.00 179.25 178.43 2j02 h LEU 31 N 0.04 -0.84 -0.57 0.00 4.07 -0.75 -2.29 115.31 114.97 2j02 h LEU 31 Ca 0.51 0.02 0.11 0.00 0.08 0.00 0.00 57.88 58.60 2j02 h LEU 31 Cb 0.95 0.22 -0.11 0.00 1.08 0.00 0.00 40.66 42.80 2j02 h LEU 31 CO -0.86 -0.57 -0.21 -0.07 -1.08 0.00 0.00 178.44 175.64 2j02 h LEU 32 N -1.05 -0.75 -0.02 1.67 3.38 0.09 -1.37 115.31 117.25 2j02 h LEU 32 Ca -0.10 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2j02 h LEU 32 Cb 0.78 0.43 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2j02 h LEU 32 CO 0.17 -0.24 -0.03 0.74 0.09 0.00 0.00 178.44 179.17 2j02 h THR 33 N -0.07 0.00 -0.75 0.22 2.02 -0.89 0.55 112.91 113.99 2j02 h THR 33 Ca 0.27 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.54 2j02 h THR 33 Cb 0.48 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.79 2j02 h THR 33 CO -0.63 0.00 -0.35 -0.11 0.37 0.00 0.00 175.52 174.80 2j02 n LEU 34 N -2.83 -0.61 -0.14 2.58 7.94 -0.66 0.20 117.00 123.48 2j02 n LEU 34 Ca -0.00 1.32 -0.04 0.00 -1.11 0.00 0.00 56.01 56.17 2j02 n LEU 34 Cb 0.02 -0.25 0.04 0.00 0.53 0.00 0.00 43.42 43.76 2j02 n LEU 34 CO 0.00 -1.14 0.95 0.03 -1.11 0.00 0.00 177.39 176.13 2j02 h ARG 35 N 0.00 0.32 0.06 1.96 3.08 -0.16 -2.47 114.38 117.17 2j02 h ARG 35 Ca 0.20 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.24 2j02 h ARG 35 Cb 0.39 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2j02 h ARG 35 CO -0.73 0.21 -0.25 0.82 -1.07 0.00 0.00 179.97 178.95 2j02 h ILE 36 N 0.33 0.00 -0.48 2.04 2.04 0.74 0.17 117.51 122.35 2j02 h ILE 36 Ca 0.21 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.16 2j02 h ILE 36 Cb 0.20 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.18 2j02 h ILE 36 CO -0.21 0.00 -0.25 0.78 0.00 0.00 0.00 178.15 178.47 2j02 h ASN 37 N -0.36 -0.84 -0.19 1.72 -0.26 -1.34 1.87 115.58 116.18 2j02 h ASN 37 Ca -0.00 0.18 0.02 0.00 -0.56 0.00 0.00 56.30 55.94 2j02 h ASN 37 Cb 0.36 0.44 -0.04 0.00 -1.06 0.00 0.00 38.32 38.03 2j02 h ASN 37 CO -0.14 -0.26 -0.24 0.03 -1.06 0.00 0.00 177.43 175.76 2j02 h ARG 38 N -0.14 -0.16 -0.93 0.81 2.47 -1.13 0.42 114.38 115.71 2j02 h ARG 38 Ca 0.22 0.01 0.12 0.00 -1.26 0.00 0.00 59.98 59.07 2j02 h ARG 38 Cb 0.49 0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 28.77 2j02 h ARG 38 CO -0.56 -0.10 0.60 1.25 0.56 0.00 0.00 179.97 181.71 2j02 h LEU 39 N -0.16 0.79 0.00 3.04 7.12 0.62 -1.83 115.31 124.89 2j02 h LEU 39 Ca 0.03 0.04 0.00 0.00 0.13 0.00 0.00 57.88 58.08 2j02 h LEU 39 Cb 0.25 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 40.26 2j02 h LEU 39 CO -0.26 0.42 0.00 -0.24 -0.13 0.00 0.00 178.44 178.23 2j02 n SER 40 N -4.58 0.00 -0.36 1.25 2.88 0.62 -1.48 113.62 111.95 2j02 n SER 40 Ca 0.17 0.75 0.31 0.00 -1.33 0.00 0.00 58.87 58.77 2j02 n SER 40 Cb 0.39 -0.25 0.52 0.00 -0.75 0.00 0.00 64.21 64.12 2j02 n SER 40 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2j02 n GLU 41 N -1.49 -0.03 0.00 -1.46 4.07 0.12 -0.89 120.64 120.97 2j02 n GLU 41 Ca 0.00 0.95 0.00 0.00 -0.06 0.00 0.00 57.16 58.05 2j02 n GLU 41 Cb 0.00 -1.88 0.00 0.00 -0.06 0.00 0.00 31.44 29.50 2j02 n GLU 41 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 2j02 n HIS 42 N -4.19 0.00 0.16 4.31 -0.00 -0.55 -2.93 115.22 112.02 2j02 n HIS 42 Ca 0.31 0.00 0.19 0.00 0.46 0.00 0.00 57.72 58.68 2j02 n HIS 42 Cb 1.20 -0.38 0.75 0.00 -0.12 0.00 0.00 29.99 31.45 2j02 n HIS 42 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2j02 h LEU 43 N 0.00 0.00 0.00 0.27 3.38 -0.41 0.90 115.31 119.44 2j02 h LEU 43 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2j02 h LEU 43 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2j02 h LEU 43 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.70 2j02 n LYS 44 N -3.45 0.28 0.00 1.13 4.81 -0.71 -2.11 118.16 118.12 2j02 n LYS 44 Ca 0.05 0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.54 2j02 n LYS 44 Cb 0.57 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.12 2j02 n LYS 44 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2j02 n VAL 45 N -1.08 0.00 -2.92 3.15 0.31 0.31 -4.83 118.33 113.27 2j02 n VAL 45 Ca 0.07 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.07 2j02 n VAL 45 Cb 0.05 -0.65 -0.02 0.00 -0.91 0.00 0.00 33.84 32.31 2j02 n VAL 45 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2j02 n HIS 46 N -2.10 3.41 -0.33 3.52 8.25 -0.90 -4.83 115.22 122.25 2j02 n HIS 46 Ca 0.00 -3.43 0.19 0.00 -0.26 0.00 0.00 57.72 54.22 2j02 n HIS 46 Cb 0.44 -0.80 0.40 0.00 1.12 0.00 0.00 29.99 31.14 2j02 n HIS 46 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2j02 h LYS 47 N 3.79 0.45 0.00 -0.41 1.79 -1.78 0.93 116.57 121.35 2j02 h LYS 47 Ca 0.28 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2j02 h LYS 47 Cb 0.48 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 2j02 h LYS 47 CO 0.99 0.30 0.00 0.87 -1.08 0.00 0.00 179.45 180.53 2j02 h LYS 48 N 0.47 0.00 -5.21 3.15 1.79 -1.88 -3.36 116.57 111.53 2j02 h LYS 48 Ca 0.65 0.00 -0.71 0.00 -2.18 0.00 0.00 60.65 58.42 2j02 h LYS 48 Cb 1.33 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.84 2j02 h LYS 48 CO -0.53 0.00 1.63 0.34 -1.08 0.00 0.00 179.45 179.81 2j02 s ASP 49 N -4.80 6.94 -0.04 0.86 2.15 0.32 -4.81 116.67 117.30 2j02 s ASP 49 Ca -0.03 -2.68 -0.25 0.00 0.43 0.00 0.00 52.55 50.02 2j02 s ASP 49 Cb 0.10 -2.47 -0.21 0.00 -0.30 0.00 0.00 42.92 40.04 2j02 s ASP 49 CO 0.36 -0.95 1.15 0.45 -0.17 0.00 0.00 175.17 176.01 2j02 h HIS 50 N 7.52 0.12 -0.81 -5.34 3.86 -1.82 -3.08 115.15 115.60 2j02 h HIS 50 Ca 0.35 -0.05 0.19 0.00 -1.16 0.00 0.00 60.37 59.70 2j02 h HIS 50 Cb 0.89 -0.02 -0.14 0.00 1.06 0.00 0.00 27.41 29.19 2j02 h HIS 50 CO 1.23 0.71 -0.02 0.45 0.86 0.00 0.00 177.93 181.16 2j02 h HIS 51 N -0.50 -0.10 -0.45 2.45 3.86 -1.96 1.93 115.15 120.38 2j02 h HIS 51 Ca -0.00 0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 2j02 h HIS 51 Cb 0.71 0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.33 2j02 h HIS 51 CO 0.14 -0.29 0.20 0.77 0.86 0.00 0.00 177.93 179.61 2j02 h SER 52 N 0.08 0.56 -0.05 2.45 0.02 -1.98 -2.21 113.55 112.43 2j02 h SER 52 Ca 0.45 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.38 2j02 h SER 52 Cb 0.80 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 2j02 h SER 52 CO -0.74 0.50 -0.27 -0.74 -1.14 0.00 0.00 176.83 174.44 2j02 h HIS 53 N 0.63 -0.73 -0.93 3.45 2.76 0.31 -1.64 115.15 119.01 2j02 h HIS 53 Ca 0.16 0.03 0.12 0.00 -2.20 0.00 0.00 60.37 58.47 2j02 h HIS 53 Cb 0.10 0.33 -0.14 0.00 1.55 0.00 0.00 27.41 29.25 2j02 h HIS 53 CO 0.01 -0.36 -0.48 -0.09 -1.30 0.00 0.00 177.93 175.71 2j02 h ARG 54 N -0.38 -0.04 -0.92 5.26 2.43 -0.65 0.92 114.38 121.00 2j02 h ARG 54 Ca 0.08 0.00 0.26 0.00 -0.81 0.00 0.00 59.98 59.50 2j02 h ARG 54 Cb 0.49 0.01 -0.14 0.00 -0.42 0.00 0.00 29.97 29.91 2j02 h ARG 54 CO -0.27 -0.03 0.38 0.78 -1.51 0.00 0.00 179.97 179.33 2j02 h GLY 55 N -0.04 1.63 0.17 2.80 0.00 -1.19 -0.92 103.07 105.52 2j02 h GLY 55 Ca 0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 2j02 h GLY 55 CO -0.92 -0.37 -0.26 -2.00 0.00 0.00 0.00 176.54 172.99 2j02 h LEU 56 N 0.31 -0.73 -0.72 3.11 5.85 0.13 -1.35 115.31 121.91 2j02 h LEU 56 Ca 0.61 0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.47 2j02 h LEU 56 Cb 1.26 0.25 -0.09 0.00 0.37 0.00 0.00 40.66 42.45 2j02 h LEU 56 CO -0.60 -0.31 -0.39 0.18 -0.34 0.00 0.00 178.44 176.98 2j02 n LEU 57 N -3.90 -0.70 0.02 2.25 4.77 -0.38 0.15 117.00 119.22 2j02 n LEU 57 Ca -0.05 1.27 -0.06 0.00 -0.03 0.00 0.00 56.01 57.14 2j02 n LEU 57 Cb 0.22 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2j02 n LEU 57 CO 0.11 -1.06 0.50 0.24 -1.33 0.00 0.00 177.39 175.85 2j02 h MET 58 N 0.00 -0.25 -0.95 3.23 2.86 -1.20 1.06 114.93 119.67 2j02 h MET 58 Ca 0.14 0.02 0.26 0.00 -2.06 0.00 0.00 59.70 58.06 2j02 h MET 58 Cb 0.32 0.06 -0.17 0.00 0.06 0.00 0.00 31.60 31.87 2j02 h MET 58 CO -0.68 -0.17 0.05 0.52 1.06 0.00 0.00 176.91 177.69 2j02 h MET 59 N -0.26 0.04 0.15 1.72 2.86 0.84 0.18 114.93 120.45 2j02 h MET 59 Ca 0.01 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2j02 h MET 59 Cb 0.28 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 2j02 h MET 59 CO -0.14 0.02 -0.18 0.28 1.06 0.00 0.00 