#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2js3 n GLY 2 N 0.00 1.43 3.76 -5.12 0.00 -1.26 -4.92 105.19 99.08 2js3 n GLY 2 Ca 0.00 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 2js3 n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2js3 s SER 3 N -4.00 7.31 0.00 1.61 0.01 -1.26 -5.06 113.70 112.31 2js3 s SER 3 Ca 0.00 2.13 0.00 0.00 1.31 0.00 0.00 55.95 59.39 2js3 s SER 3 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2js3 s SER 3 CO 0.00 -0.10 0.00 -0.24 0.41 0.00 0.00 173.24 173.31 2js3 n SER 4 N 1.07 0.93 -4.52 2.44 2.88 -1.26 -5.11 113.62 110.05 2js3 n SER 4 Ca -0.00 -0.81 -0.37 0.00 -1.33 0.00 0.00 58.87 56.35 2js3 n SER 4 Cb 0.46 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.81 2js3 n SER 4 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2js3 s HIS 5 N 0.35 3.16 0.24 0.66 -0.00 -1.26 -5.09 115.29 113.34 2js3 s HIS 5 Ca 0.00 -0.15 -0.02 0.00 -0.00 0.00 0.00 55.06 54.89 2js3 s HIS 5 Cb 0.00 -2.30 0.05 0.00 -0.00 0.00 0.00 32.58 30.33 2js3 s HIS 5 CO 0.00 -0.24 0.32 0.72 -0.00 0.00 0.00 174.74 175.54 2js3 n HIS 6 N 4.92 -3.55 -3.13 0.38 8.25 -1.26 -5.13 115.22 115.70 2js3 n HIS 6 Ca -0.15 -0.44 0.00 0.00 -0.26 0.00 0.00 57.72 56.87 2js3 n HIS 6 Cb 0.52 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.38 2js3 n HIS 6 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2js3 n HIS 7 N -2.09 0.00 -1.82 4.41 -0.00 -1.26 -5.10 115.22 109.36 2js3 n HIS 7 Ca 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.76 2js3 n HIS 7 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.15 2js3 n HIS 7 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2js3 n HIS 8 N 0.00 -1.23 -4.31 4.41 -0.00 -1.26 -5.12 115.22 107.71 2js3 n HIS 8 Ca 0.00 0.67 -0.17 0.00 -0.00 0.00 0.00 57.72 58.22 2js3 n HIS 8 Cb 0.00 -2.19 -0.10 0.00 -0.00 0.00 0.00 29.99 27.70 2js3 n HIS 8 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2js3 s HIS 9 N -0.27 1.52 -0.90 1.57 4.02 -1.26 -5.08 115.29 114.89 2js3 s HIS 9 Ca -0.06 -1.29 -0.25 0.00 1.02 0.00 0.00 55.06 54.48 2js3 s HIS 9 Cb 0.00 -0.84 0.03 0.00 -1.02 0.00 0.00 32.58 30.76 2js3 s HIS 9 CO 0.22 -0.46 1.47 -1.01 1.02 0.00 0.00 174.74 175.98 2js3 s HIS 10 N -3.74 2.33 0.02 1.40 3.76 -1.26 -4.76 115.29 113.05 2js3 s HIS 10 Ca 0.37 -0.36 0.14 0.00 -0.15 0.00 0.00 55.06 55.07 2js3 s HIS 10 Cb 0.06 -4.58 0.22 0.00 1.11 0.00 0.00 32.58 29.40 2js3 s HIS 10 CO 0.15 -1.99 1.51 0.66 -0.85 0.00 0.00 174.74 174.23 2js3 h SER 11 N 10.31 0.00 -3.57 1.40 4.64 -1.98 -3.42 113.55 120.93 2js3 h SER 11 Ca 0.01 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.70 2js3 h SER 11 Cb 1.03 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.99 2js3 h SER 11 CO 1.35 0.56 0.16 -0.44 -0.87 0.00 0.00 176.83 177.60 2js3 s SER 12 N -6.52 6.42 0.00 4.97 0.01 -1.26 -4.74 113.70 112.58 2js3 s SER 12 Ca 0.02 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.37 2js3 s SER 12 Cb 0.09 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2js3 s SER 12 CO 0.74 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 174.36 2js3 n GLY 13 N 4.72 -1.57 3.35 3.44 0.00 -1.26 -5.02 105.19 108.86 2js3 