#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 1.65 -0.49 -5.12 0.00 -1.26 -5.01 107.32 97.09 2js3 s GLY 2 Ca 0.00 -1.38 0.07 0.00 0.00 0.00 0.00 44.72 43.41 2js3 s GLY 2 CO 0.00 0.52 0.69 -1.35 0.00 0.00 0.00 173.10 172.95 2js3 s SER 3 N 1.40 -1.28 -0.97 1.64 1.04 -1.26 -5.08 113.70 109.19 2js3 s SER 3 Ca 0.02 -1.61 -0.21 0.00 0.48 0.00 0.00 55.95 54.62 2js3 s SER 3 Cb -0.16 1.78 0.08 0.00 0.10 0.00 0.00 66.02 67.82 2js3 s SER 3 CO -0.03 -0.08 1.31 -0.94 0.98 0.00 0.00 173.24 174.48 2js3 s SER 4 N 1.03 6.53 -0.32 7.02 1.04 -1.26 -4.94 113.70 122.81 2js3 s SER 4 Ca 0.27 -1.64 -0.01 0.00 0.48 0.00 0.00 55.95 55.06 2js3 s SER 4 Cb -0.01 -2.50 0.10 0.00 0.10 0.00 0.00 66.02 63.71 2js3 s SER 4 CO -0.06 -1.35 0.11 -2.28 0.98 0.00 0.00 173.24 170.64 2js3 s HIS 5 N 4.10 1.66 0.30 5.02 5.65 -1.26 -5.12 115.29 125.65 2js3 s HIS 5 Ca 0.40 -1.75 -0.29 0.00 0.25 0.00 0.00 55.06 53.67 2js3 s HIS 5 Cb -0.03 -1.69 -0.10 0.00 -1.18 0.00 0.00 32.58 29.59 2js3 s HIS 5 CO -0.09 -0.87 1.26 -3.38 -0.65 0.00 0.00 174.74 171.01 2js3 s HIS 6 N 1.54 3.21 -0.05 3.88 -0.00 -1.26 -4.94 115.29 117.67 2js3 s HIS 6 Ca 0.10 1.45 0.14 0.00 -0.00 0.00 0.00 55.06 56.76 2js3 s HIS 6 Cb -0.18 -3.57 0.25 0.00 -0.00 0.00 0.00 32.58 29.08 2js3 s HIS 6 CO -0.23 -1.54 1.13 -2.39 -0.00 0.00 0.00 174.74 171.70 2js3 n HIS 7 N 1.18 -0.07 -2.85 0.38 1.44 -1.26 -5.03 115.22 109.01 2js3 n HIS 7 Ca 0.01 -0.74 0.02 0.00 -2.01 0.00 0.00 57.72 55.00 2js3 n HIS 7 Cb 0.43 0.26 0.00 0.00 0.12 0.00 0.00 29.99 30.80 2js3 n HIS 7 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2js3 s HIS 8 N -0.30 -0.53 -0.86 -1.40 5.04 -1.26 -5.09 115.29 110.88 2js3 s HIS 8 Ca 0.17 0.10 -0.03 0.00 -1.54 0.00 0.00 55.06 53.76 2js3 s HIS 8 Cb 0.22 0.10 0.21 0.00 0.04 0.00 0.00 32.58 33.16 2js3 s HIS 8 CO -0.08 -0.35 0.75 -1.58 -2.34 0.00 0.00 174.74 171.13 2js3 s HIS 9 N 2.03 3.84 -0.30 3.88 2.46 -1.26 -4.95 115.29 121.00 2js3 s HIS 9 Ca 0.16 -2.91 -0.12 0.00 0.47 0.00 0.00 55.06 52.65 2js3 s HIS 9 Cb 0.02 -3.30 0.17 0.00 -0.13 0.00 0.00 32.58 29.33 2js3 s HIS 9 CO -0.15 -0.78 0.92 -1.58 -2.47 0.00 0.00 174.74 170.69 2js3 s HIS 10 N -1.08 -0.82 0.21 3.88 5.65 -1.26 -5.18 115.29 116.70 2js3 s HIS 10 Ca 0.26 1.22 0.08 0.00 0.25 0.00 0.00 55.06 56.87 2js3 s HIS 10 Cb -0.10 0.42 -0.04 0.00 -1.18 0.00 0.00 32.58 31.68 2js3 s HIS 10 CO -0.11 -0.42 -0.01 -1.54 -0.65 0.00 0.00 174.74 172.02 2js3 s SER 11 N 2.65 4.65 -0.18 9.88 1.04 -1.26 -5.13 113.70 125.35 2js3 s SER 11 Ca 0.00 -0.50 -0.12 0.00 0.48 0.00 0.00 55.95 55.81 2js3 s SER 11 Cb -0.09 -0.93 0.06 0.00 0.10 0.00 0.00 66.02 65.16 2js3 s SER 11 CO -0.17 0.06 0.45 -0.44 0.98 0.00 0.00 173.24 174.12 2js3 s SER 12 N -3.20 -0.54 0.00 7.02 0.01 -1.26 -5.16 113.70 110.57 2js3 s SER 12 Ca 0.29 0.96 0.00 0.00 1.31 0.00 0.00 55.95 58.51 2js3 s SER 12 Cb -0.08 0.89 0.00 0.00 0.21 0.00 0.00 66.02 67.04 2js3 s SER 12 CO 0.19 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2js3 n GLY 13 N 3.74 0.98 2.42 3.44 0.00 -1.26 -4.86 105.19 109.65 2js3 n GLY 13 Ca -0.19 -0.28 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.92 -2.19 1.61 5.12 -1.26 -4.97 116.66 114.05 2js3 n ARG 14 Ca 0.00 0.63 -0.41 0.00 -1.93 0.00 0.00 57.85 56.14 2js3 n ARG 14 Cb 0.00 -4.54 -0.03 0.00 -1.16 0.00 0.00 32.46 26.73 2js3 n ARG 14 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2js3 s GLU 15 N -2.17 4.37 0.00 5.56 -6.30 -1.26 -4.90 118.70 114.01 2js3 s GLU 15 Ca 0.00 2.09 0.01 0.00 -2.50 0.00 0.00 54.97 54.57 2js3 s GLU 15 Cb 0.00 -3.18 0.02 0.00 0.00 0.00 0.00 34.13 30.97 2js3 s GLU 15 CO 0.00 -0.27 0.77 0.27 0.02 0.00 0.00 175.26 176.05 2js3 n ASN 16 N 2.57 -0.00 -2.21 -1.70 0.23 -1.26 -5.12 115.26 107.77 2js3 n ASN 16 Ca 0.06 -1.53 -0.02 0.00 -0.53 0.00 0.00 54.58 52.56 2js3 n ASN 16 Cb 0.42 -0.09 0.01 0.00 -2.08 0.00 0.00 39.78 38.04 2js3 n ASN 16 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2js3 n LEU 17 N 0.02 0.00 -3.78 -4.53 4.77 -1.26 -5.14 117.00 107.08 2js3 n LEU 17 Ca -0.01 -0.17 -0.02 0.00 -0.03 0.00 0.00 56.01 55.78 2js3 n LEU 17 Cb 0.63 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.66 2js3 n LEU 17 CO -0.01 -0.54 0.84 -0.47 -1.33 0.00 0.00 177.39 175.89 2js3 s TYR 18 N 0.02 -0.04 -1.20 -1.77 5.04 -1.26 -5.06 117.35 113.08 2js3 s TYR 18 Ca 0.05 -0.24 -0.18 0.00 -2.44 0.00 0.00 57.07 54.27 2js3 s TYR 18 Cb -0.00 0.63 -0.03 0.00 0.35 0.00 0.00 41.96 42.91 2js3 s TYR 18 CO 0.04 -0.71 2.06 1.19 -1.34 0.00 0.00 175.55 176.79 2js3 n PHE 19 N -0.57 3.08 -0.09 4.97 3.72 -1.26 -3.91 117.46 123.40 2js3 n PHE 19 Ca -0.05 -2.49 0.00 0.00 -0.05 0.00 0.00 57.45 54.86 2js3 n PHE 19 Cb 0.61 -2.30 0.00 0.00 -0.94 0.00 0.00 39.48 36.85 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 6.79 2.67 0.00 -1.08 6.02 -1.26 -4.98 117.38 125.53 2js3 n GLN 20 Ca 0.50 -0.18 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 2js3 n GLN 20 Cb 0.41 -0.63 0.00 0.00 1.02 0.00 0.00 30.24 31.04 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 0.43 -1.40 3.75 1.08 0.00 -1.25 -5.15 105.19 102.65 2js3 n GLY 21 Ca 0.00 0.78 -0.41 0.00 0.00 0.00 0.00 46.02 46.40 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 0.00 4.54 0.83 1.61 -1.94 -1.26 -4.99 119.30 118.09 2js3 s MET 22 Ca 0.00 1.86 -0.12 