#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 -2.59 1.00 3.03 0.00 -1.26 -4.97 105.19 100.40 2js3 n GLY 2 Ca 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 46.02 44.53 2js3 n GLY 2 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2js3 n SER 3 N -2.05 -0.48 -4.55 1.61 7.64 -1.26 -5.07 113.62 109.45 2js3 n SER 3 Ca -0.00 -1.87 -0.39 0.00 1.01 0.00 0.00 58.87 57.62 2js3 n SER 3 Cb 0.01 0.14 -0.03 0.00 -1.01 0.00 0.00 64.21 63.31 2js3 n SER 3 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2js3 s SER 4 N -1.04 5.89 -0.48 6.43 1.04 -1.26 -4.82 113.70 119.46 2js3 s SER 4 Ca 0.06 -0.38 0.06 0.00 0.48 0.00 0.00 55.95 56.18 2js3 s SER 4 Cb 0.07 -2.55 0.21 0.00 0.10 0.00 0.00 66.02 63.84 2js3 s SER 4 CO -0.03 -2.00 0.69 1.57 0.98 0.00 0.00 173.24 174.44 2js3 n HIS 5 N 10.54 -2.83 -3.17 5.02 -0.00 -1.26 -5.02 115.22 118.50 2js3 n HIS 5 Ca 0.14 -2.05 -0.39 0.00 -0.00 0.00 0.00 57.72 55.42 2js3 n HIS 5 Cb 0.50 1.10 -0.06 0.00 -0.00 0.00 0.00 29.99 31.53 2js3 n HIS 5 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2js3 s HIS 6 N 0.45 3.79 0.00 1.57 0.09 -1.26 -4.75 115.29 115.19 2js3 s HIS 6 Ca 0.32 1.35 0.00 0.00 -0.00 0.00 0.00 55.06 56.72 2js3 s HIS 6 Cb 0.09 -2.61 0.00 0.00 -0.00 0.00 0.00 32.58 30.07 2js3 s HIS 6 CO -0.14 0.49 0.00 0.72 -0.00 0.00 0.00 174.74 175.81 2js3 n HIS 7 N 2.03 0.00 -0.98 1.40 -0.00 -1.26 -5.00 115.22 111.41 2js3 n HIS 7 Ca -0.08 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.73 2js3 n HIS 7 Cb 0.50 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.45 2js3 n HIS 7 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2js3 n HIS 8 N 0.00 -2.64 -3.57 4.41 -0.00 -1.26 -5.09 115.22 107.06 2js3 n HIS 8 Ca 0.00 1.45 -0.12 0.00 -0.00 0.00 0.00 57.72 59.06 2js3 n HIS 8 Cb 0.00 -2.40 -0.06 0.00 -0.00 0.00 0.00 29.99 27.54 2js3 n HIS 8 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2js3 s HIS 9 N -4.16 -0.44 0.17 4.41 5.65 -1.26 -5.18 115.29 114.47 2js3 s HIS 9 Ca 0.00 0.81 0.08 0.00 0.25 0.00 0.00 55.06 56.20 2js3 s HIS 9 Cb 0.00 0.43 -0.04 0.00 -1.18 0.00 0.00 32.58 31.79 2js3 s HIS 9 CO 0.00 -0.38 -0.17 -1.01 -0.65 0.00 0.00 174.74 172.53 2js3 s HIS 10 N -0.95 1.77 0.39 3.88 0.09 -1.26 -5.15 115.29 114.06 2js3 s HIS 10 Ca -0.03 -0.49 -0.13 0.00 -0.00 0.00 0.00 55.06 54.41 2js3 s HIS 10 Cb -0.01 -0.88 0.05 0.00 -0.00 0.00 0.00 32.58 31.74 2js3 s HIS 10 CO 0.02 0.32 0.75 0.45 -0.00 0.00 0.00 174.74 176.28 2js3 s SER 11 N -2.73 0.19 0.16 1.40 0.15 -1.26 -5.04 113.70 106.56 2js3 s SER 11 Ca 0.16 -1.25 0.22 0.00 0.70 0.00 0.00 55.95 55.78 2js3 s SER 11 Cb -0.05 0.84 -0.05 0.00 -1.71 0.00 0.00 66.02 65.04 2js3 s SER 11 CO 0.06 -1.66 0.95 -1.20 1.20 0.00 0.00 173.24 172.59 2js3 n SER 12 N -1.51 0.75 0.00 5.45 7.64 -1.26 -5.08 113.62 119.61 2js3 n SER 12 Ca -0.07 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.10 2js3 n SER 12 Cb 0.60 0.61 0.00 0.00 -1.01 0.00 0.00 64.21 64.41 2js3 n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2js3 n GLY 13 N 1.21 -1.90 0.00 0.23 0.00 -1.26 -5.09 105.19 98.38 2js3 