#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 1.77 -0.38 -5.12 0.00 -1.26 -4.91 107.32 97.41 2js3 s GLY 2 Ca 0.00 -2.33 0.02 0.00 0.00 0.00 0.00 44.72 42.41 2js3 s GLY 2 CO 0.00 1.79 0.28 -0.56 0.00 0.00 0.00 173.10 174.60 2js3 s SER 3 N 3.54 2.15 -0.36 1.64 0.01 -1.26 -5.10 113.70 114.32 2js3 s SER 3 Ca 0.20 -2.65 -0.29 0.00 1.31 0.00 0.00 55.95 54.52 2js3 s SER 3 Cb -0.17 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 65.65 2js3 s SER 3 CO 0.03 -0.24 1.39 -0.94 0.41 0.00 0.00 173.24 173.89 2js3 s SER 4 N 0.54 6.45 -0.41 2.44 1.04 -1.26 -4.98 113.70 117.52 2js3 s SER 4 Ca 0.26 1.02 -0.23 0.00 0.48 0.00 0.00 55.95 57.48 2js3 s SER 4 Cb -0.09 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.51 2js3 s SER 4 CO -0.10 -1.30 0.78 -1.00 0.98 0.00 0.00 173.24 172.60 2js3 s HIS 5 N 5.06 3.04 -0.28 5.02 4.02 -1.26 -4.98 115.29 125.92 2js3 s HIS 5 Ca 0.60 0.32 -0.28 0.00 1.02 0.00 0.00 55.06 56.73 2js3 s HIS 5 Cb -0.16 -3.55 -0.05 0.00 -1.02 0.00 0.00 32.58 27.80 2js3 s HIS 5 CO 0.29 -0.88 2.27 1.58 1.02 0.00 0.00 174.74 179.02 2js3 n HIS 6 N 6.59 1.85 -2.72 1.40 -0.00 -1.26 -4.89 115.22 116.19 2js3 n HIS 6 Ca 0.02 -0.08 -0.43 0.00 -0.00 0.00 0.00 57.72 57.24 2js3 n HIS 6 Cb 0.48 -2.71 -0.03 0.00 -0.00 0.00 0.00 29.99 27.73 2js3 n HIS 6 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2js3 s HIS 7 N 9.19 2.96 -0.36 1.57 5.04 -1.26 -4.98 115.29 127.45 2js3 s HIS 7 Ca 1.00 0.71 0.02 0.00 -1.54 0.00 0.00 55.06 55.25 2js3 s HIS 7 Cb -0.30 -4.00 0.11 0.00 0.04 0.00 0.00 32.58 28.43 2js3 s HIS 7 CO 0.33 -1.04 0.11 -1.58 -2.34 0.00 0.00 174.74 170.23 2js3 s HIS 8 N 3.89 2.66 0.01 3.88 5.65 -1.26 -5.09 115.29 125.04 2js3 s HIS 8 Ca 0.42 -2.45 -0.14 0.00 0.25 0.00 0.00 55.06 53.15 2js3 s HIS 8 Cb -0.10 -2.30 0.02 0.00 -1.18 0.00 0.00 32.58 29.02 2js3 s HIS 8 CO 0.25 -0.88 0.29 -1.01 -0.65 0.00 0.00 174.74 172.74 2js3 s HIS 9 N 1.00 -0.12 -0.26 3.88 4.02 -1.26 -5.14 115.29 117.40 2js3 s HIS 9 Ca 0.12 0.10 -0.03 0.00 1.02 0.00 0.00 55.06 56.27 2js3 s HIS 9 Cb -0.20 0.08 0.02 0.00 -1.02 0.00 0.00 32.58 31.47 2js3 s HIS 9 CO -0.13 -0.43 -0.02 -1.01 1.02 0.00 0.00 174.74 174.17 2js3 s HIS 10 N -1.87 3.10 -0.69 1.40 3.76 -1.26 -5.07 115.29 114.67 2js3 s HIS 10 Ca -0.10 -1.43 -0.24 0.00 -0.15 0.00 0.00 55.06 53.14 2js3 s HIS 10 Cb -0.03 -2.11 0.06 0.00 1.11 0.00 0.00 32.58 31.60 2js3 s HIS 10 CO 0.01 -0.70 1.05 -1.12 -0.85 0.00 0.00 174.74 173.14 2js3 s SER 11 N 1.36 6.18 0.01 1.40 0.01 -1.26 -4.79 113.70 116.62 2js3 s SER 11 Ca 0.00 -0.87 -0.05 0.00 1.31 0.00 0.00 55.95 56.34 2js3 s SER 11 Cb -0.17 -2.46 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 2js3 s SER 11 CO -0.02 -1.54 -0.10 -1.54 0.41 0.00 0.00 173.24 170.44 2js3 n SER 12 N 8.13 1.27 -4.89 2.44 3.41 -1.26 -5.05 113.62 117.67 2js3 n SER 12 Ca -0.01 0.18 -0.32 0.00 -0.26 0.00 0.00 58.87 58.46 2js3 n SER 12 Cb 0.46 -0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 2js3 n SER 12 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2js3 s GLY 13 N -4.19 2.24 -0.54 5.00 0.00 -1.26 -5.06 107.32 103.52 2js3 s GLY 13 