#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2js3 s GLY 2 N 0.00 2.34 -0.09 -5.12 0.00 -1.26 -4.64 107.32 98.54 2js3 s GLY 2 Ca 0.00 1.30 -0.08 0.00 0.00 0.00 0.00 44.72 45.95 2js3 s GLY 2 CO 0.00 2.26 0.24 -1.35 0.00 0.00 0.00 173.10 174.24 2js3 s SER 3 N 0.36 -0.25 0.22 1.64 1.04 -1.26 -5.11 113.70 110.34 2js3 s SER 3 Ca 0.59 0.48 0.00 0.00 0.48 0.00 0.00 55.95 57.50 2js3 s SER 3 Cb -0.41 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2js3 s SER 3 CO 0.43 -0.10 0.00 -0.24 0.98 0.00 0.00 173.24 174.31 2js3 n SER 4 N 3.16 -3.67 -3.62 7.02 2.88 -1.26 -5.07 113.62 113.06 2js3 n SER 4 Ca -0.15 0.59 -0.04 0.00 -1.33 0.00 0.00 58.87 57.94 2js3 n SER 4 Cb 0.57 -1.31 -0.06 0.00 -0.75 0.00 0.00 64.21 62.67 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 -3.42 -1.14 -0.04 0.66 -3.43 -1.26 -5.09 115.29 101.56 2js3 s HIS 5 Ca 0.00 1.97 -0.04 0.00 -0.80 0.00 0.00 55.06 56.19 2js3 s HIS 5 Cb 0.00 0.59 0.01 0.00 -1.43 0.00 0.00 32.58 31.75 2js3 s HIS 5 CO 0.00 -0.61 0.07 1.58 -2.00 0.00 0.00 174.74 173.78 2js3 n HIS 6 N 5.42 -3.49 -4.01 0.38 -0.00 -1.26 -5.03 115.22 107.24 2js3 n HIS 6 Ca -0.10 2.06 -0.26 0.00 -0.00 0.00 0.00 57.72 59.42 2js3 n HIS 6 Cb 0.49 -3.34 -0.04 0.00 -0.00 0.00 0.00 29.99 27.10 2js3 n HIS 6 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2js3 s HIS 7 N -0.46 3.32 0.00 1.57 4.02 -1.26 -5.11 115.29 117.37 2js3 s HIS 7 Ca -0.08 0.05 0.00 0.00 1.02 0.00 0.00 55.06 56.04 2js3 s HIS 7 Cb 0.01 -1.59 0.00 0.00 -1.02 0.00 0.00 32.58 29.98 2js3 s HIS 7 CO 0.22 0.52 0.00 -2.39 1.02 0.00 0.00 174.74 174.11 2js3 n HIS 8 N -0.50 -0.44 -0.97 1.40 1.44 -1.26 -5.13 115.22 109.77 2js3 n HIS 8 Ca -0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.63 2js3 n HIS 8 Cb 0.54 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.65 2js3 n HIS 8 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2js3 n HIS 9 N 0.00 -0.88 -2.90 -1.40 -0.00 -1.26 -4.90 115.22 103.88 2js3 n HIS 9 Ca 0.00 0.53 -0.43 0.00 -0.00 0.00 0.00 57.72 57.81 2js3 n HIS 9 Cb 0.00 -2.31 -0.03 0.00 -0.00 0.00 0.00 29.99 27.64 2js3 n HIS 9 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2js3 s HIS 10 N -0.10 2.86 -0.12 1.57 0.00 -1.26 -5.00 115.29 113.24 2js3 s HIS 10 Ca 0.00 -0.91 -0.15 0.00 -3.00 0.00 0.00 55.06 51.00 2js3 s HIS 10 Cb 0.00 -4.27 -0.05 0.00 -4.00 0.00 0.00 32.58 24.26 2js3 s HIS 10 CO 0.00 -1.57 0.36 -1.12 -1.00 0.00 0.00 174.74 171.42 2js3 s SER 11 N 3.69 6.57 -0.26 7.38 0.01 -1.26 -5.07 113.70 124.76 2js3 s SER 11 Ca 0.26 0.67 -0.25 0.00 1.31 0.00 0.00 55.95 57.93 2js3 s SER 11 Cb -0.13 -2.22 0.07 0.00 0.21 0.00 0.00 66.02 63.96 2js3 s SER 11 CO 0.02 0.11 0.74 -0.55 0.41 0.00 0.00 173.24 173.97 2js3 s SER 12 N 0.26 -0.72 -0.11 2.44 0.15 -1.26 -5.03 113.70 109.43 2js3 s SER 12 Ca 0.21 1.37 -0.30 0.00 0.70 0.00 0.00 55.95 57.93 2js3 s SER 12 Cb -0.14 1.38 0.09 0.00 -1.71 0.00 0.00 66.02 65.64 2js3 s SER 12 CO 0.07 -0.26 0.79 -0.83 1.20 0.00 0.00 173.24 174.21 2js3 s GLY 13 N 0.29 -0.47 -0.96 9.45 0.00 -1.26 -5.04 107.32 109.33 2js3 s GLY 13 Ca -0.00 1.63 -0.12 0.00 0.00 0.00 0.00 