0.00 -1.71 0.00 0.00 55.69 55.72 2js3 s MET 22 Cb 0.00 -3.21 0.09 0.00 2.01 0.00 0.00 34.83 33.72 2js3 s MET 22 CO 0.00 0.03 1.16 -0.08 -0.01 0.00 0.00 175.02 176.12 2js3 s THR 23 N -0.56 2.09 0.39 2.05 -1.32 -1.26 -4.96 115.64 112.07 2js3 s THR 23 Ca 0.49 0.03 0.09 0.00 -1.21 0.00 0.00 61.69 61.09 2js3 s THR 23 Cb -0.33 -2.96 0.19 0.00 -1.51 0.00 0.00 72.50 67.90 2js3 s THR 23 CO 0.39 -0.04 1.96 -0.78 -2.21 0.00 0.00 174.62 173.94 2js3 h ASP 24 N -1.16 0.31 0.09 8.08 3.58 -2.04 -2.17 116.42 123.10 2js3 h ASP 24 Ca -0.47 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 56.92 2js3 h ASP 24 Cb 1.33 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 42.29 2js3 h ASP 24 CO 0.65 0.38 -0.07 0.74 -2.88 0.00 0.00 179.24 178.05 2js3 h THR 25 N 0.33 0.90 -0.07 2.25 2.02 -2.03 -2.86 112.91 113.45 2js3 h THR 25 Ca 0.07 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.02 2js3 h THR 25 Cb 0.25 1.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 2js3 h THR 25 CO 0.01 0.07 0.05 0.00 0.37 0.00 0.00 175.52 176.01 2js3 h ALA 26 N 1.93 2.04 0.00 6.16 0.00 -1.76 -1.17 119.26 126.45 2js3 h ALA 26 Ca -0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2js3 h ALA 26 Cb 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2js3 h ALA 26 CO 0.01 -0.05 -0.36 0.00 0.00 0.00 0.00 179.25 178.85 2js3 h ALA 27 N 1.96 1.24 0.25 0.00 0.00 -1.68 -2.90 119.26 118.13 2js3 h ALA 27 Ca 0.03 -0.32 -0.34 0.00 0.00 0.00 0.00 54.91 54.28 2js3 h ALA 27 Cb 0.09 -0.06 0.04 0.00 0.00 0.00 0.00 17.79 17.87 2js3 h ALA 27 CO -0.00 0.44 -1.47 1.49 0.00 0.00 0.00 179.25 179.71 2js3 h GLU 28 N 0.00 0.55 -0.00 0.00 4.57 -1.39 -2.49 114.58 115.81 2js3 h GLU 28 Ca -0.00 -0.93 -0.00 0.00 -1.18 0.00 0.00 59.36 57.25 2js3 h GLU 28 Cb 0.71 0.34 -0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2js3 h GLU 28 CO 0.05 1.44 0.00 -0.44 -1.18 0.00 0.00 179.01 178.88 2js3 h ASP 29 N 0.16 0.00 0.10 1.04 3.32 -1.50 -2.19 116.42 117.35 2js3 h ASP 29 Ca -0.25 -0.24 -0.06 0.00 0.02 0.00 0.00 57.03 56.49 2js3 h ASP 29 Cb 2.16 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.70 2js3 h ASP 29 CO 0.28 0.25 -0.20 0.58 -1.72 0.00 0.00 179.24 178.42 2js3 h VAL 30 N -0.24 1.20 -0.59 -1.35 2.07 -1.64 -2.04 116.25 113.66 2js3 h VAL 30 Ca 0.00 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 2js3 h VAL 30 Cb 0.24 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2js3 h VAL 30 CO 0.00 0.28 0.32 -0.09 0.02 0.00 0.00 177.57 178.10 2js3 h ARG 31 N 0.19 0.82 -0.12 1.57 2.43 -1.18 -0.10 114.38 117.99 2js3 h ARG 31 Ca 0.03 -0.09 -0.21 0.00 -0.81 0.00 0.00 59.98 58.91 2js3 h ARG 31 Cb 