n GLY 13 Ca -0.01 0.68 -0.24 0.00 0.00 0.00 0.00 46.02 46.45 2js3 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2js3 n ARG 14 N 0.00 -4.62 0.06 1.61 1.74 -1.26 -4.86 116.66 109.33 2js3 n ARG 14 Ca 0.00 0.68 -0.11 0.00 -0.77 0.00 0.00 57.85 57.65 2js3 n ARG 14 Cb 0.00 -5.50 -0.00 0.00 -1.02 0.00 0.00 32.46 25.94 2js3 n ARG 14 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2js3 h GLU 15 N -1.43 0.38 -5.19 5.56 4.57 -2.00 -3.41 114.58 113.06 2js3 h GLU 15 Ca -0.50 -0.35 -0.61 0.00 -1.18 0.00 0.00 59.36 56.71 2js3 h GLU 15 Cb 1.34 0.09 -0.13 0.00 -0.16 0.00 0.00 28.75 29.88 2js3 h GLU 15 CO 0.57 1.01 -0.49 0.54 -1.18 0.00 0.00 179.01 179.47 2js3 s ASN 16 N -7.00 6.17 -0.16 1.04 2.20 -1.26 -4.99 114.94 110.94 2js3 s ASN 16 Ca -0.05 0.18 0.07 0.00 -0.94 0.00 0.00 52.86 52.12 2js3 s ASN 16 Cb 0.10 -2.10 -0.15 0.00 -2.00 0.00 0.00 41.25 37.10 2js3 s ASN 16 CO 0.85 0.11 -0.06 0.18 -2.94 0.00 0.00 177.10 175.24 2js3 n LEU 17 N 3.94 1.54 -4.33 3.54 4.32 -1.26 -4.74 117.00 120.00 2js3 n LEU 17 Ca -0.15 -0.05 -0.18 0.00 -0.02 0.00 0.00 56.01 55.61 2js3 n LEU 17 Cb 0.52 -0.16 -0.09 0.00 -1.62 0.00 0.00 43.42 42.06 2js3 n LEU 17 CO 0.36 0.59 -0.22 -0.47 -1.22 0.00 0.00 177.39 176.43 2js3 s TYR 18 N -2.36 1.58 -1.28 -1.77 5.04 -1.26 -5.04 117.35 112.26 2js3 s TYR 18 Ca -0.16 -1.31 -0.10 0.00 -2.44 0.00 0.00 57.07 53.06 2js3 s TYR 18 Cb 0.05 -0.87 -0.07 0.00 0.35 0.00 0.00 41.96 41.42 2js3 s TYR 18 CO 0.50 -0.46 2.48 1.19 -1.34 0.00 0.00 175.55 177.92 2js3 n PHE 19 N -0.55 2.15 0.00 4.97 3.01 -1.26 -3.41 117.46 122.37 2js3 n PHE 19 Ca 0.01 -2.57 0.00 0.00 1.01 0.00 0.00 57.45 55.89 2js3 n PHE 19 Cb 0.65 -2.15 0.00 0.00 -0.01 0.00 0.00 39.48 37.97 2js3 n PHE 19 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2js3 n GLN 20 N 4.44 0.67 -2.71 -1.08 1.13 -1.26 -4.91 117.38 113.66 2js3 n GLN 20 Ca 0.61 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.62 2js3 n GLN 20 Cb 0.23 -0.77 0.08 0.00 0.11 0.00 0.00 30.24 29.89 2js3 n GLN 20 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2js3 n GLY 21 N 2.37 1.65 3.78 1.08 0.00 -1.22 -5.13 105.19 107.72 2js3 n GLY 21 Ca 0.00 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 2js3 n GLY 21 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2js3 s MET 22 N -1.61 2.63 0.00 1.61 -1.94 -1.25 -4.74 119.30 113.99 2js3 s MET 22 Ca 0.21 1.18 0.00 0.00 -1.71 0.00 0.00 55.69 55.38 2js3 s MET 22 Cb 0.41 -1.94 0.00 0.00 2.01 0.00 0.00 34.83 35.31 2js3 s MET 22 CO -0.05 -1.36 0.00 2.41 -0.01 0.00 0.00 175.02 176.01 2js3 n THR 23 N -3.03 0.00 0.20 2.05 -1.04 -1.26 -5.09 114.28 106.11 2js3 n THR 23 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 2js3 n THR 23 Cb 0.53 -0.28 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 2js3 n THR 23 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2js3 n ASP 24 N -2.24 -2.54 0.14 8.00 2.03 -1.26 -4.94 116.55 115.73 2js3 n ASP 24 Ca 0.00 0.74 0.10 0.00 0.52 0.00 0.00 54.79 56.15 2js3 n ASP 24 Cb 0.00 2.46 0.51 0.00 -0.72 0.00 0.00 41.12 43.38 2js3 n ASP 24 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2js3 n THR 25 N -3.46 1.04 -0.15 5.18 -1.04 -1.26 -2.08 114.28 112.51 2js3 n THR 25 Ca 0.00 0.56 0.09 0.00 -2.04 0.00 0.00 64.05 62.67 2js3 n THR 25 Cb 0.00 -1.54 0.42 0.00 -1.82 0.00 0.00 70.33 67.39 2js3 n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2js3 h ALA 26 N 2.09 1.85 0.00 2.41 0.00 -1.92 -1.32 119.26 122.37 2js3 h ALA 26 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2js3 h ALA 26 Cb 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2js3 h ALA 26 CO 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 179.25 179.15 2js3 h ALA 27 N 1.64 1.69 -0.34 0.00 0.00 -1.83 -2.49 119.26 117.94 2js3 h ALA 27 Ca 0.31 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2js3 h ALA 27 Cb 0.44 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2js3 h ALA 27 CO -0.10 0.14 0.15 1.49 0.00 0.00 0.00 179.25 180.93 2js3 h GLU 28 N 0.00 0.49 0.02 0.00 4.22 -1.45 -1.93 114.58 115.94 2js3 h GLU 28 Ca -0.00 -0.08 -0.26 0.00 0.08 0.00 0.00 59.36 59.10 2js3 h GLU 28 Cb 0.22 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2js3 h GLU 28 CO 0.01 0.46 -1.35 -0.44 -2.18 0.00 0.00 179.01 175.51 2js3 h ASP 29 N 0.40 0.08 -0.16 1.04 3.32 -1.64 -2.98 116.42 116.49 2js3 h ASP 29 Ca 0.11 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2js3 h ASP 29 Cb 0.14 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2js3 h ASP 29 CO -0.01 1.09 0.08 0.58 -1.72 0.00 0.00 179.24 179.26 2js3 h VAL 30 N 0.01 1.11 0.00 -1.35 2.07 -1.36 -2.05 116.25 114.69 2js3 h VAL 30 Ca -0.15 -0.30 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 2js3 h VAL 30 Cb 1.90 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 2js3 h VAL 30 CO 0.12 0.10 -0.32 0.08 0.02 0.00 0.00 177.57 177.57 2js3 h ARG 31 N 0.14 0.00 0.17 1.57 -0.00 -1.47 -2.72 114.38 112.07 2js3 h ARG 31 Ca 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 60.03 2js3 h ARG 31 Cb 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.06 2js3 h ARG 31 CO -0.01 0.32 -0.09 -0.22 -0.00 0.00 0.00 179.97 179.97 2js3 h LYS 32 N 0.00 -0.24 -0.08 0.08 3.64 -1.22 0.71 116.57 119.46 2js3 h LYS 32 Ca -0.00 0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 2js3 h LYS 32 Cb 0.59 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2js3 h LYS 32 CO 0.04 -0.16 -0.63 -0.84 -2.27 0.00 0.00 179.45 175.59 2js3 h ILE 33 N -0.25 1.38 -0.53 2.00 3.07 -1.39 -3.09 117.51 118.71 2js3 h ILE 33 Ca -0.02 -2.02 -0.08 0.00 1.55 0.00 0.00 64.86 64.30 2js3 h ILE 33 Cb 0.20 2.01 -0.02 0.00 -0.27 0.00 0.00 36.82 38.74 2js3 h ILE 33 CO 0.02 0.60 0.00 0.00 -1.05 0.00 0.00 178.15 177.73 2js3 h ALA 34 N 1.11 1.02 -0.51 0.16 0.00 -1.22 -2.73 119.26 117.08 2js3 h ALA 34 Ca -0.01 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 2js3 h ALA 34 Cb 1.