44.72 46.23 2js3 s GLY 13 CO 0.01 1.09 0.92 0.50 0.00 0.00 0.00 173.10 175.62 2js3 s ARG 14 N -0.97 3.87 -0.03 2.90 0.52 -1.26 -4.97 118.95 119.02 2js3 s ARG 14 Ca -0.07 -2.81 -0.26 0.00 -0.52 0.00 0.00 55.73 52.07 2js3 s ARG 14 Cb -0.01 -4.48 0.06 0.00 0.52 0.00 0.00 34.95 31.04 2js3 s ARG 14 CO 0.06 -1.27 0.57 -2.00 0.02 0.00 0.00 175.30 172.68 2js3 s GLU 15 N -0.49 0.95 -0.27 3.54 2.56 -1.26 -5.11 118.70 118.62 2js3 s GLU 15 Ca 0.24 0.10 -0.02 0.00 0.00 0.00 0.00 54.97 55.28 2js3 s GLU 15 Cb -0.10 0.44 0.12 0.00 2.00 0.00 0.00 34.13 36.59 2js3 s GLU 15 CO -0.09 -0.29 0.25 1.21 -0.56 0.00 0.00 175.26 175.78 2js3 s ASN 16 N -1.30 1.95 -0.04 -1.70 3.04 -1.26 -4.87 114.94 110.76 2js3 s ASN 16 Ca -0.11 -0.73 0.01 0.00 0.04 0.00 0.00 52.86 52.07 2js3 s ASN 16 Cb -0.01 0.33 0.02 0.00 -1.54 0.00 0.00 41.25 40.04 2js3 s ASN 16 CO 0.07 -0.38 -0.05 -0.22 -3.04 0.00 0.00 177.10 173.48 2js3 s LEU 17 N 2.31 1.41 -1.08 3.21 0.20 -1.26 -5.08 118.68 118.39 2js3 s LEU 17 Ca 0.09 -0.14 -0.15 0.00 0.69 0.00 0.00 54.13 54.62 2js3 s LEU 17 Cb -0.15 -0.46 0.16 0.00 -0.43 0.00 0.00 46.19 45.31 2js3 s LEU 17 CO -0.29 -0.04 1.27 -0.47 -0.29 0.00 0.00 176.35 176.53 2js3 s TYR 18 N 0.81 3.41 0.27 5.38 5.04 -1.26 -4.95 117.35 126.04 2js3 s TYR 18 Ca -0.11 -1.87 0.00 0.00 -2.44 0.00 0.00 57.07 52.65 2js3 s TYR 18 Cb -0.14 -4.25 0.00 0.00 0.35 0.00 0.00 41.96 37.92 2js3 s TYR 18 CO 0.01 -1.39 0.00 1.19 -1.34 0.00 0.00 175.55 174.02 2js3 n PHE 19 N 5.76 -3.31 0.00 4.97 3.72 -1.26 -4.79 117.46 122.56 2js3 n PHE 19 Ca 0.30 1.43 0.00 0.00 -0.05 0.00 0.00 57.45 59.13 2js3 n PHE 19 Cb 0.45 -2.60 0.00 0.00 -0.94 0.00 0.00 39.48 36.39 2js3 n PHE 19 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2js3 n GLN 20 N -3.76 0.00 -1.76 -1.08 6.02 -1.26 -4.34 117.38 111.20 2js3 n GLN 20 Ca 0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.65 2js3 n GLN 20 Cb 0.52 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.76 2js3 n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2js3 n GLY 21 N 0.00 4.81 3.63 1.08 0.00 -1.26 -4.94 105.19 108.51 2js3 n GLY 21 Ca 0.00 -1.94 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.05 4.15 -0.09 1.61 -1.94 -1.26 -5.00 119.30 115.71 2js3 s MET 22 Ca 0.57 0.72 -0.06 0.00 -1.71 0.00 0.00 55.69 55.20 2js3 s MET 22 Cb 0.25 -3.64 0.03 0.00 2.01 0.00 0.00 34.83 33.48 2js3 s MET 22 CO -0.13 -0.45 0.24 -0.08 -0.01 0.00 0.00 175.02 174.59 2js3 s THR 23 N 2.61 -0.02 0.00 2.05 -1.32 -1.26 -4.90 115.64 112.80 2js3 s THR 23 Ca 0.30 0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.86 2js3 s THR 23 Cb -0.15 -0.35 0.00 0.00 -1.51 0.00 0.00 72.50 70.49 2js3 s THR 23 CO 0.08 0.03 0.00 -0.67 -2.21 0.00 0.00 174.62 171.85 2js3 n ASP 24 N 3.62 0.00 0.00 8.08 -0.08 -1.26 -3.19 116.55 123.72 2js3 n ASP 24 Ca -0.19 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.19 2js3 n ASP 24 Cb 0.56 0.00 0.59 0.00 2.34 0.00 0.00 41.12 44.60 2js3 n ASP 24 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2js3 n THR 25 N 0.00 0.00 -0.21 5.18 -1.04 -1.26 -2.86 114.28 114.09 2js3 n THR 25 