n GLY 13 Ca -0.01 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.21 0.00 0.00 1.61 5.12 -1.26 -5.15 116.66 115.78 2js3 n ARG 14 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2js3 n ARG 14 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2js3 n ARG 14 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 2js3 n GLU 15 N -0.05 0.00 -4.34 5.56 0.28 -1.26 -5.11 120.64 115.72 2js3 n GLU 15 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.81 2js3 n GLU 15 Cb 0.00 0.00 -0.13 0.00 1.43 0.00 0.00 31.44 32.74 2js3 n GLU 15 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2js3 s ASN 16 N 0.00 1.50 -0.60 -1.84 2.20 -1.26 -4.07 114.94 110.86 2js3 s ASN 16 Ca 0.00 -0.41 -0.01 0.00 -0.94 0.00 0.00 52.86 51.50 2js3 s ASN 16 Cb 0.00 -0.10 0.46 0.00 -2.00 0.00 0.00 41.25 39.61 2js3 s ASN 16 CO 0.00 0.03 2.01 -0.11 -2.94 0.00 0.00 177.10 176.09 2js3 n LEU 17 N 2.03 7.43 0.00 3.54 7.94 -1.24 -5.03 117.00 131.68 2js3 n LEU 17 Ca -0.18 -4.09 0.00 0.00 -1.11 0.00 0.00 56.01 50.64 2js3 n LEU 17 Cb 0.55 -0.96 0.00 0.00 0.53 0.00 0.00 43.42 43.54 2js3 n LEU 17 CO 0.23 1.38 0.00 0.00 -1.11 0.00 0.00 177.39 177.89 2js3 n TYR 18 N -0.84 -1.72 1.86 1.96 9.36 -1.26 -2.96 117.16 123.55 2js3 n TYR 18 Ca 0.59 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.96 2js3 n TYR 18 Cb 0.81 0.27 0.84 0.00 -0.63 0.00 0.00 39.34 40.63 2js3 n TYR 18 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 2js3 n PHE 19 N -1.47 0.00 -0.04 2.98 3.72 -1.26 -2.91 117.46 118.48 2js3 n PHE 19 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 2js3 n PHE 19 Cb 0.00 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.41 2js3 n PHE 19 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2js3 h GLN 20 N 0.00 0.08 -2.05 -1.08 4.15 -2.02 -3.41 115.11 110.79 2js3 h GLN 20 Ca 0.00 -0.11 -0.56 0.00 0.77 0.00 0.00 58.65 58.74 2js3 h GLN 20 Cb 0.00 0.04 -0.40 0.00 0.21 0.00 0.00 27.48 27.33 2js3 h GLN 20 CO 0.00 0.99 -1.00 0.41 -1.93 0.00 0.00 178.83 177.30 2js3 n GLY 21 N 1.42 3.43 3.75 2.39 0.00 -1.16 -5.10 105.19 109.92 2js3 n GLY 21 Ca -0.10 -1.87 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.65 4.25 0.07 1.61 -1.94 -1.15 -3.66 119.30 116.83 2js3 s MET 22 Ca 0.37 2.34 0.00 0.00 -1.71 0.00 0.00 55.69 56.69 2js3 s MET 22 Cb 0.19 -3.09 0.00 0.00 2.01 0.00 0.00 34.83 33.95 2js3 s MET 22 CO -0.09 -0.42 0.03 -2.37 -0.01 0.00 0.00 175.02 172.16 2js3 n THR 23 N 1.98 0.00 0.12 2.05 5.66 -1.26 -4.98 114.28 117.84 2js3 n THR 23 Ca 0.06 -0.31 -0.13 0.00 -3.05 0.00 0.00 64.05 60.61 2js3 n THR 23 Cb 0.40 -0.20 -0.08 0.00 -1.55 0.00 0.00 70.33 68.90 2js3 n THR 23 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 175.07 171.24 2js3 h ASP 24 N 0.13 -0.24 0.00 1.09 3.58 -1.95 -3.16 116.42 115.87 2js3 h ASP 24 Ca -0.05 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2js3 h ASP 24 Cb 0.17 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2js3 h ASP 24 CO 0.08 0.04 0.00 0.41 -2.88 0.00 0.00 179.24 176.90 2js3 n THR 25 N -5.10 0.00 0.47 2.25 -1.04 -1.26 -2.85 114.28 106.75 2js3 n THR 