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2js3 h ALA 34 CO 0.10 0.61 0.06 1.15 0.00 0.00 0.00 179.25 181.17 2js3 h THR 35 N 0.82 1.23 -0.18 0.00 2.02 -0.78 -0.65 112.91 115.38 2js3 h THR 35 Ca 0.16 -0.91 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 2js3 h THR 35 Cb 0.49 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2js3 h THR 35 CO 0.02 0.33 0.08 0.00 0.37 0.00 0.00 175.52 176.32 2js3 h ALA 36 N 1.30 0.23 0.00 6.16 0.00 -1.41 -1.17 119.26 124.37 2js3 h ALA 36 Ca 0.16 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2js3 h ALA 36 Cb 0.37 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2js3 h ALA 36 CO 0.01 -0.19 -0.60 1.37 0.00 0.00 0.00 179.25 179.83 2js3 h LEU 37 N 0.14 0.00 -0.99 0.00 8.10 -1.43 -2.98 115.31 118.16 2js3 h LEU 37 Ca 0.06 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.95 2js3 h LEU 37 Cb 0.15 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.36 2js3 h LEU 37 CO -0.01 0.60 -0.34 0.25 -4.11 0.00 0.00 178.44 174.84 2js3 h LEU 38 N 0.00 0.32 -0.36 0.17 5.85 -0.74 0.30 115.31 120.84 2js3 h LEU 38 Ca -0.01 -0.12 -0.19 0.00 0.84 0.00 0.00 57.88 58.41 2js3 h LEU 38 Cb 1.10 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2js3 h LEU 38 CO 0.08 0.64 -0.80 0.11 -0.34 0.00 0.00 178.44 178.13 2js3 h LYS 39 N 0.27 0.31 0.07 1.25 1.57 -1.11 -3.15 116.57 115.77 2js3 h LYS 39 Ca 0.03 -0.28 -0.38 0.00 -1.87 0.00 0.00 60.65 58.15 2js3 h LYS 39 Cb 0.73 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 2js3 h LYS 39 CO 0.06 0.95 -2.21 2.41 -0.57 0.00 0.00 179.45 180.09 2js3 n THR 40 N -3.77 1.65 1.08 -0.16 -1.04 -1.04 -4.24 114.28 106.76 2js3 n THR 40 Ca -0.04 -0.61 0.14 0.00 -2.04 0.00 0.00 64.05 61.50 2js3 n THR 40 Cb 0.75 -1.60 0.54 0.00 -1.82 0.00 0.00 70.33 68.20 2js3 n THR 40 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2js3 n ALA 41 N -3.13 2.68 -3.73 2.41 0.00 0.10 -4.24 120.51 114.60 2js3 n ALA 41 Ca -0.38 -0.18 -0.29 0.00 0.00 0.00 0.00 53.44 52.58 2js3 n ALA 41 Cb 1.02 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.97 2js3 n ALA 41 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2js3 s ILE 42 N -2.91 1.64 0.01 0.00 1.01 -1.19 -2.70 121.20 117.06 2js3 s ILE 42 Ca 0.16 -2.90 -0.03 0.00 0.00 0.00 0.00 60.65 57.88 2js3 s ILE 42 Cb 0.19 -2.13 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 2js3 s ILE 42 CO 0.56 -0.94 0.05 -0.70 0.00 0.00 0.00 174.94 173.91 2js3 s GLU 43 N -0.01 0.34 -0.17 2.79 2.12 -1.26 -4.70 118.70 117.81 2js3 s GLU 43 Ca 0.20 -0.43 -0.27 0.00 0.36 0.00 0.00 54.97 54.84 2js3 s GLU 43 Cb -0.19 0.13 -0.01 0.00 0.26 0.00 0.00 34.13 34.33 2js3 s GLU 43 CO -0.04 -0.07 0.91 0.96 -0.54 0.00 0.00 175.26 176.48 2js3 s ILE 44 N -1.21 4.82 -0.39 -3.70 -4.36 -1.26 -3.25 121.20 111.84 2js3 s ILE 44 Ca -0.13 1.79 -0.21 0.00 -0.26 0.00 0.00 60.65 61.83 2js3 s ILE 44 Cb -0.08 -4.20 0.01 0.00 1.25 0.00 0.00 42.46 39.44 2js3 s ILE 44 CO 0.00 -0.03 0.69 0.68 0.24 0.00 0.00 174.94 176.53 2js3 s VAL 45 N 2.38 4.80 -0.06 8.37 -7.23 0.12 -4.77 120.40 124.01 2js3 s VAL 45 Ca 0.41 0.50 -0.22 0.00 -1.81 0.00 0.00 61.98 60.87 2js3 s VAL 45 Cb -0.16 -4.17 -0.04 0.00 0.56 0.00 0.00 36.38 32.56 2js3 s VAL 45 CO 0.12 -0.47 0.63 -0.44 -0.31 0.00 0.00 175.10 174.62 2js3 s SER 46 N 1.91 6.92 0.34 4.85 0.01 -1.26 -0.69 113.70 125.78 2js3 s SER 46 Ca 0.26 1.10 -0.26 0.00 1.31 0.00 0.00 55.95 58.36 2js3 s SER 46 Cb -0.14 -2.37 -0.10 0.00 0.21 0.00 0.00 66.02 63.62 2js3 s SER 46 CO 0.18 -0.04 0.98 -1.61 0.41 0.00 0.00 173.24 173.16 2js3 s GLU 47 N 0.53 4.47 0.25 12.44 2.02 -1.22 -4.95 118.70 132.24 2js3 s GLU 47 Ca 0.33 1.40 -0.05 0.00 0.02 0.00 0.00 54.97 56.68 2js3 s GLU 47 Cb -0.17 -2.75 0.30 0.00 0.10 0.00 0.00 34.13 31.61 2js3 s GLU 47 CO 0.16 0.16 1.86 1.49 0.02 0.00 0.00 175.26 178.95 2js3 h GLU 48 N 3.01 1.12 -3.15 1.61 4.57 -1.97 -3.35 114.58 116.42 2js3 h GLU 48 Ca -0.47 -0.15 -0.54 0.00 -1.18 0.00 0.00 59.36 57.02 2js3 h GLU 48 Cb 1.20 -0.21 -0.40 0.00 -0.16 0.00 0.00 28.75 29.18 2js3 h GLU 48 CO 0.64 0.85 -0.77 0.34 -1.18 0.00 0.00 179.01 178.89 2js3 s ASP 49 N -6.35 3.47 0.00 1.04 2.15 -1.26 -5.02 116.67 110.70 2js3 s ASP 49 Ca -0.12 -1.26 0.00 0.00 0.43 0.00 0.00 52.55 51.61 2js3 s ASP 49 Cb 0.17 -0.53 0.00 0.00 -0.30 0.00 0.00 42.92 42.26 2js3 s ASP 49 CO 0.82 -0.40 0.00 0.61 -0.17 0.00 0.00 175.17 176.02 2js3 n GLY 50 N 5.11 -0.77 3.14 2.66 0.00 -1.26 -5.14 105.19 108.93 2js3 n GLY 50 Ca -0.05 0.33 -0.13 0.00 0.00 0.00 0.00 46.02 46.17 2js3 n GLY 50 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2js3 s GLY 51 N 0.00 -0.19 0.05 -0.02 0.00 -1.26 -4.96 107.32 100.93 2js3 s GLY 51 Ca 0.00 0.73 -0.31 0.00 0.00 0.00 0.00 44.72 45.15 2js3 s GLY 51 CO 0.00 0.65 1.29 0.00 0.00 0.00 0.00 173.10 175.03 2js3 s ALA 52 N 0.18 3.49 -0.27 3.20 0.00 -1.26 -3.42 121.76 123.68 2js3 s ALA 52 Ca -0.00 0.89 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 2js3 s ALA 52 Cb -0.02 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2js3 s ALA 52 CO 0.00 -0.62 0.11 -1.01 0.00 0.00 0.00 175.76 174.24 2js3 s HIS 53 N 1.50 3.13 -0.29 0.00 3.76 0.14 -1.25 115.29 122.28 2js3 s HIS 53 Ca 0.61 -0.40 -0.15 0.00 -0.15 0.00 0.00 55.06 54.97 2js3 s HIS 53 Cb -0.31 -2.29 -0.03 0.00 1.11 0.00 0.00 32.58 31.06 2js3 s HIS 53 CO 0.28 -0.36 0.36 1.21 -0.85 0.00 0.00 174.74 175.38 2js3 s ASN 54 N 1.63 6.22 -0.10 1.40 2.47 0.45 0.11 114.94 127.13 2js3 s ASN 54 Ca 0.06 0.16 -0.02 0.00 0.42 0.00 0.00 52.86 53.48 2js3 s ASN 54 Cb -0.16 -2.20 -0.03 0.00 -1.45 0.00 0.00 41.25 37.41 2js3 s ASN 54 CO 0.05 -0.21 0.01 -1.10 -3.72 0.00 0.00 177.10 172.13 2js3 s GLN 55 N 2.05 3.08 -0.79 0.43 1.11 -1.20 -0.19 119.66 124.14 2js3 s GLN 55 Ca 0.14 -0.40 -0.17 0.00 0.01 0.00 0.00 55.36 54.94 2js3 s GLN 55 Cb -0.16 -2.83 0.15 0.00 -1.01 0.00 0.00 33.01 29.16 2js3 s GLN 55 CO 0.10 0.66 0.88 0.00 0.01 0.00 0.00 175.29 176.94 2js3 h LYS 57 N 8.57 0.61 0.00 0.00 1.57 -1.79 0.23 116.57 125.77 2js3 h LYS 57 Ca 0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2js3 h LYS 57 Cb 1.05 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2js3 h LYS 57 CO 0.98 0.41 0.00 -0.07 -0.57 0.00 0.00 179.45 180.20 2js3 h LEU 58 N 0.63 0.00 0.00 2.94 4.07 -1.92 -3.11 115.31 117.92 2js3 h LEU 58 Ca 0.45 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 58.14 2js3 h LEU 58 Cb 0.61 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.30 2js3 h LEU 58 CO -0.35 0.00 -2.10 0.00 -1.08 0.00 0.00 178.44 174.91 2js3 n GLY 60 N 1.59 0.42 3.30 0.00 0.00 0.60 -4.78 105.19 106.31 2js3 n GLY 60 Ca -0.23 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2js3 n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2js3 s ALA 61 N -2.35 2.04 -0.01 4.61 0.00 -1.21 -4.99 