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 2js3 n THR 25 Cb 0.00 -0.50 0.35 0.00 -1.82 0.00 0.00 70.33 68.36 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 3.36 1.71 -0.28 2.41 0.00 -1.89 -1.37 119.26 123.19 2js3 h ALA 26 Ca 0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 2js3 h ALA 26 Cb 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2js3 h ALA 26 CO 0.00 0.15 -0.55 0.00 0.00 0.00 0.00 179.25 178.85 2js3 h ALA 27 N 1.59 0.50 0.20 0.00 0.00 -1.87 -3.23 119.26 116.46 2js3 h ALA 27 Ca 0.35 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2js3 h ALA 27 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2js3 h ALA 27 CO -0.13 0.68 -0.10 0.93 0.00 0.00 0.00 179.25 180.64 2js3 h GLU 28 N 0.65 -0.26 -0.88 0.00 4.39 -1.48 0.12 114.58 117.11 2js3 h GLU 28 Ca 0.01 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 2js3 h GLU 28 Cb 1.15 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.81 2js3 h GLU 28 CO 0.12 -0.12 0.49 -0.44 -1.16 0.00 0.00 179.01 177.89 2js3 h ASP 29 N -0.34 1.10 -0.02 1.42 3.32 -1.44 0.39 116.42 120.85 2js3 h ASP 29 Ca -0.03 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.84 2js3 h ASP 29 Cb 0.26 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.54 2js3 h ASP 29 CO 0.05 0.87 -0.33 0.58 -1.72 0.00 0.00 179.24 178.69 2js3 h VAL 30 N 1.23 1.49 0.00 -1.35 2.07 -1.56 -3.21 116.25 114.92 2js3 h VAL 30 Ca 0.31 -1.90 -0.04 0.00 0.82 0.00 0.00 66.70 65.90 2js3 h VAL 30 Cb 0.02 2.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 2js3 h VAL 30 CO -0.05 0.53 -0.18 0.08 0.02 0.00 0.00 177.57 177.97 2js3 h ARG 31 N -0.34 0.00 -0.46 1.57 -0.00 -0.55 -2.36 114.38 112.25 2js3 h ARG 31 Ca -0.04 0.00 0.09 0.00 -0.00 0.00 0.00 59.98 60.03 2js3 h ARG 31 Cb 1.04 0.00 -0.08 0.00 -0.00 0.00 0.00 29.97 30.94 2js3 h ARG 31 CO 0.07 0.18 -0.02 -0.22 -0.00 0.00 0.00 179.97 179.97 2js3 h LYS 32 N 0.00 0.09 -0.32 0.08 3.64 -0.22 0.56 116.57 120.39 2js3 h LYS 32 Ca -0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2js3 h LYS 32 Cb 0.38 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2js3 h LYS 32 CO 0.02 0.06 0.05 0.82 -2.27 0.00 0.00 179.45 178.13 2js3 h ILE 33 N 0.09 1.23 -0.63 2.00 2.04 -1.49 -2.65 117.51 118.10 2js3 h ILE 33 Ca 0.23 -0.81 -0.09 0.00 1.00 0.00 0.00 64.86 65.18 2js3 h ILE 33 Cb 0.34 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2js3 h ILE 33 CO -0.40 0.27 0.05 0.00 0.00 0.00 0.00 178.15 178.07 2js3 h ALA 34 N 0.89 0.88 -0.58 1.87 0.00 -1.23 -2.60 119.26 118.49 2js3 h ALA 34 Ca 0.10 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2js3 h ALA 34 Cb 0.35 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2js3 h ALA 34 CO 0.01 0.67 0.18 1.15 0.00 0.00 0.00 179.25 181.25 2js3 h THR 35 N 1.00 1.24 -0.40 0.00 2.02 0.16 -0.48 112.91 116.44 2js3 h THR 35 Ca 0.19 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 2js3 h THR 35 Cb 0.51 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 2js3 h THR 35 CO 0.02 0.31 0.16 0.00 0.37 0.00 0.00 175.52 176.38 2js3 h ALA 36 N 1.05 0.52 0.00 6.16 0.00 -1.30 -1.40 119.26 124.29 2js3 h ALA 36 Ca 