Ca -0.08 -0.59 -0.10 0.00 0.00 0.00 0.00 44.72 43.95 2js3 s GLY 13 CO 0.12 -0.48 0.42 1.09 0.00 0.00 0.00 173.10 174.25 2js3 s ARG 14 N -2.38 2.66 -1.05 2.90 3.03 -1.26 -5.02 118.95 117.84 2js3 s ARG 14 Ca 0.37 -1.93 -0.17 0.00 2.03 0.00 0.00 55.73 56.03 2js3 s ARG 14 Cb -0.13 -4.00 0.14 0.00 -1.03 0.00 0.00 34.95 29.94 2js3 s ARG 14 CO 0.23 -1.22 1.27 -1.21 -1.13 0.00 0.00 175.30 173.24 2js3 s GLU 15 N 1.09 3.80 -0.39 3.89 0.41 -1.26 -4.97 118.70 121.26 2js3 s GLU 15 Ca 0.08 -2.05 -0.17 0.00 -0.41 0.00 0.00 54.97 52.42 2js3 s GLU 15 Cb -0.24 -5.01 0.01 0.00 -1.78 0.00 0.00 34.13 27.11 2js3 s GLU 15 CO -0.02 -1.80 0.42 1.21 -0.49 0.00 0.00 175.26 174.58 2js3 s ASN 16 N 3.41 6.20 0.16 -0.19 3.84 -1.26 -4.75 114.94 122.34 2js3 s ASN 16 Ca 0.38 -0.49 0.00 0.00 0.21 0.00 0.00 52.86 52.95 2js3 s ASN 16 Cb -0.04 -2.22 0.00 0.00 -0.55 0.00 0.00 41.25 38.45 2js3 s ASN 16 CO -0.05 -0.50 0.02 0.18 -2.79 0.00 0.00 177.10 173.96 2js3 n LEU 17 N 5.54 0.00 -4.54 3.21 7.99 -1.26 -5.16 117.00 122.78 2js3 n LEU 17 Ca -0.08 -0.95 -0.24 0.00 -0.01 0.00 0.00 56.01 54.74 2js3 n LEU 17 Cb 0.48 0.09 -0.09 0.00 -0.11 0.00 0.00 43.42 43.79 2js3 n LEU 17 CO 0.44 -0.18 -0.42 -0.47 -1.51 0.00 0.00 177.39 175.25 2js3 s TYR 18 N -1.42 2.45 -0.81 -1.77 5.04 -1.26 -5.01 117.35 114.56 2js3 s TYR 18 Ca 0.02 -0.29 0.08 0.00 -2.44 0.00 0.00 57.07 54.44 2js3 s TYR 18 Cb -0.00 -1.07 0.41 0.00 0.35 0.00 0.00 41.96 41.64 2js3 s TYR 18 CO 0.01 0.68 1.26 1.19 -1.34 0.00 0.00 175.55 177.35 2js3 n PHE 19 N -0.71 0.19 0.06 4.97 3.01 -1.26 -1.23 117.46 122.49 2js3 n PHE 19 Ca -0.06 0.09 -0.10 0.00 1.01 0.00 0.00 57.45 58.40 2js3 n PHE 19 Cb 0.60 -0.65 0.03 0.00 -0.01 0.00 0.00 39.48 39.44 2js3 n PHE 19 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2js3 h GLN 20 N 0.00 0.37 -4.53 -1.08 5.75 -2.07 -3.41 115.11 110.15 2js3 h GLN 20 Ca 0.00 -0.32 -0.64 0.00 -0.15 0.00 0.00 58.65 57.54 2js3 h GLN 20 Cb 0.07 0.07 -0.39 0.00 1.07 0.00 0.00 27.48 28.30 2js3 h GLN 20 CO 0.00 0.96 -0.76 0.20 -2.65 0.00 0.00 178.83 176.58 2js3 s GLY 21 N -4.34 1.62 -0.46 2.39 0.00 -0.37 -5.08 107.32 101.09 2js3 s GLY 21 Ca -0.05 -1.97 -0.21 0.00 0.00 0.00 0.00 44.72 42.48 2js3 s GLY 21 CO 0.84 0.93 0.69 1.06 0.00 0.00 0.00 173.10 176.62 2js3 s MET 22 N 1.15 3.29 0.00 2.90 -1.94 -1.26 -4.36 119.30 119.07 2js3 s MET 22 Ca 0.02 -0.37 0.00 0.00 -1.71 0.00 0.00 55.69 53.63 2js3 s MET 22 Cb -0.19 -3.97 0.00 0.00 2.01 0.00 0.00 34.83 32.68 2js3 s MET 22 CO -0.09 -1.09 0.00 0.25 -0.01 0.00 0.00 175.02 174.08 2js3 n THR 23 N 5.91 0.00 0.00 2.05 -2.24 -1.26 -5.05 114.28 113.69 2js3 n THR 23 Ca -0.01 0.47 0.00 0.00 -2.27 0.00 0.00 64.05 62.24 2js3 n THR 23 Cb 0.48 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 2js3 n THR 23 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2js3 n ASP 24 N -2.23 0.00 0.00 3.42 -0.08 -1.26 -4.97 116.55 111.42 2js3 n ASP 24 Ca 0.00 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.29 2js3 n ASP 24 Cb 0.00 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.53 2js3 n ASP 24 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2js3 