121.76 119.85 2js3 s ALA 61 Ca 0.02 -1.14 0.04 0.00 0.00 0.00 0.00 51.96 50.88 2js3 s ALA 61 Cb -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 2js3 s ALA 61 CO 0.02 0.48 -0.13 -1.54 0.00 0.00 0.00 175.76 174.59 2js3 s SER 62 N -1.00 1.56 -0.05 0.00 1.04 -1.26 -0.30 113.70 113.68 2js3 s SER 62 Ca 0.10 -0.26 -0.05 0.00 0.48 0.00 0.00 55.95 56.22 2js3 s SER 62 Cb -0.09 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 65.87 2js3 s SER 62 CO 0.01 0.15 0.14 0.54 0.98 0.00 0.00 173.24 175.06 2js3 s VAL 63 N -0.36 0.00 0.37 5.02 0.11 0.73 -4.95 120.40 121.32 2js3 s VAL 63 Ca 0.05 -0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 58.84 2js3 s VAL 63 Cb -0.05 -0.20 -0.12 0.00 -1.53 0.00 0.00 36.38 34.47 2js3 s VAL 63 CO -0.00 -0.00 0.89 -0.81 -3.33 0.00 0.00 175.10 171.84 2js3 n PRO 64 N 2.99 1.13 0.30 1.54 -0.04 -1.26 -0.41 135.00 139.24 2js3 n PRO 64 Ca -0.12 0.40 0.19 0.00 -0.04 0.00 0.00 63.50 63.92 2js3 n PRO 64 Cb 0.59 -1.82 0.98 0.00 -0.04 0.00 0.00 33.50 33.21 2js3 n PRO 64 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 2js3 h TRP 65 N 1.49 0.00 -0.56 0.54 0.09 -1.54 -2.59 115.95 113.38 2js3 h TRP 65 Ca -0.41 0.00 -0.09 0.00 0.09 0.00 0.00 58.89 58.47 2js3 h TRP 65 Cb 1.36 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.57 2js3 h TRP 65 CO 0.43 0.00 -0.02 1.25 0.09 0.00 0.00 178.44 180.19 2js3 h LEU 66 N 0.00 0.95 0.00 0.11 7.12 -1.88 -3.40 115.31 118.21 2js3 h LEU 66 Ca 0.03 -0.27 0.00 0.00 0.13 0.00 0.00 57.88 57.77 2js3 h LEU 66 Cb 0.32 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 40.20 2js3 h LEU 66 CO -0.00 1.02 0.00 0.00 -0.13 0.00 0.00 178.44 179.33 2js3 n GLN 67 N -4.18 0.00 0.00 1.25 3.00 -0.97 -5.12 117.38 111.35 2js3 n GLN 67 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2js3 n GLN 67 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.58 2js3 n GLN 67 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2js3 n THR 68 N 0.00 0.00 0.19 5.09 5.66 -1.26 -5.01 114.28 118.96 2js3 n THR 68 Ca 0.00 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.11 2js3 n THR 68 Cb 0.00 0.00 0.22 0.00 -1.55 0.00 0.00 70.33 69.00 2js3 n THR 68 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2js3 n GLY 69 N -0.25 1.82 0.11 1.09 0.00 -1.26 -4.10 105.19 102.60 2js3 n GLY 69 Ca 0.00 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 2js3 n GLY 69 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2js3 h ASP 70 N 4.23 0.11 0.20 1.61 1.82 -2.00 -3.38 116.42 119.01 2js3 h ASP 70 Ca 0.00 -0.62 0.00 0.00 -0.39 0.00 0.00 57.03 56.02 2js3 h ASP 70 Cb 0.96 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.93 2js3 h ASP 70 CO 0.00 1.58 -0.24 1.21 -1.61 0.00 0.00 179.24 180.18 2js3 n GLU 71 N -4.21 0.95 -1.50 0.28 2.13 -1.26 -4.92 120.64 112.12 2js3 n GLU 71 Ca -0.32 -0.58 -0.30 0.00 0.66 0.00 0.00 57.16 56.62 2js3 n GLU 71 Cb 0.77 -1.49 0.08 0.00 0.27 0.00 0.00 31.44 31.08 2js3 n GLU 71 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 2js3 s ILE 72 N -2.45 3.31 0.30 6.31 2.07 -1.26 -4.99 121.20 124.49 2js3 s ILE 72 Ca 0.25 0.42 -0.29 0.00 -1.41 0.00 0.00 60.65 59.63 2js3 s ILE 72 Cb 0.19 -3.12 -0.10 0.00 0.13 0.00 0.00 42.46 39.56 2js3 s ILE 72 CO 0.50 -0.55 1.30 -0.75 -1.91 0.00 0.00 174.94 173.53 2js3 s LYS 73 N -5.08 4.38 0.14 3.50 2.20 -1.26 -5.01 119.74 118.61 2js3 s LYS 73 Ca 0.60 2.16 0.02 0.00 -0.36 0.00 0.00 55.97 58.40 2js3 s LYS 73 Cb -0.15 -3.10 -0.01 0.00 -1.51 0.00 0.00 37.83 33.06 2js3 s LYS 73 CO 0.55 -0.18 0.13 -2.39 -0.36 0.00 0.00 175.35 173.10 2js3 n HIS 74 N 1.25 -0.45 -3.12 4.03 1.44 -1.26 -5.01 115.22 112.10 2js3 n HIS 74 Ca 0.01 -1.10 -0.44 0.00 -2.01 0.00 0.00 57.72 54.19 2js3 n HIS 74 Cb 0.42 0.14 -0.06 0.00 0.12 0.00 0.00 29.99 30.61 2js3 n HIS 74 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2js3 s ALA 75 N -2.43 3.36 -1.31 1.59 0.00 -1.26 -4.90 121.76 116.79 2js3 s ALA 75 Ca 0.15 -1.67 0.20 0.00 0.00 0.00 0.00 51.96 50.64 2js3 s ALA 75 Cb 0.01 -3.39 0.96 0.00 0.00 0.00 0.00 23.12 20.69 2js3 s ALA 75 CO 0.11 -2.04 1.62 -0.25 0.00 0.00 0.00 175.76 175.20 2js3 n ASP 76 N 6.32 0.00 0.14 0.00 8.00 -1.26 -2.26 116.55 127.49 2js3 n ASP 76 Ca -0.05 0.13 -0.01 0.00 0.71 0.00 0.00 54.79 55.57 2js3 n ASP 76 Cb 0.46 -0.34 0.18 0.00 -0.02 0.00 0.00 41.12 41.40 2js3 n ASP 76 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2js3 h ASP 77 N 0.00 0.03 -3.99 -2.24 1.82 -2.00 -3.46 116.42 106.59 2js3 h ASP 77 Ca 0.00 -0.02 -0.49 0.00 -0.39 0.00 0.00 57.03 56.13 2js3 h ASP 77 Cb 0.23 -0.01 0.04 0.00 0.68 0.00 0.00 39.33 40.26 2js3 h ASP 77 CO 0.00 0.61 0.44 0.00 -1.61 0.00 0.00 179.24 178.68 2js3 n PRO 79 N -0.30 0.04 -0.25 0.00 -0.04 -1.26 -2.25 135.00 130.95 2js3 n PRO 79 Ca 0.06 0.41 -0.06 0.00 -0.04 0.00 0.00 63.50 63.87 2js3 n PRO 79 Cb 0.49 -1.60 0.08 0.00 -0.04 0.00 0.00 33.50 32.43 2js3 n PRO 79 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2js3 h VAL 80 N 0.00 1.26 -0.19 0.52 2.07 -1.92 0.38 116.25 118.37 2js3 h VAL 80 Ca 0.00 -0.89 -0.14 0.00 0.82 0.00 0.00 66.70 66.49 2js3 h VAL 80 Cb 0.15 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2js3 h VAL 80 CO 0.00 0.35 -0.49 0.58 0.02 0.00 0.00 177.57 178.03 2js3 h VAL 81 N 1.07 1.32 0.45 2.57 2.07 -1.76 -1.30 116.25 120.67 2js3 h VAL 81 Ca 0.23 -1.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.03 2js3 h VAL 81 Cb 0.30 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 2js3 h VAL 81 CO -0.01 0.53 -0.23 0.40 0.02 0.00 0.00 177.57 178.28 2js3 h ILE 82 N 0.39 0.53 -0.75 4.57 1.08 -1.50 -1.09 117.51 120.75 2js3 h ILE 82 Ca 0.02 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.53 2js3 h ILE 82 Cb 1.00 0.53 -0.05 0.00 -3.07 0.00 0.00 36.82 35.23 2js3 h ILE 82 CO 0.09 0.00 0.46 0.00 -0.69 0.00 0.00 178.15 178.01 2js3 h ALA 83 N -0.07 0.99 -0.47 1.87 0.00 -0.86 -0.88 119.26 119.83 2js3 h ALA 83 Ca -0.06 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2js3 h ALA 83 Cb 0.48 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2js3 h ALA 83 CO 0.09 0.23 0.29 -0.22 0.00 0.00 0.00 179.25 179.65 2js3 h LYS 84 N 0.89 0.57 -0.60 0.00 3.64 -1.10 -0.12 116.57 119.86 2js3 h LYS 84 Ca 0.31 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.62 2js3 h LYS 84 Cb 0.06 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2js3 h LYS 