0.19 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2js3 h ALA 36 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2js3 h ALA 36 CO -0.00 0.12 -0.46 1.37 0.00 0.00 0.00 179.25 180.28 2js3 h LEU 37 N 0.50 0.00 -0.95 0.00 8.10 -1.35 -2.38 115.31 119.23 2js3 h LEU 37 Ca 0.13 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.04 2js3 h LEU 37 Cb 0.19 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.40 2js3 h LEU 37 CO -0.01 0.46 -0.37 0.25 -4.11 0.00 0.00 178.44 174.65 2js3 h LEU 38 N 0.00 0.00 0.00 0.17 5.85 -0.65 -2.47 115.31 118.21 2js3 h LEU 38 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2js3 h LEU 38 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2js3 h LEU 38 CO 0.06 0.37 -0.63 0.29 -0.34 0.00 0.00 178.44 178.20 2js3 n LYS 39 N -3.55 0.06 0.00 1.25 5.02 -0.57 -4.85 118.16 115.53 2js3 n LYS 39 Ca -0.00 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2js3 n LYS 39 Cb 0.51 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 2js3 n LYS 39 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2js3 n THR 40 N -1.61 0.00 0.00 -0.18 -2.24 -0.93 -4.99 114.28 104.33 2js3 n THR 40 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2js3 n THR 40 Cb 0.36 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2js3 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2js3 n ALA 41 N -3.00 0.00 -1.24 6.98 0.00 -0.95 -4.80 120.51 117.50 2js3 n ALA 41 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2js3 n ALA 41 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.66 2js3 n ALA 41 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2js3 s ILE 42 N 0.00 1.76 -0.09 0.00 -4.36 -1.26 -4.87 121.20 112.37 2js3 s ILE 42 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 60.65 60.22 2js3 s ILE 42 Cb 0.00 -2.57 0.04 0.00 1.25 0.00 0.00 42.46 41.17 2js3 s ILE 42 CO 0.00 0.00 0.42 -1.83 0.24 0.00 0.00 174.94 173.77 2js3 s GLU 43 N -5.37 0.65 -0.28 0.37 -1.05 -1.23 -5.02 118.70 106.78 2js3 s GLU 43 Ca 0.70 0.25 -0.02 0.00 -0.15 0.00 0.00 54.97 55.75 2js3 s GLU 43 Cb -0.11 0.30 0.04 0.00 -0.44 0.00 0.00 34.13 33.92 2js3 s GLU 43 CO 0.56 -0.15 -0.03 0.96 0.95 0.00 0.00 175.26 177.55 2js3 s ILE 44 N -0.57 2.95 0.02 1.83 -4.36 -1.26 -1.52 121.20 118.29 2js3 s ILE 44 Ca -0.07 -1.22 -0.00 0.00 -0.26 0.00 0.00 60.65 59.11 2js3 s ILE 44 Cb -0.03 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 41.03 2js3 s ILE 44 CO 0.03 0.03 0.13 0.68 0.24 0.00 0.00 174.94 176.05 2js3 s VAL 45 N 1.29 4.98 -0.01 8.37 -7.23 -1.01 -4.89 120.40 121.89 2js3 s VAL 45 Ca -0.03 -0.42 0.08 0.00 -1.81 0.00 0.00 61.98 59.79 2js3 s VAL 45 Cb -0.18 -3.34 -0.02 0.00 0.56 0.00 0.00 36.38 33.39 2js3 s VAL 45 CO -0.03 0.26 -0.24 -0.55 -0.31 0.00 0.00 175.10 174.23 2js3 s SER 46 N -2.07 2.84 0.66 4.85 0.15 -1.26 -0.31 113.70 118.56 2js3 s SER 46 Ca 0.28 -0.46 -0.04 0.00 0.70 0.00 0.00 55.95 56.43 2js3 s SER 46 Cb -0.12 -0.31 0.06 0.00 -1.71 0.00 0.00 66.02 63.94 2js3 s SER 46 CO 0.19 0.29 0.94 -1.61 1.20 0.00 0.00 173.24 174.25 2js3 s GLU 47 N -0.67 2.20 0.02 5.44 2.02 -0.15 -4.93 118.70 122.63 2js3 s GLU 