n THR 25 N -0.44 0.00 0.29 5.18 -2.24 -1.26 -2.99 114.28 112.82 2js3 n THR 25 Ca 0.00 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.93 2js3 n THR 25 Cb 0.00 -0.17 0.87 0.00 -2.10 0.00 0.00 70.33 68.93 2js3 n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2js3 h ALA 26 N 2.59 1.30 0.00 6.98 0.00 -1.93 -1.30 119.26 126.90 2js3 h ALA 26 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2js3 h ALA 26 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2js3 h ALA 26 CO 0.00 0.07 -0.37 0.00 0.00 0.00 0.00 179.25 178.95 2js3 h ALA 27 N 1.95 1.25 0.40 0.00 0.00 -1.96 -3.12 119.26 117.77 2js3 h ALA 27 Ca -0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2js3 h ALA 27 Cb 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2js3 h ALA 27 CO 0.01 0.46 -0.19 1.49 0.00 0.00 0.00 179.25 181.02 2js3 h GLU 28 N 0.00 -0.52 -0.31 0.00 4.22 -1.50 -0.58 114.58 115.89 2js3 h GLU 28 Ca -0.00 0.04 -0.15 0.00 0.08 0.00 0.00 59.36 59.32 2js3 h GLU 28 Cb 0.71 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2js3 h GLU 28 CO 0.05 -0.23 -0.42 0.22 -2.18 0.00 0.00 179.01 176.44 2js3 h ASP 29 N -0.78 0.84 -0.39 1.04 3.58 -1.66 -0.68 116.42 118.38 2js3 h ASP 29 Ca -0.06 -0.40 -0.15 0.00 0.42 0.00 0.00 57.03 56.85 2js3 h ASP 29 Cb 0.53 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2js3 h ASP 29 CO 0.09 1.15 -0.36 0.58 -2.88 0.00 0.00 179.24 177.83 2js3 h VAL 30 N 0.64 1.27 -0.17 2.25 2.07 -1.59 -2.81 116.25 117.91 2js3 h VAL 30 Ca 0.05 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 65.96 2js3 h VAL 30 Cb 0.99 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 2js3 h VAL 30 CO 0.09 0.51 -0.23 -0.09 0.02 0.00 0.00 177.57 177.88 2js3 h ARG 31 N 0.74 0.31 -0.83 1.57 2.43 -0.95 -1.54 114.38 116.11 2js3 h ARG 31 Ca 0.07 -0.10 0.12 0.00 -0.81 0.00 0.00 59.98 59.25 2js3 h ARG 31 Cb 0.95 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.39 2js3 h ARG 31 CO 0.09 0.53 0.45 -0.22 -1.51 0.00 0.00 179.97 179.31 2js3 h LYS 32 N 0.28 0.69 -0.11 0.20 3.64 -0.88 0.30 116.57 120.69 2js3 h LYS 32 Ca 0.05 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 2js3 h LYS 32 Cb 0.57 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 2js3 h LYS 32 CO 0.04 0.46 -0.12 0.82 -2.27 0.00 0.00 179.45 178.37 2js3 h ILE 33 N 0.71 1.36 -0.25 2.00 2.04 -1.15 -3.22 117.51 119.00 2js3 h ILE 33 Ca 0.42 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2js3 h ILE 33 Cb 0.48 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 2js3 h ILE 33 CO -0.30 0.37 0.17 0.00 0.00 0.00 0.00 178.15 178.40 2js3 h ALA 34 N 0.58 1.82 -0.46 1.87 0.00 -0.72 -2.10 119.26 120.25 2js3 h ALA 34 Ca 0.02 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2js3 h ALA 34 Cb 0.66 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2js3 h ALA 34 CO 0.03 0.16 0.35 1.15 0.00 0.00 0.00 179.25 180.94 2js3 h THR 35 N 0.34 0.70 -0.57 0.00 2.02 -0.96 -2.20 112.91 112.24 2js3 h THR 35 Ca 0.09 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.31 2js3 h THR 35 Cb -0.04 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2js3 