25 Ca -0.09 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.01 2js3 n THR 25 Cb 0.21 -0.04 0.38 0.00 -1.82 0.00 0.00 70.33 69.07 2js3 n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2js3 n ALA 26 N -0.48 1.68 0.15 2.41 0.00 -1.19 -1.35 120.51 121.72 2js3 n ALA 26 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.46 2js3 n ALA 26 Cb 0.01 -1.29 0.17 0.00 0.00 0.00 0.00 19.45 18.33 2js3 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2js3 h ALA 27 N 2.43 0.81 0.02 0.00 0.00 -1.77 -3.04 119.26 117.69 2js3 h ALA 27 Ca 0.00 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 2js3 h ALA 27 Cb 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2js3 h ALA 27 CO 0.00 0.64 -0.20 1.49 0.00 0.00 0.00 179.25 181.18 2js3 h GLU 28 N 0.00 0.11 0.09 0.00 4.22 -1.48 -3.14 114.58 114.38 2js3 h GLU 28 Ca -0.01 -0.14 -0.15 0.00 0.08 0.00 0.00 59.36 59.15 2js3 h GLU 28 Cb 1.18 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.48 2js3 h GLU 28 CO 0.07 0.95 -0.71 0.38 -2.18 0.00 0.00 179.01 177.52 2js3 h ASP 29 N -0.68 0.29 -0.41 1.04 2.03 -1.70 -3.18 116.42 113.80 2js3 h ASP 29 Ca -0.03 -0.92 -0.04 0.00 -0.73 0.00 0.00 57.03 55.31 2js3 h ASP 29 Cb 1.04 -0.09 -0.02 0.00 -0.83 0.00 0.00 39.33 39.42 2js3 h ASP 29 CO 0.04 1.32 0.12 0.58 -1.03 0.00 0.00 179.24 180.27 2js3 h VAL 30 N -0.59 1.20 0.00 4.15 2.07 -1.72 -2.52 116.25 118.85 2js3 h VAL 30 Ca -0.14 -0.73 -0.13 0.00 0.82 0.00 0.00 66.70 66.52 2js3 h VAL 30 Cb 1.45 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 2js3 h VAL 30 CO 0.07 0.27 -0.61 0.03 0.02 0.00 0.00 177.57 177.34 2js3 h ARG 31 N 0.69 0.00 -0.67 1.57 3.08 -1.67 -3.22 114.38 114.17 2js3 h ARG 31 Ca 0.16 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 2js3 h ARG 31 Cb 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 2js3 h ARG 31 CO -0.00 0.61 0.10 0.87 -1.07 0.00 0.00 179.97 180.48 2js3 h LYS 32 N 0.00 1.11 -0.31 0.04 1.57 -1.43 -1.28 116.57 116.27 2js3 h LYS 32 Ca -0.01 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.43 2js3 h LYS 32 Cb 1.16 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2js3 h LYS 32 CO 0.08 1.01 -0.03 -0.84 -0.57 0.00 0.00 179.45 179.10 2js3 h ILE 33 N 1.03 1.20 -0.01 1.86 3.07 -1.55 0.39 117.51 123.50 2js3 h ILE 33 Ca 0.20 -0.80 -0.18 0.00 1.55 0.00 0.00 64.86 65.63 2js3 h ILE 33 Cb 0.45 1.00 -0.01 0.00 -0.27 0.00 0.00 36.82 37.98 2js3 h ILE 33 CO 0.01 0.27 -0.81 0.00 -1.05 0.00 0.00 178.15 176.58 2js3 h ALA 34 N 1.52 0.61 -0.00 0.16 0.00 -1.58 -3.16 119.26 116.80 2js3 h ALA 34 Ca 0.10 -0.68 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 2js3 h ALA 34 Cb 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2js3 h ALA 34 CO 0.01 0.88 -0.62 1.15 0.00 0.00 0.00 179.25 180.67 2js3 h THR 35 N 0.11 1.45 -0.32 0.00 2.02 -0.37 -2.97 112.91 112.83 2js3 h THR 35 Ca -0.03 -2.13 0.09 0.00 0.77 0.00 0.00 66.41 65.11 2js3 h THR 35 Cb 1.40 2.15 -0.01 0.00 -1.74 0.00 0.00 68.15 69.95 2js3 h THR 35 CO 0.12 0.61 0.29 0.00 0.37 0.00 0.00 175.52 176.91 2js3 h ALA 36 N 1.37 2.09 -0.70 6.16 0.00 -0.92 -0.05 119.26 127.21 2js3 h ALA 36 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2js3 h ALA 36 Cb 1.10 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2js3 h ALA 36 CO 0.08 -0.45 0.44 -0.07 0.00 0.00 0.00 179.25 179.26 2js3 h LEU 37 N 0.00 0.82 -0.29 0.00 3.38 -1.65 -2.23 115.31 115.34 2js3 h LEU 37 Ca 0.15 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 2js3 h LEU 37 Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2js3 h LEU 37 CO -0.00 0.62 -0.72 -0.07 0.09 0.00 0.00 178.44 178.35 2js3 h LEU 38 N 0.95 0.00 0.17 1.67 4.07 -1.20 -2.86 115.31 118.11 2js3 h LEU 38 Ca 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.21 2js3 h LEU 38 Cb -0.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.67 2js3 h LEU 38 CO -0.05 0.72 -0.08 0.50 -1.08 0.00 0.00 178.44 178.45 2js3 h LYS 39 N 0.00 -0.22 0.00 1.13 3.64 -0.85 -3.44 116.57 116.83 2js3 h LYS 39 Ca -0.01 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2js3 h LYS 39 Cb 1.42 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 2js3 h LYS 39 CO 0.09 0.12 0.00 -2.37 -2.27 0.00 0.00 179.45 175.02 2js3 n THR 40 N -5.03 0.00 0.23 1.00 5.66 -0.89 -4.93 114.28 110.31 2js3 n THR 40 Ca -0.09 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.02 2js3 n THR 40 Cb 0.23 0.00 0.42 0.00 -1.55 0.00 0.00 70.33 69.43 2js3 n THR 40 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2js3 h ALA 41 N 0.00 0.97 -2.44 1.79 0.00 -1.25 -3.43 119.26 114.91 2js3 h ALA 41 Ca 0.00 -0.16 -0.47 0.00 0.00 0.00 0.00 54.91 54.28 2js3 h ALA 41 Cb 0.80 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2js3 h ALA 41 CO 0.00 0.21 0.38 0.42 0.00 0.00 0.00 179.25 180.26 2js3 s ILE 42 N -3.51 4.01 0.22 0.00 1.01 -1.19 -4.97 121.20 116.76 2js3 s ILE 42 Ca 0.02 1.58 0.06 0.00 0.00 0.00 0.00 60.65 62.31 2js3 s ILE 42 Cb 0.09 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 2js3 s ILE 42 CO 0.63 0.05 0.17 -0.70 0.00 0.00 0.00 174.94 175.09 2js3 s GLU 43 N -2.33 2.91 -0.24 2.79 2.56 -1.11 -4.94 118.70 118.35 2js3 s GLU 43 Ca 0.54 -0.98 0.00 0.00 0.00 0.00 0.00 54.97 54.53 2js3 s GLU 43 Cb -0.19 -2.59 0.03 0.00 2.00 0.00 0.00 34.13 33.38 2js3 s GLU 43 CO 0.25 0.43 -0.10 0.42 -0.56 0.00 0.00 175.26 175.70 2js3 s ILE 44 N -1.98 2.53 -0.22 -3.70 -1.09 -1.26 -0.29 121.20 115.20 2js3 s ILE 44 Ca 0.32 -1.18 0.00 0.00 -2.23 0.00 0.00 60.65 57.56 2js3 s ILE 44 Cb -0.09 -2.30 0.03 0.00 -1.58 0.00 0.00 42.46 38.52 2js3 s ILE 44 CO 0.24 0.19 -0.13 0.68 -1.23 0.00 0.00 174.94 174.70 2js3 s VAL 45 N 1.26 2.44 0.25 2.92 -7.23 -0.30 -4.89 120.40 114.85 2js3 s VAL 45 Ca -0.01 -1.08 0.05 0.00 -1.81 0.00 0.00 61.98 59.13 2js3 s VAL 45 Cb -0.17 -2.19 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 2js3 s VAL 45 CO -0.06 0.31 0.38 -0.55 -0.31 0.00 0.00 175.10 174.86 2js3 s SER 46 N 1.28 6.27 0.83 4.85 0.15 -1.26 -0.22 113.70 125.59 2js3 s SER 46 Ca 0.01 0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.58 2js3 s SER 46 Cb -0.16 -1.76 0.09 0.00 -1.71 0.00 0.00 66.02 62.48 2js3 s SER 46 CO -0.08 -0.13 1.09 -1.61 1.20 0.00 0.00 