47 Ca 0.09 -0.54 -0.18 0.00 0.02 0.00 0.00 54.97 54.36 2js3 s GLU 47 Cb -0.09 -2.29 -0.10 0.00 0.10 0.00 0.00 34.13 31.75 2js3 s GLU 47 CO -0.00 -1.13 1.19 1.49 0.02 0.00 0.00 175.26 176.83 2js3 h GLU 48 N -0.40 -0.64 -0.03 1.61 4.81 -2.01 -3.34 114.58 114.58 2js3 h GLU 48 Ca -0.43 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2js3 h GLU 48 Cb 1.30 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.83 2js3 h GLU 48 CO 0.54 -0.43 0.00 -0.40 -0.73 0.00 0.00 179.01 178.00 2js3 n ASP 49 N -3.92 1.66 0.07 1.04 5.75 -1.26 -4.60 116.55 115.29 2js3 n ASP 49 Ca -0.08 -1.55 -0.05 0.00 -0.01 0.00 0.00 54.79 53.10 2js3 n ASP 49 Cb 0.26 -0.02 -0.09 0.00 -1.03 0.00 0.00 41.12 40.24 2js3 n ASP 49 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2js3 h GLY 50 N 0.33 0.00 0.00 6.12 0.00 -1.97 -3.50 103.07 104.05 2js3 h GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2js3 h GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2js3 n GLY 51 N 1.33 2.10 3.73 4.60 0.00 -1.25 -4.87 105.19 110.83 2js3 n GLY 51 Ca -0.01 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2js3 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2js3 s ALA 52 N -2.45 3.28 -0.09 4.61 0.00 -1.26 -0.97 121.76 124.87 2js3 s ALA 52 Ca 0.00 0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.37 2js3 s ALA 52 Cb 0.00 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 2js3 s ALA 52 CO 0.00 -0.07 -0.17 -1.01 0.00 0.00 0.00 175.76 174.51 2js3 s HIS 53 N 0.41 2.67 -0.34 0.00 3.76 0.58 -2.30 115.29 120.07 2js3 s HIS 53 Ca 0.44 -0.55 -0.18 0.00 -0.15 0.00 0.00 55.06 54.61 2js3 s HIS 53 Cb -0.21 -1.71 -0.01 0.00 1.11 0.00 0.00 32.58 31.76 2js3 s HIS 53 CO 0.25 -0.11 0.50 1.21 -0.85 0.00 0.00 174.74 175.73 2js3 s ASN 54 N -0.08 6.31 -0.39 1.40 3.84 0.13 -2.40 114.94 123.75 2js3 s ASN 54 Ca -0.03 0.01 -0.16 0.00 0.21 0.00 0.00 52.86 52.88 2js3 s ASN 54 Cb -0.14 -2.26 0.01 0.00 -0.55 0.00 0.00 41.25 38.31 2js3 s ASN 54 CO 0.04 -0.44 0.41 -1.10 -2.79 0.00 0.00 177.10 173.22 2js3 s GLN 55 N 2.34 3.31 -0.84 0.43 1.11 -0.57 -0.84 119.66 124.61 2js3 s GLN 55 Ca 0.18 -0.59 -0.26 0.00 0.01 0.00 0.00 55.36 54.71 2js3 s GLN 55 Cb -0.16 -3.89 0.04 0.00 -1.01 0.00 0.00 33.01 27.99 2js3 s GLN 55 CO 0.13 -0.71 1.35 0.00 0.01 0.00 0.00 175.29 176.06 2js3 h LYS 57 N 9.99 -0.11 -0.23 0.00 1.79 -1.89 0.02 116.57 126.13 2js3 h LYS 57 Ca -0.11 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.36 2js3 h LYS 57 Cb 1.04 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 2js3 h LYS 57 CO 1.33 -0.07 0.10 -0.07 -1.08 0.00 0.00 179.45 179.66 2js3 h LEU 58 N -0.11 0.32 -1.09 2.94 4.07 -1.96 -2.99 115.31 116.48 2js3 h LEU 58 Ca 0.24 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2js3 h LEU 58 Cb 0.48 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.14 2js3 h LEU 58 CO -0.59 0.39 -0.20 0.00 -1.08 0.00 0.00 178.44 176.96 2js3 n GLY 60 N 1.33 -0.34 3.64 0.00 0.00 -0.03 -4.98 105.19 104.81 2js3 n GLY 60 Ca 0.13 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.93 3.39 -0.14 4.61 0.00 -1.08 -4.93 121.76 120.68 2js3 s ALA 61 Ca 0.07 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.27 2js3 s ALA 61 Cb -0.03 -1.