h THR 35 CO -0.02 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.25 2js3 h ALA 36 N 1.73 1.75 0.00 6.16 0.00 -1.53 -1.30 119.26 126.08 2js3 h ALA 36 Ca 0.22 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2js3 h ALA 36 Cb 0.92 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2js3 h ALA 36 CO -0.00 0.18 -0.27 1.37 0.00 0.00 0.00 179.25 180.52 2js3 h LEU 37 N 0.62 0.00 -0.77 0.00 8.10 -1.60 -2.21 115.31 119.46 2js3 h LEU 37 Ca 0.23 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.14 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 -0.06 0.27 -0.40 -0.07 -4.11 0.00 0.00 178.44 174.07 2js3 h LEU 38 N 0.00 0.00 0.00 0.17 -0.00 -1.36 -3.35 115.31 110.77 2js3 h LEU 38 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.87 2js3 h LEU 38 Cb 0.92 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.58 2js3 h LEU 38 CO 0.04 0.40 -0.04 0.11 -0.00 0.00 0.00 178.44 178.95 2js3 h LYS 39 N 0.00 0.00 0.00 1.13 1.57 -1.17 -3.48 116.57 114.61 2js3 h LYS 39 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2js3 h LYS 39 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2js3 h LYS 39 CO 0.05 0.18 0.00 0.25 -0.57 0.00 0.00 179.45 179.37 2js3 n THR 40 N -4.74 0.00 0.00 -0.16 -2.24 -0.94 -5.03 114.28 101.18 2js3 n THR 40 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2js3 n THR 40 Cb 0.10 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 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 -2.51 0.00 -1.77 6.98 0.00 -1.22 -4.87 120.51 117.12 2js3 n ALA 41 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2js3 n ALA 41 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 0.00 3.42 0.12 0.00 1.01 -1.26 -4.94 121.20 119.55 2js3 s ILE 42 Ca 0.00 1.29 0.06 0.00 0.00 0.00 0.00 60.65 62.00 2js3 s ILE 42 Cb 0.00 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 2js3 s ILE 42 CO 0.00 0.20 -0.03 -1.83 0.00 0.00 0.00 174.94 173.28 2js3 s GLU 43 N -1.91 2.37 -0.28 2.79 1.03 -1.26 -5.06 118.70 116.38 2js3 s GLU 43 Ca 0.51 -0.98 -0.10 0.00 0.03 0.00 0.00 54.97 54.43 2js3 s GLU 43 Cb -0.30 -2.41 -0.03 0.00 -0.80 0.00 0.00 34.13 30.59 2js3 s GLU 43 CO 0.38 0.50 0.16 0.96 -1.33 0.00 0.00 175.26 175.94 2js3 s ILE 44 N -1.40 4.97 -0.04 1.83 -4.36 -1.26 -3.32 121.20 117.61 2js3 s ILE 44 Ca 0.25 -0.04 -0.09 0.00 -0.26 0.00 0.00 60.65 60.50 2js3 s ILE 44 Cb -0.11 -3.40 -0.05 0.00 1.25 0.00 0.00 42.46 40.15 2js3 s ILE 44 CO 0.17 0.21 0.27 -0.69 0.24 0.00 0.00 174.94 175.14 2js3 s VAL 45 N 1.70 5.29 -0.03 8.37 1.01 -0.10 -4.93 120.40 131.71 2js3 s VAL 45 Ca 0.06 0.40 0.05 0.00 0.00 0.00 0.00 61.98 62.49 2js3 s VAL 45 Cb -0.16 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 2js3 s VAL 45 CO 0.08 0.53 -0.17 -0.55 0.00 0.00 0.00 175.10 175.00 2js3 s SER 46 N -1.25 2.08 0.05 3.32 0.15 -1.26 0.59 113.70 117.39 2js3 s SER 46 Ca 0.22 -0.33 0.01 0.00 0.70 0.00 0.00 55.95 56.54 2js3 s SER 46 Cb -0.14 -0.47 -0.03 0.00 -1.71 0.00 0.00 66.02 63.67 2js3 s SER 46 CO 0.11 0.17 -0.05 -1.61 1.20 0.00 0.00 173.24 173.06 2js3 s GLU 47 N -0.10 0.57 0.11 5.44 2.02 0.26 -4.95 118.70 