84 CO -0.13 0.38 0.25 0.37 -2.27 0.00 0.00 179.45 178.05 2js3 h GLN 85 N 0.59 0.88 0.23 1.90 4.15 -0.60 -2.31 115.11 119.96 2js3 h GLN 85 Ca 0.18 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 2js3 h GLN 85 Cb -0.02 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.53 2js3 h GLN 85 CO -0.07 0.75 -0.11 0.82 -1.93 0.00 0.00 178.83 178.29 2js3 h ILE 86 N 0.82 0.83 0.00 2.39 2.04 -0.71 -1.82 117.51 121.06 2js3 h ILE 86 Ca 0.20 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2js3 h ILE 86 Cb 0.18 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2js3 h ILE 86 CO -0.02 0.09 -0.04 0.17 0.00 0.00 0.00 178.15 178.35 2js3 h LEU 87 N -0.52 0.00 0.09 1.44 8.10 -1.03 -1.89 115.31 121.50 2js3 h LEU 87 Ca -0.03 0.00 -0.26 0.00 0.11 0.00 0.00 57.88 57.70 2js3 h LEU 87 Cb 0.39 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.61 2js3 h LEU 87 CO 0.05 0.04 -1.19 0.28 -4.11 0.00 0.00 178.44 173.51 2js3 h SER 88 N 0.00 0.34 -4.95 0.17 0.02 -1.25 -3.48 113.55 104.41 2js3 h SER 88 Ca -0.00 -0.37 -0.41 0.00 -0.84 0.00 0.00 61.79 60.18 2js3 h SER 88 Cb 0.40 -0.11 0.06 0.00 0.14 0.00 0.00 62.40 62.89 2js3 h SER 88 CO 0.00 1.28 -0.63 -1.20 -1.14 0.00 0.00 176.83 175.15 2js3 n SER 89 N -3.50 -5.96 -4.06 3.07 7.64 -0.70 -4.98 113.62 105.13 2js3 n SER 89 Ca -0.07 -0.37 -0.08 0.00 1.01 0.00 0.00 58.87 59.36 2js3 n SER 89 Cb 1.00 -4.79 -0.10 0.00 -1.01 0.00 0.00 64.21 59.31 2js3 n SER 89 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2js3 s ARG 90 N -5.91 0.52 0.96 1.43 1.70 -1.26 -5.12 118.95 111.28 2js3 s ARG 90 Ca 0.39 -1.02 -0.14 0.00 -0.47 0.00 0.00 55.73 54.49 2js3 s ARG 90 Cb -0.18 0.14 0.17 0.00 -0.57 0.00 0.00 34.95 34.52 2js3 s ARG 90 CO 0.49 -0.08 1.19 -1.25 -1.08 0.00 0.00 175.30 174.57 2js3 s PRO 91 N -3.05 0.72 -0.66 3.89 0.04 -1.26 -4.96 135.00 129.71 2js3 s PRO 91 Ca -0.01 0.01 -0.26 0.00 0.04 0.00 0.00 61.00 60.78 2js3 s PRO 91 Cb 0.02 -1.82 0.04 0.00 0.04 0.00 0.00 34.50 32.78 2js3 s PRO 91 CO -0.07 -2.43 1.16 0.21 0.04 0.00 0.00 177.00 175.92 2js3 s LYS 92 N -5.52 3.28 -0.08 4.56 2.36 -1.26 -4.98 119.74 118.11 2js3 s LYS 92 Ca 0.68 -0.20 0.03 0.00 -2.55 0.00 0.00 55.97 53.93 2js3 s LYS 92 Cb -0.10 -4.13 0.01 0.00 -1.05 0.00 0.00 37.83 32.56 2js3 s LYS 92 CO 0.53 -1.89 -0.17 -1.17 1.55 0.00 0.00 175.35 174.20 2js3 s LEU 93 N 5.04 1.84 -0.03 5.43 0.20 -1.26 -5.12 118.68 124.78 2js3 s LEU 93 Ca 0.35 -0.41 -0.01 0.00 0.69 0.00 0.00 54.13 54.75 2js3 s LEU 93 Cb -0.10 -1.07 0.03 0.00 -0.43 0.00 0.00 46.19 44.62 2js3 s LEU 93 CO 0.18 0.09 0.06 -2.28 -0.29 0.00 0.00 176.35 174.11 2js3 s HIS 94 N 0.51 -0.04 -0.04 5.38 2.46 -1.26 -5.14 115.29 117.17 2js3 s HIS 94 Ca -0.16 0.22 -0.21 0.00 0.47 0.00 0.00 55.06 55.37 2js3 s HIS 94 Cb -0.17 -0.13 -0.05 0.00 -0.13 0.00 0.00 32.58 32.11 2js3 s HIS 94 CO 0.06 -0.09 0.63 0.00 -2.47 0.00 0.00 174.74 172.86 2js3 s ALA 95 N 0.82 3.43 -0.14 1.58 0.00 -1.26 -5.34 121.76 120.85 2js3 s ALA 95 Ca -0.07 0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.96 2js3 s ALA 95 Cb -0.09 -2.82 0.01 0.00 0.00 0.00 0.00 23.12 20.22 2js3 s ALA 95 CO -0.03 0.05 0.54 1.33 0.00 0.00 0.00 175.76 177.65