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.20 2js3 s ALA 61 CO 0.09 0.23 -0.09 -1.54 0.00 0.00 0.00 175.76 174.45 2js3 s SER 62 N 0.23 4.36 -0.02 0.00 1.04 -1.26 0.10 113.70 118.15 2js3 s SER 62 Ca 0.04 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.27 2js3 s SER 62 Cb -0.12 -1.66 -0.01 0.00 0.10 0.00 0.00 66.02 64.34 2js3 s SER 62 CO 0.01 0.18 -0.12 0.54 0.98 0.00 0.00 173.24 174.82 2js3 s VAL 63 N 0.29 0.97 0.45 5.02 0.11 -0.02 -4.92 120.40 122.30 2js3 s VAL 63 Ca -0.07 -0.50 -0.23 0.00 -2.93 0.00 0.00 61.98 58.25 2js3 s VAL 63 Cb -0.15 -0.83 -0.10 0.00 -1.53 0.00 0.00 36.38 33.77 2js3 s VAL 63 CO 0.04 0.28 0.95 -2.65 -3.33 0.00 0.00 175.10 170.40 2js3 n PRO 64 N 2.96 1.21 0.00 1.54 -0.02 -1.26 0.22 135.00 139.65 2js3 n PRO 64 Ca -0.16 0.44 0.02 0.00 -2.02 0.00 0.00 63.50 61.78 2js3 n PRO 64 Cb 0.55 -2.01 0.07 0.00 -0.02 0.00 0.00 33.50 32.10 2js3 n PRO 64 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2js3 n TRP 65 N -0.72 0.00 0.38 6.00 4.27 -0.97 -1.74 117.44 124.66 2js3 n TRP 65 Ca 0.10 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.85 2js3 n TRP 65 Cb 0.40 -0.43 0.48 0.00 -1.36 0.00 0.00 31.31 30.40 2js3 n TRP 65 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 2js3 h LEU 66 N 0.00 0.00-10.52 5.67 3.38 -1.88 -3.45 115.31 108.51 2js3 h LEU 66 Ca 0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 2js3 h LEU 66 Cb 0.05 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.81 2js3 h LEU 66 CO 0.00 0.00 -0.19 -1.10 0.09 0.00 0.00 178.44 177.24 2js3 s GLN 67 N -3.35 2.48 0.40 1.13 -0.21 -0.71 -5.02 119.66 114.37 2js3 s GLN 67 Ca 0.05 -1.54 0.21 0.00 0.02 0.00 0.00 55.36 54.10 2js3 s GLN 67 Cb 0.09 -2.62 0.30 0.00 1.00 0.00 0.00 33.01 31.79 2js3 s GLN 67 CO 0.52 -0.61 1.58 1.15 -2.12 0.00 0.00 175.29 175.81 2js3 h THR 68 N 0.43 0.22 0.00 -0.19 2.02 -1.86 -3.48 112.91 110.05 2js3 h THR 68 Ca -0.34 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 65.54 2js3 h THR 68 Cb 1.29 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.79 2js3 h THR 68 CO 0.45 0.13 0.00 0.61 0.37 0.00 0.00 175.52 177.07 2js3 n GLY 69 N 1.09 2.82 0.12 2.16 0.00 -1.26 -4.72 105.19 105.41 2js3 n GLY 69 Ca 0.03 -0.70 0.12 0.00 0.00 0.00 0.00 46.02 45.47 2js3 n GLY 69 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2js3 n ASP 70 N 2.33 0.69 0.17 1.61 2.03 -1.26 -3.03 116.55 119.09 2js3 n ASP 70 Ca 0.00 0.64 0.03 0.00 0.52 0.00 0.00 54.79 55.98 2js3 n ASP 70 Cb 0.00 -0.80 0.41 0.00 -0.72 0.00 0.00 41.12 40.01 2js3 n ASP 70 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2js3 h GLU 71 N 0.00 0.08 -6.86 -0.67 4.39 -1.98 -3.42 114.58 106.12 2js3 h GLU 71 Ca 0.00 -0.02 -0.51 0.00 0.34 0.00 0.00 59.36 59.16 2js3 h GLU 71 Cb 0.44 -0.01 0.05 0.00 -0.10 0.00 0.00 28.75 29.13 2js3 h GLU 71 CO 0.00 0.33 0.56 -1.50 -1.16 0.00 0.00 179.01 177.24 2js3 s ILE 72 N -4.48 3.06 -0.31 3.13 2.07 -1.17 -4.90 121.20 118.61 2js3 s ILE 72 Ca -0.04 1.05 -0.28 0.00 -1.41 0.00 0.00 60.65 59.96 2js3 s ILE 72 