176.91 177.95 2j02 h VAL 60 N 0.04 0.59 0.03 -2.22 2.07 0.52 -2.44 116.25 114.84 2j02 h VAL 60 Ca 0.57 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 68.09 2j02 h VAL 60 Cb 1.17 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2j02 h VAL 60 CO -0.87 0.00 -0.01 1.23 0.02 0.00 0.00 177.57 177.94 2j02 h GLY 61 N -0.38 -0.04 -0.62 2.17 0.00 0.38 -2.15 103.07 102.43 2j02 h GLY 61 Ca 0.01 0.01 0.25 0.00 0.00 0.00 0.00 47.33 47.60 2j02 h GLY 61 CO -0.07 -0.01 0.15 -1.61 0.00 0.00 0.00 176.54 175.00 2j02 h GLN 62 N -0.13 0.11 -0.42 4.80 5.75 -1.00 1.18 115.11 125.41 2j02 h GLN 62 Ca -0.00 -0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 2j02 h GLN 62 Cb 0.12 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 2j02 h GLN 62 CO 0.01 0.08 0.07 -0.09 -2.65 0.00 0.00 178.83 176.24 2j02 h ARG 63 N 0.12 0.69 0.06 1.69 2.43 -1.12 -2.23 114.38 116.02 2j02 h ARG 63 Ca 0.56 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2j02 h ARG 63 Cb 1.15 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 2j02 h ARG 63 CO -0.75 0.73 -0.22 -0.09 -1.51 0.00 0.00 179.97 178.14 2j02 h ARG 64 N 0.55 -0.30 0.00 0.20 2.43 0.18 -1.71 114.38 115.73 2j02 h ARG 64 Ca 0.13 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2j02 h ARG 64 Cb 0.37 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2j02 h ARG 64 CO 0.01 -0.20 0.00 0.54 -1.51 0.00 0.00 179.97 178.81 2j02 n ARG 65 N -3.67 0.00 -0.07 0.20 3.00 0.13 -1.52 116.66 114.73 2j02 n ARG 65 Ca -0.04 0.57 -0.02 0.00 -0.01 0.00 0.00 57.85 58.36 2j02 n ARG 65 Cb 0.17 -0.87 -0.02 0.00 0.00 0.00 0.00 32.46 31.75 2j02 n ARG 65 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2j02 h LEU 66 N 0.00 -0.37 -0.94 0.55 4.07 -1.17 0.24 115.31 117.69 2j02 h LEU 66 Ca 0.00 0.06 0.28 0.00 0.08 0.00 0.00 57.88 58.30 2j02 h LEU 66 Cb 0.00 0.16 -0.16 0.00 1.08 0.00 0.00 40.66 41.74 2j02 h LEU 66 CO 0.00 -0.04 0.23 -0.07 -1.08 0.00 0.00 178.44 177.48 2j02 h LEU 67 N -0.00 -0.09 -0.22 1.67 3.38 -0.42 0.63 115.31 120.26 2j02 h LEU 67 Ca 0.03 0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.28 2j02 h LEU 67 Cb 0.07 0.34 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 2j02 h LEU 67 CO -0.16 -0.28 -0.11 -0.09 0.09 0.00 0.00 178.44 177.90 2j02 h ARG 68 N 0.11 -0.08 0.31 1.13 2.43 0.51 1.33 114.38 120.11 2j02 h ARG 68 Ca 0.63 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.81 2j02 h ARG 68 Cb 1.38 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.92 2j02 h ARG 68 CO -0.77 -0.06 -0.33 -0.92 -1.51 0.00 0.00 179.97 176.39 2j02 h TYR 69 N -0.09 -0.89 -0.02 2.20 3.20 0.13 -0.71 116.97 120.79 2j02 h TYR 69 Ca 0.12 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.00 2j02 h TYR 69 Cb 0.26 