173.24 173.72 2js3 s GLU 47 N -4.01 1.82 0.24 5.44 0.41 -0.56 -4.91 118.70 117.12 2js3 s GLU 47 Ca 0.36 1.10 -0.05 0.00 -0.41 0.00 0.00 54.97 55.96 2js3 s GLU 47 Cb -0.09 -1.85 0.42 0.00 -1.78 0.00 0.00 34.13 30.83 2js3 s GLU 47 CO 0.29 -1.93 1.73 0.93 -0.49 0.00 0.00 175.26 175.79 2js3 h GLU 48 N -1.33 0.41 -1.85 1.61 3.07 -1.99 -3.39 114.58 111.11 2js3 h GLU 48 Ca -0.45 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 58.31 2js3 h GLU 48 Cb 1.25 -0.09 -0.27 0.00 -0.84 0.00 0.00 28.75 28.80 2js3 h GLU 48 CO 0.51 0.27 -0.39 0.34 -1.40 0.00 0.00 179.01 178.35 2js3 s ASP 49 N -5.35 -0.29 0.00 1.42 2.15 -1.26 -5.06 116.67 108.28 2js3 s ASP 49 Ca -0.13 0.62 0.00 0.00 0.43 0.00 0.00 52.55 53.47 2js3 s ASP 49 Cb 0.20 1.46 0.00 0.00 -0.30 0.00 0.00 42.92 44.28 2js3 s ASP 49 CO 0.76 -0.27 0.00 0.61 -0.17 0.00 0.00 175.17 176.10 2js3 n GLY 50 N 5.39 -1.47 3.33 2.66 0.00 -1.26 -5.14 105.19 108.70 2js3 n GLY 50 Ca -0.05 0.51 -0.15 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.30 0.62 -0.02 0.00 -1.26 -4.96 107.32 101.40 2js3 s GLY 51 Ca 0.00 0.69 -0.16 0.00 0.00 0.00 0.00 44.72 45.25 2js3 s GLY 51 CO 0.00 0.43 1.08 0.00 0.00 0.00 0.00 173.10 174.61 2js3 s ALA 52 N -1.22 2.62 -0.12 3.20 0.00 -1.26 -1.50 121.76 123.47 2js3 s ALA 52 Ca -0.12 0.49 0.02 0.00 0.00 0.00 0.00 51.96 52.35 2js3 s ALA 52 Cb -0.03 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.82 2js3 s ALA 52 CO 0.06 -1.01 -0.19 -1.01 0.00 0.00 0.00 175.76 173.61 2js3 s HIS 53 N -2.36 2.32 -0.58 0.00 3.76 0.69 -1.83 115.29 117.30 2js3 s HIS 53 Ca 0.66 -1.10 -0.27 0.00 -0.15 0.00 0.00 55.06 54.20 2js3 s HIS 53 Cb -0.18 -1.61 0.03 0.00 1.11 0.00 0.00 32.58 31.93 2js3 s HIS 53 CO 0.38 -0.52 1.11 1.21 -0.85 0.00 0.00 174.74 176.08 2js3 s ASN 54 N 0.80 6.39 -0.29 1.40 2.47 0.21 -1.15 114.94 124.78 2js3 s ASN 54 Ca -0.09 -0.10 -0.08 0.00 0.42 0.00 0.00 52.86 53.02 2js3 s ASN 54 Cb -0.16 -2.51 -0.00 0.00 -1.45 0.00 0.00 41.25 37.13 2js3 s ASN 54 CO 0.00 -1.42 0.09 -1.58 -3.72 0.00 0.00 177.10 170.48 2js3 s GLN 55 N 4.65 3.30 -0.93 0.43 -0.44 0.61 -1.20 119.66 126.09 2js3 s GLN 55 Ca 0.38 -0.72 -0.19 0.00 -2.50 0.00 0.00 55.36 52.32 2js3 s GLN 55 Cb -0.09 -3.40 0.12 0.00 -1.64 0.00 0.00 33.01 28.00 2js3 s GLN 55 CO 0.22 -0.37 1.15 0.00 0.50 0.00 0.00 175.29 176.79 2js3 n LYS 57 N 6.77 0.70 -0.45 0.00 0.00 -1.26 -0.89 118.16 123.02 2js3 n LYS 57 Ca 0.24 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.63 2js3 n LYS 57 Cb 0.49 -1.03 0.27 0.00 -0.00 0.00 0.00 35.03 34.77 2js3 n LYS 57 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2js3 n LEU 58 N -0.53 4.02 0.00 -5.58 4.32 -1.26 -4.60 117.00 113.37 2js3 n LEU 58 Ca 0.01 -2.51 0.00 0.00 -0.02 0.00 0.00 56.01 53.49 2js3 n LEU 58 Cb 0.00 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.33 2js3 n LEU 58 CO 0.01 0.74 0.00 0.00 -1.22 0.00 0.00 177.39 176.92 2js3 n GLY 60 N -0.21 0.74 3.34 0.00 0.00 -0.07 -4.90 105.19 104.08 2js3 n GLY 60 Ca 0.00 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.54 -1.15 0.17 4.61 0.00 -1.21 -5.03 121.76 116.60 