Cb 0.15 -3.66 -0.02 0.00 0.13 0.00 0.00 42.46 39.06 2js3 s ILE 72 CO 0.72 0.23 1.85 -0.54 -1.91 0.00 0.00 174.94 175.30 2js3 s LYS 73 N -1.72 3.33 0.27 3.50 -0.14 -1.26 -4.96 119.74 118.77 2js3 s LYS 73 Ca 0.48 1.53 -0.16 0.00 -1.36 0.00 0.00 55.97 56.47 2js3 s LYS 73 Cb -0.36 -4.22 -0.08 0.00 -1.68 0.00 0.00 37.83 31.49 2js3 s LYS 73 CO 0.47 -1.86 0.70 -1.01 -0.76 0.00 0.00 175.35 172.89 2js3 s HIS 74 N 7.00 3.47 0.61 3.18 3.76 -1.26 -4.93 115.29 127.12 2js3 s HIS 74 Ca 0.83 1.22 -0.16 0.00 -0.15 0.00 0.00 55.06 56.79 2js3 s HIS 74 Cb -0.24 -2.52 -0.03 0.00 1.11 0.00 0.00 32.58 30.90 2js3 s HIS 74 CO 0.34 0.20 1.09 0.00 -0.85 0.00 0.00 174.74 175.53 2js3 s ALA 75 N -1.80 2.62 -0.77 -1.40 0.00 -1.26 -0.11 121.76 119.03 2js3 s ALA 75 Ca 0.49 0.56 0.26 0.00 0.00 0.00 0.00 51.96 53.28 2js3 s ALA 75 Cb -0.12 -3.30 0.84 0.00 0.00 0.00 0.00 23.12 20.54 2js3 s ALA 75 CO 0.19 -0.98 1.76 -0.25 0.00 0.00 0.00 175.76 176.47 2js3 n ASP 76 N -2.00 0.67 -0.05 0.00 9.92 -1.26 -2.78 116.55 121.05 2js3 n ASP 76 Ca 0.10 0.51 0.15 0.00 -0.53 0.00 0.00 54.79 55.02 2js3 n ASP 76 Cb 0.52 -0.65 0.85 0.00 -0.64 0.00 0.00 41.12 41.20 2js3 n ASP 76 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2js3 n ASP 77 N -2.11 0.15 -4.56 -2.24 8.00 -1.26 -4.63 116.55 109.89 2js3 n ASP 77 Ca 0.06 -1.11 -0.42 0.00 0.71 0.00 0.00 54.79 54.03 2js3 n ASP 77 Cb 0.41 -0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.44 2js3 n ASP 77 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2js3 n PRO 79 N 5.93 0.00 0.13 0.00 -0.04 -1.26 -1.86 135.00 137.89 2js3 n PRO 79 Ca -0.03 0.18 0.03 0.00 -0.04 0.00 0.00 63.50 63.65 2js3 n PRO 79 Cb 0.49 -1.51 0.43 0.00 -0.04 0.00 0.00 33.50 32.87 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 1.15 -0.52 0.52 2.07 -1.93 -0.89 116.25 116.65 2js3 h VAL 80 Ca 0.00 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 2js3 h VAL 80 Cb 0.01 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2js3 h VAL 80 CO 0.00 0.20 0.14 -0.37 0.02 0.00 0.00 177.57 177.56 2js3 h VAL 81 N 0.22 1.22 -0.23 2.57 -1.51 -1.71 0.08 116.25 116.89 2js3 h VAL 81 Ca 0.05 -0.76 -0.05 0.00 -1.23 0.00 0.00 66.70 64.71 2js3 h VAL 81 Cb 0.29 0.66 -0.01 0.00 -2.13 0.00 0.00 31.29 30.10 2js3 h VAL 81 CO 0.01 0.28 -0.05 0.40 -1.23 0.00 0.00 177.57 176.99 2js3 h ILE 82 N 0.77 1.28 -0.43 7.19 1.08 -1.53 -2.58 117.51 123.29 2js3 h ILE 82 Ca 0.17 -1.04 0.05 0.00 -0.39 0.00 0.00 64.86 63.65 2js3 h ILE 82 Cb 0.26 1.50 -0.04 0.00 -3.07 0.00 0.00 36.82 35.46 2js3 h ILE 82 CO -0.00 0.32 0.18 0.00 -0.69 0.00 0.00 178.15 177.96 2js3 h ALA 83 N 0.76 0.53 -0.41 1.87 0.00 -0.64 0.04 119.26 121.40 2js3 h ALA 83 Ca 0.06 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2js3 h ALA 83 Cb 0.51 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2js3 h ALA 83 CO 0.02 -0.20 0.20 0.87 0.00 0.00 0.00 179.25 180.14 2js3 h LYS 84 N 0.37 0.39 -0.04 0.00 1.57 -1.01 -1.15 116.57 116.69 2js3 h LYS 84 Ca 0.19 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2js3 h LYS 84 Cb 0.15 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2js3 h