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2j02 h TYR 69 CO -0.27 -0.47 -0.11 1.25 -1.64 0.00 0.00 178.16 176.92 2j02 h LEU 70 N -0.68 -0.36 -0.94 2.82 5.85 0.10 0.37 115.31 122.47 2j02 h LEU 70 Ca -0.01 0.04 0.32 0.00 0.84 0.00 0.00 57.88 59.07 2j02 h LEU 70 Cb 0.62 0.14 -0.17 0.00 0.37 0.00 0.00 40.66 41.62 2j02 h LEU 70 CO -0.07 -0.10 0.24 1.67 -0.34 0.00 0.00 178.44 179.83 2j02 n GLN 71 N -3.17 -0.07 0.26 1.25 7.27 0.44 -0.20 117.38 123.16 2j02 n GLN 71 Ca -0.01 1.36 -0.10 0.00 0.07 0.00 0.00 57.00 58.31 2j02 n GLN 71 Cb 0.08 -2.28 -0.05 0.00 2.41 0.00 0.00 30.24 30.40 2j02 n GLN 71 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 2j02 h ARG 72 N 0.00 -0.66 -0.61 3.69 2.43 0.62 -3.24 114.38 116.62 2j02 h ARG 72 Ca 0.67 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.98 2j02 h ARG 72 Cb 1.59 0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 31.22 2j02 h ARG 72 CO -0.81 -0.44 0.21 0.93 -1.51 0.00 0.00 179.97 178.35 2j02 h GLU 73 N -0.87 0.37 -2.36 0.20 4.39 0.11 -3.42 114.58 113.00 2j02 h GLU 73 Ca -0.07 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.56 2j02 h GLU 73 Cb 0.52 -0.08 -0.25 0.00 -0.10 0.00 0.00 28.75 28.84 2j02 h GLU 73 CO 0.11 0.25 -0.26 0.34 -1.16 0.00 0.00 179.01 178.29 2j02 s ASP 74 N -5.37 -0.59 -0.07 1.42 2.15 0.72 -5.05 116.67 109.88 2j02 s ASP 74 Ca -0.13 1.17 -0.26 0.00 0.43 0.00 0.00 52.55 53.76 2j02 s ASP 74 Cb 0.17 1.48 -0.24 0.00 -0.30 0.00 0.00 42.92 44.04 2j02 s ASP 74 CO 0.74 -0.22 1.01 1.55 -0.17 0.00 0.00 175.17 178.08 2j02 h PRO 75 N 7.82 0.10 0.00 4.34 0.13 -1.76 -3.27 132.00 139.36 2j02 h PRO 75 Ca -0.21 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2j02 h PRO 75 Cb 1.13 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2j02 h PRO 75 CO 0.15 0.86 0.00 -1.91 -0.23 0.00 0.00 178.00 176.87 2j02 n GLU 76 N -4.60 0.00 0.00 0.86 4.07 -1.26 0.81 120.64 120.52 2j02 n GLU 76 Ca -0.10 0.26 0.03 0.00 -0.06 0.00 0.00 57.16 57.29 2j02 n GLU 76 Cb 0.45 -0.61 0.17 0.00 -0.06 0.00 0.00 31.44 31.39 2j02 n GLU 76 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2j02 n ARG 77 N -0.62 0.20 -0.01 5.31 1.85 -1.26 -1.92 116.66 120.21 2j02 n ARG 77 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.84 2j02 n ARG 77 Cb 0.00 -1.43 -0.00 0.00 -1.05 0.00 0.00 32.46 29.97 2j02 n ARG 77 CO 0.00 0.00 0.00 -0.92 -0.01 0.00 0.00 177.63 176.70 2j02 h TYR 78 N 0.00 -0.03 -0.88 2.89 3.20 0.35 -2.17 116.97 120.33 2j02 h TYR 78 Ca 0.00 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.07 2j02 h TYR 78 Cb 0.00 0.01 -0.16 0.00 1.54 0.00 0.00 36.73 38.12 2j02 h TYR 78 CO 0.00 -0.02 -0.08 0.00 -1.64 0.00 0.00 178.16 176.42 2j02 h ARG 79 N -0.59 0.03 -0.05 1.82 3.08 -0.40 