2js3 s ALA 61 Ca 0.00 1.52 0.11 0.00 0.00 0.00 0.00 51.96 53.59 2js3 s ALA 61 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2js3 s ALA 61 CO 0.00 -0.26 -0.25 -1.54 0.00 0.00 0.00 175.76 173.71 2js3 s SER 62 N 0.98 3.34 -0.02 0.00 1.04 -1.26 -0.55 113.70 117.23 2js3 s SER 62 Ca -0.06 -0.82 -0.02 0.00 0.48 0.00 0.00 55.95 55.54 2js3 s SER 62 Cb -0.06 -0.23 0.01 0.00 0.10 0.00 0.00 66.02 65.84 2js3 s SER 62 CO -0.08 0.14 0.06 0.54 0.98 0.00 0.00 173.24 174.87 2js3 s VAL 63 N -1.44 -0.01 0.29 5.02 0.11 -0.34 -4.92 120.40 119.12 2js3 s VAL 63 Ca 0.18 0.04 -0.27 0.00 -2.93 0.00 0.00 61.98 59.00 2js3 s VAL 63 Cb -0.09 -0.10 -0.14 0.00 -1.53 0.00 0.00 36.38 34.52 2js3 s VAL 63 CO 0.08 0.02 0.80 -2.65 -3.33 0.00 0.00 175.10 170.02 2js3 n PRO 64 N 3.29 0.86 -1.20 1.54 -0.02 -1.26 0.67 135.00 138.87 2js3 n PRO 64 Ca -0.15 0.30 -0.31 0.00 -2.02 0.00 0.00 63.50 61.32 2js3 n PRO 64 Cb 0.58 -1.57 0.11 0.00 -0.02 0.00 0.00 33.50 32.60 2js3 n PRO 64 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 2js3 s TRP 65 N -1.12 2.46 0.00 6.00 -0.00 -0.76 -2.90 118.94 122.62 2js3 s TRP 65 Ca 0.61 1.53 0.00 0.00 -0.00 0.00 0.00 56.10 58.24 2js3 s TRP 65 Cb -0.74 -3.09 0.00 0.00 -0.00 0.00 0.00 33.47 29.64 2js3 s TRP 65 CO 0.59 -1.97 0.00 1.28 -0.00 0.00 0.00 176.95 176.84 2js3 n LEU 66 N -3.64 0.00 -0.12 5.86 7.99 -1.26 -4.73 117.00 121.10 2js3 n LEU 66 Ca 0.09 0.00 0.12 0.00 -0.01 0.00 0.00 56.01 56.21 2js3 n LEU 66 Cb 0.53 -0.03 0.64 0.00 -0.11 0.00 0.00 43.42 44.45 2js3 n LEU 66 CO 0.53 0.00 0.92 1.67 -1.51 0.00 0.00 177.39 179.00 2js3 n GLN 67 N -1.77 1.15 0.00 3.23 7.27 -1.14 -4.91 117.38 121.21 2js3 n GLN 67 Ca 0.00 -0.23 0.00 0.00 0.07 0.00 0.00 57.00 56.84 2js3 n GLN 67 Cb 0.00 -1.38 0.00 0.00 2.41 0.00 0.00 30.24 31.27 2js3 n GLN 67 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2js3 n THR 68 N -0.62 0.00 0.00 1.69 -1.04 -1.26 -2.99 114.28 110.06 2js3 n THR 68 Ca 0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 2js3 n THR 68 Cb 0.14 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 2js3 n THR 68 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2js3 n GLY 69 N 0.00 0.23 3.59 3.41 0.00 -1.26 -4.96 105.19 106.20 2js3 n GLY 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -3.80 1.61 2.03 -1.16 -2.93 116.55 112.30 2js3 n ASP 70 Ca 0.00 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.07 2js3 n ASP 70 Cb 0.00 -1.22 0.02 0.00 -0.72 0.00 0.00 41.12 39.20 2js3 n ASP 70 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2js3 n GLU 71 N -2.00 -4.57 -1.70 -0.67 1.02 -1.26 -4.92 120.64 106.54 2js3 n GLU 71 Ca 0.00 0.56 -0.39 0.00 -0.02 0.00 0.00 57.16 57.31 2js3 n GLU 71 Cb 0.00 -5.07 0.03 0.00 -0.02 0.00 0.00 31.44 26.39 2js3 n GLU 71 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 2js3 n ILE 72 N -4.36 3.25 -1.78 -3.67 3.06 -1.15 -4.90 119.36 109.81 2js3 n ILE 72 Ca -0.25 -0.50 -0.38 0.00 -2.50 0.00 0.00 62.75 59.12 2js3 n ILE 72 Cb 0.65 -1.51 0.04 0.00 0.54 0.00 0.00 39.64 39.36 2js3 n ILE 72 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 