122.06 2js3 s GLU 47 Ca -0.00 -1.00 0.16 0.00 0.02 0.00 0.00 54.97 54.14 2js3 s GLU 47 Cb -0.10 -0.01 -0.09 0.00 0.10 0.00 0.00 34.13 34.03 2js3 s GLU 47 CO 0.01 -0.04 0.98 0.93 0.02 0.00 0.00 175.26 177.16 2js3 h GLU 48 N 3.75 0.00 0.00 1.61 5.08 -2.01 -2.55 114.58 120.46 2js3 h GLU 48 Ca -0.34 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 2js3 h GLU 48 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2js3 h GLU 48 CO 0.54 0.36 -0.27 0.22 -1.00 0.00 0.00 179.01 178.87 2js3 h ASP 49 N 0.00 0.00 0.10 1.42 3.58 -2.05 -3.41 116.42 116.06 2js3 h ASP 49 Ca -0.12 -0.69 -0.35 0.00 0.42 0.00 0.00 57.03 56.29 2js3 h ASP 49 Cb 1.55 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.58 2js3 h ASP 49 CO 0.05 1.00 -1.91 0.61 -2.88 0.00 0.00 179.24 176.12 2js3 n GLY 50 N 1.60 -0.59 0.00 -0.78 0.00 -1.26 -5.10 105.19 99.07 2js3 n GLY 50 Ca -0.13 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2js3 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2js3 n GLY 51 N 1.91 0.07 3.72 -0.02 0.00 -0.96 -4.96 105.19 104.96 2js3 n GLY 51 Ca -0.33 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.15 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 -2.00 3.31 -0.11 4.61 0.00 -1.26 -0.57 121.76 125.74 2js3 s ALA 52 Ca 0.00 0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.19 2js3 s ALA 52 Cb 0.00 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.12 2js3 s ALA 52 CO 0.00 -0.11 -0.21 -1.01 0.00 0.00 0.00 175.76 174.42 2js3 s HIS 53 N 0.79 2.46 -0.53 0.00 3.76 0.20 -1.54 115.29 120.43 2js3 s HIS 53 Ca 0.39 -1.12 -0.21 0.00 -0.15 0.00 0.00 55.06 53.98 2js3 s HIS 53 Cb -0.18 -1.67 0.05 0.00 1.11 0.00 0.00 32.58 31.89 2js3 s HIS 53 CO 0.20 -0.49 0.75 1.21 -0.85 0.00 0.00 174.74 175.55 2js3 s ASN 54 N 0.63 6.26 0.03 1.40 2.47 0.15 -0.92 114.94 124.96 2js3 s ASN 54 Ca -0.12 -0.71 0.08 0.00 0.42 0.00 0.00 52.86 52.52 2js3 s ASN 54 Cb -0.16 -2.35 -0.03 0.00 -1.45 0.00 0.00 41.25 37.26 2js3 s ASN 54 CO 0.03 -1.02 -0.22 -1.58 -3.72 0.00 0.00 177.10 170.59 2js3 s GLN 55 N 3.13 2.01 -0.41 0.43 0.74 -1.21 -0.70 119.66 123.65 2js3 s GLN 55 Ca 0.21 -1.00 -0.20 0.00 0.05 0.00 0.00 55.36 54.41 2js3 s GLN 55 Cb -0.17 -2.11 0.01 0.00 1.10 0.00 0.00 33.01 31.85 2js3 s GLN 55 CO 0.14 0.54 0.62 0.00 -0.55 0.00 0.00 175.29 176.04 2js3 h LYS 57 N 8.72 -0.00 0.00 0.00 3.64 -1.92 -2.93 116.57 124.08 2js3 h LYS 57 Ca -0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 2js3 h LYS 57 Cb 1.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2js3 h LYS 57 CO 0.86 -0.00 0.00 1.47 -2.27 0.00 0.00 179.45 179.51 2js3 n LEU 58 N -5.59 0.89 -0.12 5.20 -0.00 -1.26 -4.66 117.00 111.46 2js3 n LEU 58 Ca 0.15 -0.89 0.14 0.00 -0.00 0.00 0.00 56.01 55.40 2js3 n LEU 58 Cb 0.48 0.00 0.55 0.00 -0.00 0.00 0.00 43.42 44.44 2js3 n LEU 58 CO -0.12 0.22 0.81 0.00 -0.00 0.00 0.00 177.39 178.31 2js3 n GLY 60 N 1.32 -0.03 3.27 0.00 0.00 -1.24 -3.76 105.19 104.76 2js3 n GLY 60 Ca 0.13 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.21 -0.96 -0.03 4.61 0.00 -1.26 -4.96 121.76 115.95 2js3 s ALA 61 Ca 0.19 1.16 -0.01 