0.46 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2js3 h ARG 31 CO 0.03 0.61 -0.77 0.87 -1.51 0.00 0.00 179.97 179.20 2js3 h LYS 32 N 0.83 0.64 -0.46 0.20 6.56 -0.75 -2.96 116.57 120.62 2js3 h LYS 32 Ca 0.21 -0.53 -0.02 0.00 -1.06 0.00 0.00 60.65 59.25 2js3 h LYS 32 Cb 0.03 0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 2js3 h LYS 32 CO -0.03 1.15 0.23 0.82 -2.06 0.00 0.00 179.45 179.55 2js3 h ILE 33 N 0.43 1.18 -0.19 1.86 2.04 -0.81 -2.53 117.51 119.50 2js3 h ILE 33 Ca -0.05 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 2js3 h ILE 33 Cb 1.38 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 2js3 h ILE 33 CO 0.15 0.20 0.06 0.00 0.00 0.00 0.00 178.15 178.56 2js3 h ALA 34 N 1.07 1.74 -0.15 1.87 0.00 -1.05 -2.07 119.26 120.67 2js3 h ALA 34 Ca 0.16 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2js3 h ALA 34 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2js3 h ALA 34 CO -0.02 0.21 -0.29 1.15 0.00 0.00 0.00 179.25 180.30 2js3 h THR 35 N 0.27 1.26 0.18 0.00 2.02 -1.28 -3.08 112.91 112.28 2js3 h THR 35 Ca 0.07 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.00 2js3 h THR 35 Cb 0.09 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2js3 h THR 35 CO -0.00 0.38 -0.09 0.00 0.37 0.00 0.00 175.52 176.17 2js3 h ALA 36 N 1.45 -0.25 0.00 6.16 0.00 -1.25 -2.83 119.26 122.54 2js3 h ALA 36 Ca 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2js3 h ALA 36 Cb 0.64 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2js3 h ALA 36 CO 0.05 -0.62 -0.13 1.37 0.00 0.00 0.00 179.25 179.92 2js3 h LEU 37 N -0.29 0.00 -1.16 0.00 8.10 -1.58 0.32 115.31 120.70 2js3 h LEU 37 Ca -0.03 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.90 2js3 h LEU 37 Cb 0.23 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.43 2js3 h LEU 37 CO 0.04 0.13 -0.06 -0.07 -4.11 0.00 0.00 178.44 174.37 2js3 h LEU 38 N 0.00 0.49 0.00 0.17 3.38 -1.41 -2.59 115.31 115.35 2js3 h LEU 38 Ca -0.00 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.70 2js3 h LEU 38 Cb 0.36 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2js3 h LEU 38 CO 0.02 0.60 -1.17 0.29 0.09 0.00 0.00 178.44 178.27 2js3 n LYS 39 N -4.24 0.52 0.10 1.13 4.76 -0.52 -4.56 118.16 115.34 2js3 n LYS 39 Ca 0.01 0.46 0.08 0.00 -2.87 0.00 0.00 58.31 55.99 2js3 n LYS 39 Cb 0.28 -1.64 -0.01 0.00 -1.84 0.00 0.00 35.03 31.82 2js3 n LYS 39 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2js3 h THR 40 N -1.00 0.17 0.00 -0.18 1.35 -1.10 -3.25 112.91 108.89 2js3 h THR 40 Ca -0.24 -1.31 0.00 0.00 -0.55 0.00 0.00 66.41 64.31 2js3 h THR 40 Cb 1.04 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2js3 