2js3 s LYS 73 N -2.56 3.10 -0.02 9.51 -0.14 -1.26 -5.00 119.74 123.38 2js3 s LYS 73 Ca 0.68 2.23 -0.06 0.00 -1.36 0.00 0.00 55.97 57.46 2js3 s LYS 73 Cb -0.46 -2.23 0.00 0.00 -1.68 0.00 0.00 37.83 33.46 2js3 s LYS 73 CO 0.53 -1.22 0.13 -1.58 -0.76 0.00 0.00 175.35 172.45 2js3 s HIS 74 N -1.31 -0.01 -0.58 3.18 5.65 -1.26 -5.02 115.29 115.94 2js3 s HIS 74 Ca 0.72 0.02 -0.26 0.00 0.25 0.00 0.00 55.06 55.79 2js3 s HIS 74 Cb -0.40 -0.02 -0.05 0.00 -1.18 0.00 0.00 32.58 30.92 2js3 s HIS 74 CO 0.47 -0.21 2.14 0.00 -0.65 0.00 0.00 174.74 176.50 2js3 s ALA 75 N -0.88 1.82 -0.64 1.58 0.00 -1.26 -4.83 121.76 117.55 2js3 s ALA 75 Ca -0.10 -0.40 0.24 0.00 0.00 0.00 0.00 51.96 51.70 2js3 s ALA 75 Cb -0.05 -4.35 0.91 0.00 0.00 0.00 0.00 23.12 19.62 2js3 s ALA 75 CO 0.01 -4.31 1.73 -3.47 0.00 0.00 0.00 175.76 169.72 2js3 n ASP 76 N 14.55 0.63 -0.31 0.00 2.03 -1.26 -1.81 116.55 130.37 2js3 n ASP 76 Ca 0.30 0.61 0.13 0.00 0.52 0.00 0.00 54.79 56.35 2js3 n ASP 76 Cb 0.53 -0.76 0.46 0.00 -0.72 0.00 0.00 41.12 40.63 2js3 n ASP 76 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2js3 n ASP 77 N -2.14 1.13 -4.65 1.67 5.75 -1.26 -4.53 116.55 112.51 2js3 n ASP 77 Ca 0.04 -1.08 -0.35 0.00 -0.01 0.00 0.00 54.79 53.39 2js3 n ASP 77 Cb 0.31 0.07 0.10 0.00 -1.03 0.00 0.00 41.12 40.56 2js3 n ASP 77 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2js3 h PRO 79 N -0.40 0.00 -0.31 0.00 0.13 -1.90 -1.94 132.00 127.57 2js3 h PRO 79 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 2js3 h PRO 79 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2js3 h PRO 79 CO 0.47 0.00 0.20 0.28 -0.23 0.00 0.00 178.00 178.72 2js3 h VAL 80 N 0.00 1.06 -0.09 1.56 2.07 -1.92 -1.06 116.25 117.87 2js3 h VAL 80 Ca 0.00 -0.14 -0.24 0.00 0.82 0.00 0.00 66.70 67.14 2js3 h VAL 80 Cb 0.52 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2js3 h VAL 80 CO 0.00 0.07 -0.88 0.58 0.02 0.00 0.00 177.57 177.37 2js3 h VAL 81 N 0.40 1.29 -0.37 2.57 2.07 -1.58 -0.90 116.25 119.72 2js3 h VAL 81 Ca 0.12 -2.09 -0.08 0.00 0.82 0.00 0.00 66.70 65.47 2js3 h VAL 81 Cb -0.03 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 2js3 h VAL 81 CO -0.03 0.65 -0.10 -0.29 0.02 0.00 0.00 177.57 177.82 2js3 h ILE 82 N 0.47 1.24 -0.64 4.57 6.09 -1.61 -0.50 117.51 127.13 2js3 h ILE 82 Ca -0.08 -1.08 -0.09 0.00 -1.37 0.00 0.00 64.86 62.25 2js3 h ILE 82 Cb 1.51 1.07 -0.02 0.00 0.47 0.00 0.00 36.82 39.84 2js3 h ILE 82 CO 0.17 0.36 0.06 0.00 -3.07 0.00 0.00 178.15 175.68 2js3 h ALA 83 N 1.30 0.89 -0.83 0.18 0.00 -1.12 -2.31 119.26 117.37 2js3 h ALA 83 Ca 0.11 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2js3 h ALA 83 Cb 0.52 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2js3 h ALA 83 CO 0.03 0.67 0.52 0.87 0.00 0.00 0.00 179.25 181.34 2js3 h LYS 84 N 1.01 0.93 -0.55 0.00 6.56 -0.20 -0.57 116.57 123.75 2js3 h LYS 84 Ca 0.19 -0.06 -0.03 0.00 -1.06 0.00 0.00 60.65 59.69 2js3 h LYS 84 Cb 0.49 -0.21 -0.02 0.00 -0.57 0.00 0.00 32.23 31.92 2js3 h LYS 84 CO 0.02 0.61 0.23 0.37 -2.06 0.00 0.00 179.45 178.62 2js3 h