0.00 0.00 0.00 0.00 51.96 53.31 2js3 s ALA 61 Cb -0.09 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.38 2js3 s ALA 61 CO 0.46 -0.20 0.06 0.45 0.00 0.00 0.00 175.76 176.54 2js3 s SER 62 N 0.43 0.02 0.02 0.00 0.15 -1.26 -0.50 113.70 112.55 2js3 s SER 62 Ca -0.02 0.11 0.04 0.00 0.70 0.00 0.00 55.95 56.78 2js3 s SER 62 Cb -0.04 0.00 -0.02 0.00 -1.71 0.00 0.00 66.02 64.26 2js3 s SER 62 CO -0.02 -0.13 -0.12 0.54 1.20 0.00 0.00 173.24 174.71 2js3 s VAL 63 N 1.04 0.96 0.20 4.45 0.11 0.12 -4.97 120.40 122.31 2js3 s VAL 63 Ca -0.08 -0.75 -0.31 0.00 -2.93 0.00 0.00 61.98 57.90 2js3 s VAL 63 Cb -0.12 -0.85 -0.16 0.00 -1.53 0.00 0.00 36.38 33.72 2js3 s VAL 63 CO -0.04 0.10 0.99 -2.65 -3.33 0.00 0.00 175.10 170.17 2js3 n PRO 64 N 2.30 0.94 -1.69 1.54 -0.02 -1.26 0.32 135.00 137.12 2js3 n PRO 64 Ca -0.16 0.33 -0.44 0.00 -2.02 0.00 0.00 63.50 61.21 2js3 n PRO 64 Cb 0.55 -1.70 -0.03 0.00 -0.02 0.00 0.00 33.50 32.30 2js3 n PRO 64 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2js3 n TRP 65 N 0.84 2.57 -0.97 6.00 -0.00 -0.59 -1.81 117.44 123.48 2js3 n TRP 65 Ca 0.14 0.03 0.00 0.00 -0.00 0.00 0.00 57.50 57.67 2js3 n TRP 65 Cb 0.26 -2.66 0.00 0.00 -0.00 0.00 0.00 31.31 28.91 2js3 n TRP 65 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2js3 n LEU 66 N 4.55 0.40 0.01 5.87 4.77 -1.26 -4.87 117.00 126.47 2js3 n LEU 66 Ca 0.17 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.97 2js3 n LEU 66 Cb 0.34 -1.20 -0.10 0.00 -2.33 0.00 0.00 43.42 40.13 2js3 n LEU 66 CO 0.65 -0.37 0.20 -0.61 -1.33 0.00 0.00 177.39 175.93 2js3 h GLN 67 N 0.78 0.57 0.00 3.23 -0.00 -1.71 -3.46 115.11 114.51 2js3 h GLN 67 Ca 0.00 -0.58 0.00 0.00 -0.00 0.00 0.00 58.65 58.07 2js3 h GLN 67 Cb 0.34 0.15 0.00 0.00 0.00 0.00 0.00 27.48 27.98 2js3 h GLN 67 CO 0.00 1.20 0.00 0.25 0.00 0.00 0.00 178.83 180.28 2js3 n THR 68 N -4.06 0.00 0.00 2.39 -2.24 -1.26 -5.10 114.28 104.00 2js3 n THR 68 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2js3 n THR 68 Cb 0.75 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 2js3 n THR 68 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2js3 n GLY 69 N 0.68 1.67 0.18 3.38 0.00 -1.26 -4.67 105.19 105.16 2js3 n GLY 69 Ca 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 46.02 45.29 2js3 n GLY 69 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2js3 h ASP 70 N 0.00 0.00 -1.36 1.61 3.32 -2.01 -3.40 116.42 114.58 2js3 h ASP 70 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 2js3 h ASP 70 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 2js3 h ASP 70 CO 0.00 0.40 1.18 -0.70 -1.72 0.00 0.00 179.24 178.40 2js3 s GLU 71 N -3.35 3.08 0.20 3.56 2.56 -1.26 -4.85 118.70 118.64 2js3 s GLU 71 Ca 0.02 -0.47 -0.23 0.00 0.00 0.00 0.00 54.97 54.28 2js3 s GLU 71 Cb 0.09 -4.91 0.06 0.00 2.00 0.00 0.00 34.13 31.37 2js3 s GLU 71 CO 0.70 -2.60 0.91 -1.50 -0.56 0.00 0.00 175.26 172.21 2js3 s ILE 72 N 7.15 0.00 0.52 -3.70 2.07 -1.26 -4.79 121.20 121.19 2js3 s ILE 72 Ca 0.54 -0.75 -0.21 0.00 -1.41 0.00 0.00 60.65 58.82 2js3 s ILE 72 Cb -0.05 -2.21 -0.06 0.00 0.13 0.00 0.00 42.46 40.27 