LYS 84 CO -0.17 0.26 -0.09 1.96 -0.57 0.00 0.00 179.45 180.83 2js3 h GLN 85 N 0.40 0.06 -0.00 3.15 4.20 -0.95 -0.85 115.11 121.12 2js3 h GLN 85 Ca 0.18 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 2js3 h GLN 85 Cb 0.09 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2js3 h GLN 85 CO -0.13 0.16 -0.01 0.82 -0.67 0.00 0.00 178.83 179.00 2js3 h ILE 86 N 0.06 1.59 0.00 2.54 2.04 -0.22 0.19 117.51 123.71 2js3 h ILE 86 Ca 0.01 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.11 2js3 h ILE 86 Cb 0.20 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 39.07 2js3 h ILE 86 CO 0.01 0.46 0.00 0.00 0.00 0.00 0.00 178.15 178.62 2js3 n LEU 87 N -4.72 0.79 -1.31 1.44 -0.00 -0.51 -1.79 117.00 110.90 2js3 n LEU 87 Ca -0.09 0.62 0.12 0.00 -0.00 0.00 0.00 56.01 56.65 2js3 n LEU 87 Cb 0.37 -0.42 0.31 0.00 -0.00 0.00 0.00 43.42 43.68 2js3 n LEU 87 CO 0.34 -0.35 0.76 -1.20 -0.00 0.00 0.00 177.39 176.94 2js3 n SER 88 N -2.29 3.82 -3.37 1.45 7.64 -0.34 -5.00 113.62 115.52 2js3 n SER 88 Ca 0.04 -2.00 -0.20 0.00 1.01 0.00 0.00 58.87 57.72 2js3 n SER 88 Cb 0.35 -0.46 0.01 0.00 -1.01 0.00 0.00 64.21 63.11 2js3 n SER 88 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2js3 n SER 89 N 1.60 -6.29 -4.76 6.43 3.41 -0.74 -4.92 113.62 108.36 2js3 n SER 89 Ca 0.24 -0.26 -0.41 0.00 -0.26 0.00 0.00 58.87 58.18 2js3 n SER 89 Cb 0.61 -3.20 -0.02 0.00 -0.26 0.00 0.00 64.21 61.33 2js3 n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2js3 s ARG 90 N -3.40 4.39 0.11 4.33 1.70 0.04 -5.03 118.95 121.08 2js3 s ARG 90 Ca 0.15 2.15 0.00 0.00 -0.47 0.00 0.00 55.73 57.56 2js3 s ARG 90 Cb -0.02 -3.10 0.02 0.00 -0.57 0.00 0.00 34.95 31.27 2js3 s ARG 90 CO 0.83 -0.16 0.15 -0.35 -1.08 0.00 0.00 175.30 174.69 2js3 n PRO 91 N 1.17 0.53 -2.23 3.89 -0.04 -1.26 -5.02 135.00 132.04 2js3 n PRO 91 Ca 0.01 -0.40 -0.43 0.00 -0.04 0.00 0.00 63.50 62.64 2js3 n PRO 91 Cb 0.42 -0.10 -0.02 0.00 -0.04 0.00 0.00 33.50 33.76 2js3 n PRO 91 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2js3 s LYS 92 N -2.77 3.54 -0.09 0.54 2.20 -1.26 -4.97 119.74 116.94 2js3 s LYS 92 Ca 0.10 1.16 -0.08 0.00 -0.36 0.00 0.00 55.97 56.79 2js3 s LYS 92 Cb -0.01 -4.07 0.02 0.00 -1.51 0.00 0.00 37.83 32.27 2js3 s LYS 92 CO 0.06 -1.61 0.23 -1.17 -0.36 0.00 0.00 175.35 172.51 2js3 s LEU 93 N 5.79 1.06 -1.31 5.43 2.96 -1.26 -5.07 118.68 126.28 2js3 s LEU 93 Ca 0.67 0.46 -0.14 0.00 -0.22 0.00 0.00 54.13 54.91 2js3 s LEU 93 Cb -0.17 0.77 0.12 0.00 0.50 0.00 0.00 46.19 47.40 2js3 s LEU 93 CO 0.32 -0.09 1.81 1.41 -1.32 0.00 0.00 176.35 178.49 2js3 n HIS 94 N 3.09 4.01 -2.27 5.38 8.25 -1.26 -4.44 115.22 127.99 2js3 n HIS 94 Ca -0.14 -2.99 0.03 0.00 -0.26 0.00 0.00 57.72 54.35 2js3 n HIS 94 Cb 0.58 -2.31 0.02 0.00 1.12 0.00 0.00 29.99 29.39 2js3 n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2js3 n ALA 95 N 5.90 2.25 1.16 -1.41 0.00 -1.26 -5.32 120.51 121.84 2js3 n ALA 95 Ca 0.44 -1.86 0.13 0.00 0.00 0.00 0.00 53.44 52.15 2js3 n ALA 95 Cb 0.41 -0.63 0.24 0.00 0.00 0.00 0.00 19.45 19.46 2js3 n ALA 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78