GLN 85 N 0.96 0.82 -0.53 3.15 4.15 -0.85 -0.04 115.11 122.76 2js3 h GLN 85 Ca 0.36 -0.14 -0.02 0.00 0.77 0.00 0.00 58.65 59.62 2js3 h GLN 85 Cb 0.14 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 2js3 h GLN 85 CO -0.16 0.70 0.26 0.82 -1.93 0.00 0.00 178.83 178.52 2js3 h ILE 86 N 0.75 1.20 -0.00 2.39 2.04 -0.83 -2.03 117.51 121.02 2js3 h ILE 86 Ca 0.18 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2js3 h ILE 86 Cb 0.19 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2js3 h ILE 86 CO -0.02 0.22 -0.01 0.00 0.00 0.00 0.00 178.15 178.34 2js3 n LEU 87 N -4.59 0.03 -1.17 1.44 -0.00 -0.28 -2.99 117.00 109.44 2js3 n LEU 87 Ca 0.02 0.28 0.07 0.00 -0.00 0.00 0.00 56.01 56.38 2js3 n LEU 87 Cb 0.12 -0.29 0.25 0.00 -0.00 0.00 0.00 43.42 43.49 2js3 n LEU 87 CO 0.37 0.01 0.69 -0.24 -0.00 0.00 0.00 177.39 178.22 2js3 n SER 88 N -1.28 3.42 -4.65 1.45 2.88 -0.04 -4.95 113.62 110.45 2js3 n SER 88 Ca 0.14 -2.28 -0.45 0.00 -1.33 0.00 0.00 58.87 54.95 2js3 n SER 88 Cb 0.25 -0.47 -0.02 0.00 -0.75 0.00 0.00 64.21 63.22 2js3 n SER 88 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2js3 n SER 89 N 0.76 2.30 -2.81 -3.46 2.88 -1.16 -2.82 113.62 109.31 2js3 n SER 89 Ca 0.18 1.16 -0.05 0.00 -1.33 0.00 0.00 58.87 58.83 2js3 n SER 89 Cb 0.64 -1.38 0.01 0.00 -0.75 0.00 0.00 64.21 62.73 2js3 n SER 89 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2js3 n ARG 90 N 1.62 -1.84 -3.12 -1.46 1.74 -1.26 -4.98 116.66 107.35 2js3 n ARG 90 Ca 0.11 1.79 -0.45 0.00 -0.77 0.00 0.00 57.85 58.53 2js3 n ARG 90 Cb 0.31 -5.39 -0.04 0.00 -1.02 0.00 0.00 32.46 26.32 2js3 n ARG 90 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2js3 s PRO 91 N -2.67 3.17 -1.43 5.56 0.04 -1.13 -4.96 135.00 133.58 2js3 s PRO 91 Ca 0.15 -1.53 -0.11 0.00 0.04 0.00 0.00 61.00 59.55 2js3 s PRO 91 Cb -0.04 -4.36 0.06 0.00 0.04 0.00 0.00 34.50 30.20 2js3 s PRO 91 CO 0.70 -1.53 2.29 1.17 0.04 0.00 0.00 177.00 179.67 2js3 n LYS 92 N 6.03 3.40 -0.00 4.56 4.81 -1.26 -4.01 118.16 131.69 2js3 n LYS 92 Ca -0.03 -2.86 0.00 0.00 -0.87 0.00 0.00 58.31 54.55 2js3 n LYS 92 Cb 0.44 -3.03 0.00 0.00 0.02 0.00 0.00 35.03 32.46 2js3 n LYS 92 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2js3 n LEU 93 N 4.58 1.12 -3.00 3.14 4.32 -1.26 -5.05 117.00 120.85 2js3 n LEU 93 Ca 0.55 -1.05 -0.09 0.00 -0.02 0.00 0.00 56.01 55.40 2js3 n LEU 93 Cb 0.34 -0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.15 2js3 n LEU 93 CO 0.85 0.27 0.10 1.57 -1.22 0.00 0.00 177.39 178.96 2js3 n HIS 94 N 0.03 -3.23 -0.67 -1.77 -0.00 -1.26 -4.83 115.22 103.49 2js3 n HIS 94 Ca 0.01 1.29 0.00 0.00 -0.00 0.00 0.00 57.72 59.01 2js3 n HIS 94 Cb 0.03 -3.87 0.00 0.00 -0.00 0.00 0.00 29.99 26.16 2js3 n HIS 94 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2js3 n ALA 95 N -0.80 -1.95 -0.50 1.57 0.00 -1.26 -5.25 120.51 112.31 2js3 n ALA 95 Ca 0.05 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2js3 n ALA 95 Cb 0.50 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.08 2js3 n ALA 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78