2js3 s ILE 72 CO 0.02 0.00 1.16 -0.54 -1.91 0.00 0.00 174.94 173.67 2js3 s LYS 73 N -3.15 3.42 0.14 3.50 1.02 -1.26 -5.05 119.74 118.35 2js3 s LYS 73 Ca 0.14 1.72 0.06 0.00 0.02 0.00 0.00 55.97 57.91 2js3 s LYS 73 Cb -0.03 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 2js3 s LYS 73 CO 0.04 -0.82 -0.12 -1.01 -0.92 0.00 0.00 175.35 172.52 2js3 s HIS 74 N -1.65 1.37 -0.05 3.18 3.76 -1.26 -4.69 115.29 115.95 2js3 s HIS 74 Ca 0.71 -0.63 -0.06 0.00 -0.15 0.00 0.00 55.06 54.93 2js3 s HIS 74 Cb -0.27 -0.70 -0.04 0.00 1.11 0.00 0.00 32.58 32.68 2js3 s HIS 74 CO 0.31 0.14 0.18 0.00 -0.85 0.00 0.00 174.74 174.53 2js3 s ALA 75 N -2.68 3.90 -0.06 -1.40 0.00 -1.25 -5.00 121.76 115.27 2js3 s ALA 75 Ca 0.13 -0.66 0.17 0.00 0.00 0.00 0.00 51.96 51.60 2js3 s ALA 75 Cb -0.02 -1.96 -0.26 0.00 0.00 0.00 0.00 23.12 20.88 2js3 s ALA 75 CO 0.03 0.67 0.31 -3.47 0.00 0.00 0.00 175.76 173.30 2js3 n ASP 76 N 1.44 0.95 -0.70 0.00 2.03 -1.26 -4.20 116.55 114.82 2js3 n ASP 76 Ca -0.15 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.29 2js3 n ASP 76 Cb 0.54 1.61 0.27 0.00 -0.72 0.00 0.00 41.12 42.81 2js3 n ASP 76 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2js3 n ASP 77 N -2.23 2.23 -4.80 1.67 2.03 -1.26 -4.95 116.55 109.25 2js3 n ASP 77 Ca -0.09 -1.71 -0.34 0.00 0.52 0.00 0.00 54.79 53.18 2js3 n ASP 77 Cb 0.59 0.04 -0.03 0.00 -0.72 0.00 0.00 41.12 41.00 2js3 n ASP 77 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2js3 n PRO 79 N -1.02 0.01 -0.25 0.00 -0.04 -1.26 -3.04 135.00 129.41 2js3 n PRO 79 Ca 0.09 0.26 -0.03 0.00 -0.04 0.00 0.00 63.50 63.79 2js3 n PRO 79 Cb 0.52 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.63 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 1.24 -0.31 0.52 2.07 -1.93 -0.11 116.25 117.73 2js3 h VAL 80 Ca 0.00 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 2js3 h VAL 80 Cb 0.23 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2js3 h VAL 80 CO 0.00 0.28 0.13 0.58 0.02 0.00 0.00 177.57 178.58 2js3 h VAL 81 N 1.07 1.17 -0.40 2.57 2.07 -1.86 -2.15 116.25 118.72 2js3 h VAL 81 Ca 0.26 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.30 2js3 h VAL 81 Cb 0.10 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2js3 h VAL 81 CO -0.03 0.18 0.20 0.40 0.02 0.00 0.00 177.57 178.34 2js3 h ILE 82 N 0.35 0.98 -0.72 4.57 1.08 -1.60 -2.11 117.51 120.05 2js3 h ILE 82 Ca 0.10 -0.14 0.06 0.00 -0.39 0.00 0.00 64.86 64.49 2js3 h ILE 82 Cb 0.16 0.53 -0.06 0.00 -3.07 0.00 0.00 36.82 34.38 2js3 h ILE 82 CO -0.01 0.08 0.41 0.00 -0.69 0.00 0.00 178.15 177.94 2js3 h ALA 83 N 1.21 0.98 -0.40 1.87 0.00 -0.81 0.11 119.26 122.22 2js3 h ALA 83 Ca 0.17 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2js3 h ALA 83 Cb 0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2js3 h ALA 83 CO -0.11 0.10 0.22 0.87 0.00 0.00 0.00 179.25 180.33 2js3 h LYS 84 N 0.75 0.56 -0.73 0.00 1.57 -0.99 -0.97 116.57 116.75 2js3 h LYS 84 Ca 0.33 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2js3 h LYS 84 Cb 0.21 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2js3 h LYS 84 