0.15 114.38 118.42 2j02 h ARG 79 Ca -0.00 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.05 2j02 h ARG 79 Cb 0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2j02 h ARG 79 CO 0.01 0.02 -0.12 0.00 -1.07 0.00 0.00 179.97 178.81 2j02 h ALA 80 N 1.86 -0.49 0.16 0.04 0.00 -1.54 0.50 119.26 119.79 2j02 h ALA 80 Ca 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2j02 h ALA 80 Cb 0.84 0.71 -0.03 0.00 0.00 0.00 0.00 17.79 19.31 2j02 h ALA 80 CO -0.84 -0.54 -0.34 1.25 0.00 0.00 0.00 179.25 178.78 2j02 h LEU 81 N -0.12 -0.99 -0.94 0.00 5.85 -0.41 0.98 115.31 119.69 2j02 h LEU 81 Ca 0.01 0.10 0.24 0.00 0.84 0.00 0.00 57.88 59.06 2j02 h LEU 81 Cb 0.14 0.35 -0.13 0.00 0.37 0.00 0.00 40.66 41.40 2j02 h LEU 81 CO -0.11 -0.38 0.47 -0.29 -0.34 0.00 0.00 178.44 177.79 2j02 h ILE 82 N -0.54 0.48 0.48 4.05 -0.00 -1.00 0.01 117.51 120.99 2j02 h ILE 82 Ca -0.02 -0.15 -0.02 0.00 -0.00 0.00 0.00 64.86 64.67 2j02 h ILE 82 Cb 0.51 -0.01 0.00 0.00 -0.00 0.00 0.00 36.82 37.33 2j02 h ILE 82 CO -0.14 0.08 -0.23 -0.08 -0.00 0.00 0.00 178.15 177.78 2j02 h GLU 83 N 0.45 -0.62 -0.92 2.19 4.81 0.69 0.40 114.58 121.58 2j02 h GLU 83 Ca 0.60 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.96 2j02 h GLU 83 Cb 1.16 0.14 -0.07 0.00 0.63 0.00 0.00 28.75 30.61 2j02 h GLU 83 CO -0.52 -0.33 0.57 0.87 -0.73 0.00 0.00 179.01 178.87 2j02 h LYS 84 N -0.82 0.95 0.00 1.92 1.57 0.18 0.24 116.57 120.61 2j02 h LYS 84 Ca -0.07 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2j02 h LYS 84 Cb 0.57 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2j02 h LYS 84 CO 0.11 0.63 0.00 -0.07 -0.57 0.00 0.00 179.45 179.55 2j02 h LEU 85 N 0.98 0.00 -2.48 2.94 3.38 -1.01 -3.48 115.31 115.64 2j02 h LEU 85 Ca 0.43 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.30 2j02 h LEU 85 Cb 0.30 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.10 2j02 h LEU 85 CO -0.22 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 178.65 2j02 n GLY 86 N 1.15 -1.22 0.00 0.83 0.00 0.13 -5.04 105.19 101.03 2j02 n GLY 86 Ca 0.05 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2j02 n GLY 86 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2j02 n ILE 87 N -2.22 0.00 -2.98 -0.61 5.41 -0.37 -4.94 119.36 113.64 2j02 n ILE 87 Ca -0.03 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.42 2j02 n ILE 87 Cb 0.54 -0.10 0.03 0.00 -0.71 0.00 0.00 39.64 39.40 2j02 n ILE 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2j02 n ARG 88 N 0.00 -1.45 0.00 0.38 1.74 -1.26 -4.97 116.66 111.09 2j02 n ARG 88 Ca 0.00 1.04 0.13 0.00 -0.77 0.00 0.00 57.85 58.25 2j02 n ARG 88 Cb 0.00 -1.54 0.41 0.00 -1.02 0.00 0.00 32.46 30.31 2j02 n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52