CO -0.19 0.44 0.31 1.96 -0.57 0.00 0.00 179.45 181.40 2js3 h GLN 85 N 0.52 1.07 0.48 3.15 4.20 -0.70 -1.77 115.11 122.07 2js3 h GLN 85 Ca 0.14 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2js3 h GLN 85 Cb 0.04 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.64 2js3 h GLN 85 CO -0.02 0.86 -0.23 0.82 -0.67 0.00 0.00 178.83 179.58 2js3 h ILE 86 N 1.06 0.51 0.00 2.54 2.04 -0.38 -1.51 117.51 121.77 2js3 h ILE 86 Ca 0.25 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.96 2js3 h ILE 86 Cb 0.17 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2js3 h ILE 86 CO -0.02 0.03 0.00 0.17 0.00 0.00 0.00 178.15 178.32 2js3 h LEU 87 N -0.74 0.00 0.23 1.44 8.10 -1.08 -2.53 115.31 120.73 2js3 h LEU 87 Ca -0.07 0.00 -0.33 0.00 0.11 0.00 0.00 57.88 57.60 2js3 h LEU 87 Cb 0.54 0.00 0.03 0.00 -0.44 0.00 0.00 40.66 40.79 2js3 h LEU 87 CO 0.11 0.00 -1.49 0.28 -4.11 0.00 0.00 178.44 173.23 2js3 h SER 88 N 0.00 0.76 -0.57 0.17 0.02 -1.20 -3.47 113.55 109.26 2js3 h SER 88 Ca 0.00 -0.93 -0.25 0.00 -0.84 0.00 0.00 61.79 59.78 2js3 h SER 88 Cb 0.45 -0.25 -0.10 0.00 0.14 0.00 0.00 62.40 62.65 2js3 h SER 88 CO 0.00 1.70 -0.22 -1.20 -1.14 0.00 0.00 176.83 175.97 2js3 n SER 89 N -3.73 -5.38 -3.94 3.07 7.64 -0.58 -4.95 113.62 105.75 2js3 n SER 89 Ca -0.19 0.30 -0.28 0.00 1.01 0.00 0.00 58.87 59.71 2js3 n SER 89 Cb 1.07 -3.93 -0.17 0.00 -1.01 0.00 0.00 64.21 60.17 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 -2.93 1.76 -0.30 1.43 1.70 -1.26 -5.11 118.95 114.24 2js3 s ARG 90 Ca 0.00 -0.39 -0.27 0.00 -0.47 0.00 0.00 55.73 54.60 2js3 s ARG 90 Cb 0.00 -1.81 0.01 0.00 -0.57 0.00 0.00 34.95 32.58 2js3 s ARG 90 CO 0.00 -0.28 0.98 -1.25 -1.08 0.00 0.00 175.30 173.67 2js3 s PRO 91 N 1.63 4.07 -0.42 3.89 0.05 -1.26 -5.02 135.00 137.94 2js3 s PRO 91 Ca 0.04 0.99 -0.12 0.00 0.05 0.00 0.00 61.00 61.96 2js3 s PRO 91 Cb -0.13 -3.72 0.05 0.00 0.05 0.00 0.00 34.50 30.76 2js3 s PRO 91 CO -0.09 -0.78 0.28 0.21 0.05 0.00 0.00 177.00 176.66 2js3 s LYS 92 N 3.36 2.80 0.00 4.56 2.20 -1.26 -4.95 119.74 126.46 2js3 s LYS 92 Ca 0.41 -1.26 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 2js3 s LYS 92 Cb -0.13 -3.87 0.00 0.00 -1.51 0.00 0.00 37.83 32.32 2js3 s LYS 92 CO 0.13 -0.87 0.00 1.28 -0.36 0.00 0.00 175.35 175.53 2js3 n LEU 93 N 5.04 0.00 0.00 5.43 4.77 -1.26 -4.91 117.00 126.07 2js3 n LEU 93 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2js3 n LEU 93 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2js3 n LEU 93 CO 0.40 0.00 0.00 1.41 -1.33 0.00 0.00 177.39 177.87 2js3 n HIS 94 N -0.99 0.00 -2.76 -1.77 8.25 -1.26 -2.10 115.22 114.59 2js3 n HIS 94 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 2js3 n HIS 94 Cb 0.00 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.18 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 6.01 1.36 -0.92 -1.41 0.00 -1.26 -5.36 120.51 118.92 2js3 n ALA 95 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 53.44 51.43 2js3 n ALA 95 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2js3 n ALA 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78