h THR 40 CO -0.14 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.22 2js3 n ALA 41 N -2.23 2.18 -2.45 6.62 0.00 -0.97 -4.51 120.51 119.14 2js3 n ALA 41 Ca -0.02 -0.04 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 2js3 n ALA 41 Cb 0.63 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 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 -3.08 3.83 -0.01 0.00 -1.09 -1.23 -4.24 121.20 115.39 2js3 s ILE 42 Ca 0.11 0.70 0.01 0.00 -2.23 0.00 0.00 60.65 59.24 2js3 s ILE 42 Cb 0.14 -4.55 -0.04 0.00 -1.58 0.00 0.00 42.46 36.44 2js3 s ILE 42 CO 0.52 -1.27 0.01 -0.70 -1.23 0.00 0.00 174.94 172.26 2js3 s GLU 43 N 5.41 2.82 -0.36 2.79 2.12 -1.00 -4.96 118.70 125.53 2js3 s GLU 43 Ca 0.49 -0.59 -0.13 0.00 0.36 0.00 0.00 54.97 55.10 2js3 s GLU 43 Cb -0.10 -2.69 0.01 0.00 0.26 0.00 0.00 34.13 31.60 2js3 s GLU 43 CO 0.24 0.63 0.24 0.42 -0.54 0.00 0.00 175.26 176.25 2js3 s ILE 44 N -1.08 5.02 -0.48 -3.70 -1.09 -1.26 -1.11 121.20 117.50 2js3 s ILE 44 Ca 0.19 -0.52 -0.16 0.00 -2.23 0.00 0.00 60.65 57.93 2js3 s ILE 44 Cb -0.12 -3.69 0.07 0.00 -1.58 0.00 0.00 42.46 37.14 2js3 s ILE 44 CO 0.10 -0.14 0.45 0.68 -1.23 0.00 0.00 174.94 174.81 2js3 s VAL 45 N 1.66 5.14 -0.06 2.92 -7.23 -0.03 -4.89 120.40 117.91 2js3 s VAL 45 Ca 0.05 -0.91 -0.02 0.00 -1.81 0.00 0.00 61.98 59.29 2js3 s VAL 45 Cb -0.18 -4.17 -0.04 0.00 0.56 0.00 0.00 36.38 32.55 2js3 s VAL 45 CO 0.09 -0.63 0.05 -0.94 -0.31 0.00 0.00 175.10 173.36 2js3 s SER 46 N 2.60 5.60 0.55 4.85 1.04 -1.26 -0.90 113.70 126.19 2js3 s SER 46 Ca 0.07 0.20 -0.14 0.00 0.48 0.00 0.00 55.95 56.57 2js3 s SER 46 Cb -0.23 -1.64 -0.06 0.00 0.10 0.00 0.00 66.02 64.20 2js3 s SER 46 CO 0.08 0.35 0.99 -1.61 0.98 0.00 0.00 173.24 174.03 2js3 s GLU 47 N -1.21 3.78 0.23 4.02 2.02 -0.39 -4.96 118.70 122.18 2js3 s GLU 47 Ca 0.17 0.82 -0.07 0.00 0.02 0.00 0.00 54.97 55.91 2js3 s GLU 47 Cb -0.12 -2.13 0.37 0.00 0.10 0.00 0.00 34.13 32.35 2js3 s GLU 47 CO 0.07 -0.39 1.74 1.05 0.02 0.00 0.00 175.26 177.75 2js3 h GLU 48 N 0.38 0.42 -0.99 1.61 4.11 -1.99 -3.41 114.58 114.70 2js3 h GLU 48 Ca -0.46 -0.03 0.12 0.00 0.07 0.00 0.00 59.36 59.07 2js3 h GLU 48 Cb 1.19 -0.09 -0.21 0.00 0.50 0.00 0.00 28.75 30.13 2js3 h GLU 48 CO 0.62 0.28 -0.15 0.34 0.07 0.00 0.00 179.01 180.16 2js3 s ASP 49 N -5.37 -1.15 0.00 3.06 2.15 -1.26 -4.99 116.67 109.11 2js3 s ASP 49 Ca -0.13 0.85 0.00 0.00 0.43 0.00 0.00 52.55 53.70 2js3 s ASP 49 Cb 0.19 2.01 0.00 0.00 -0.30 0.00 0.00 42.92 44.82 2js3 s ASP 49 CO 0.75 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 176.15 2js3 n GLY 50 N 5.42 0.19 0.00 2.66 0.00 -1.26 -5.14 105.19 107.06 2js3 n GLY 50 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 4.29 3.93 -0.02 0.00 -1.26 -5.03 105.19 107.10 2js3 n GLY 51 Ca 0.00 -0.84 -0.27 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.73 3.86 -0.11 4.61 0.00 -1.26 -1.26 121.76 125.87 2js3 s ALA 52 Ca 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.09 2js3 s ALA 52 Cb 0.00 -1.95 0.02 0.00 0.00 0.00 0.00 23.12 21.19 2js3 s ALA 52 CO 0.00 0.45 -0.12 -1.01 0.00 0.00 0.00 175.76 175.08 2js3 s HIS 53 N -1.85 1.73 -0.36 0.00 3.76 -0.07 -2.10 115.29 116.40 2js3 s HIS 53 Ca 0.38 -0.83 -0.27 0.00 -0.15 0.00 0.00 55.06 54.19 2js3 s HIS 53 Cb -0.11 -1.31 0.02 0.00 1.11 0.00 0.00 32.58 32.29 2js3 s HIS 53 CO 0.29 -0.48 0.97 1.21 -0.85 0.00 0.00 174.74 175.88 2js3 s ASN 54 N 1.24 6.74 -0.08 1.40 3.84 0.12 -0.85 114.94 127.34 2js3 s ASN 54 Ca -0.03 0.69 0.01 0.00 0.21 0.00 0.00 52.86 53.74 2js3 s ASN 54 Cb -0.14 -2.49 0.02 0.00 -0.55 0.00 0.00 41.25 38.09 2js3 s ASN 54 CO -0.04 -0.88 -0.08 -1.58 -2.79 0.00 0.00 177.10 171.73 2js3 s GLN 55 N 3.57 1.42 -0.63 0.43 0.74 -0.26 -0.67 119.66 124.25 2js3 s GLN 55 Ca 0.40 -0.26 -0.25 0.00 0.05 0.00 0.00 55.36 55.30 2js3 s GLN 55 Cb -0.12 -1.38 0.04 0.00 1.10 0.00 0.00 33.01 32.66 2js3 s GLN 55 CO 0.19 -0.15 1.09 0.00 -0.55 0.00 0.00 175.29 175.87 2js3 n LYS 57 N 8.23 1.01 -0.44 0.00 2.85 -1.26 -0.35 118.16 128.21 2js3 n LYS 57 Ca 0.02 -0.02 0.08 0.00 -1.05 0.00 0.00 58.31 57.34 2js3 n LYS 57 Cb 0.48 -1.12 0.27 0.00 -0.65 0.00 0.00 35.03 34.01 2js3 n LYS 57 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 2js3 n LEU 58 N -0.60 4.00 0.00 -5.58 7.94 -1.26 -4.58 117.00 116.92 2js3 n LEU 58 Ca 0.06 -2.43 0.00 0.00 -1.11 0.00 0.00 56.01 52.53 2js3 n LEU 58 Cb 0.03 -0.46 0.00 0.00 0.53 0.00 0.00 43.42 43.52 2js3 n LEU 58 CO 0.04 0.76 0.00 0.00 -1.11 0.00 0.00 177.39 177.09 2js3 n GLY 60 N 0.08 0.74 3.75 0.00 0.00 0.53 -4.84 105.19 105.45 2js3 n GLY 60 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.00 3.35 0.03 4.61 0.00 -1.23 -4.89 121.76 121.62 2js3 s ALA 61 Ca 0.00 0.71 -0.04 0.00 0.00 0.00 0.00 51.96 52.63 2js3 s ALA 61 Cb 0.00 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 2js3 s ALA 61 CO 0.00 0.03 0.07 -1.54 0.00 0.00 0.00 175.76 174.32 2js3 s SER 62 N -0.81 0.18 -0.07 0.00 1.04 -1.26 -1.08 113.70 111.71 2js3 s SER 62 Ca 0.44 -0.50 -0.17 0.00 0.48 0.00 0.00 55.95 56.20 2js3 s SER 62 Cb -0.28 0.19 0.04 0.00 0.10 0.00 0.00 66.02 66.07 2js3 s SER 62 CO 0.34 -0.44 0.41 0.54 0.98 0.00 0.00 173.24 175.07 2js3 s VAL 63 N -2.22 0.03 -0.17 5.02 0.11 0.15 -4.96 120.40 118.36 2js3 s VAL 63 Ca -0.08 -0.24 -0.42 0.00 -2.93 0.00 0.00 61.98 58.31 2js3 s VAL 63 Cb -0.04 -0.67 -0.20 0.00 -1.53 0.00 0.00 36.38 33.95 2js3 s VAL 63 CO -0.03 -0.13 1.25 -2.65 -3.33 0.00 0.00 175.10 170.21 2js3 n PRO 64 N 1.77 0.01 0.27 1.54 -0.02 -1.26 0.13 135.00 137.44 2js3 n PRO 64 Ca -0.18 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.44 2js3 n PRO 64 Cb 0.56 -1.50 0.78 0.00 -0.02 0.00 0.00 33.50 33.32 2js3 n PRO 64 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 2js3 h TRP 65 N 3.70 0.00 -0.44 6.00 5.08 -1.75 -1.35 115.95 127.19 2js3 h TRP 65 Ca -0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.48 2js3 h TRP 65 Cb 1.41 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.57 2js3 h TRP 65 CO 0.60 0.09 0.00 -0.11 -1.28 0.00 0.00 178.44 177.74 2js3 n LEU 66 N -3.64 3.14 0.00 0.11 7.94 -1.26 -4.37 117.00 118.92 2js3 n LEU 66 Ca -0.02 -1.58 0.00 0.00 -1.11 0.00 0.00 56.01 53.30 2js3 n LEU 66 Cb 0.21 -0.44 0.00 0.00 0.53 0.00 0.00 43.42 43.72 2js3 n LEU 66 CO 0.29 0.58 0.00 1.67 -1.11 0.00 0.00 177.39 178.82 2js3 n GLN 67 N 0.71 0.00 0.00 1.96 0.00 -0.51 -5.12 117.38 114.42 2js3 n GLN 67 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.17 2js3 n GLN 67 Cb 0.58 -0.31 0.00 0.00 0.00 0.00 0.00 30.24 30.51 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 -2.45 0.00 0.00 1.69 5.66 -1.24 -5.04 114.28 112.90 2js3 n THR 68 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2js3 n THR 68 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 0.03 2.51 0.06 1.09 0.00 -1.26 -4.87 105.19 102.75 2js3 n GLY 69 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 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 1.40 0.00 1.61 -0.08 -1.26 -4.51 116.55 113.71 2js3 n ASP 70 Ca 0.00 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.40 2js3 n ASP 70 Cb 0.00 1.04 0.57 0.00 2.34 0.00 0.00 41.12 45.07 2js3 n ASP 70 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2js3 n GLU 71 N -2.44 0.22 -2.04 -0.67 2.13 -1.26 -4.84 120.64 111.74 2js3 n GLU 71 Ca -0.19 0.07 -0.41 0.00 0.66 0.00 0.00 57.16 57.29 2js3 n GLU 71 Cb 0.86 -1.50 -0.02 0.00 0.27 0.00 0.00 31.44 31.05 2js3 n GLU 71 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 2js3 s ILE 72 N -2.72 2.65 -0.33 6.31 -4.36 -1.26 -4.94 121.20 116.54 2js3 s ILE 72 Ca 0.19 0.59 -0.25 0.00 -0.26 0.00 0.00 60.65 60.92 2js3 s ILE 72 Cb 0.16 -3.38 0.01 0.00 1.25 0.00 0.00 42.46 40.50 2js3 s ILE 72 CO 0.39 0.12 0.86 -0.54 0.24 0.00 0.00 174.94 176.01 2js3 s LYS 73 N -1.05 3.91 0.78 0.37 -0.14 -1.26 -5.03 119.74 117.32 2js3 s LYS 73 Ca 0.55 0.61 -0.12 0.00 -1.36 0.00 0.00 55.97 55.65 2js3 s LYS 73 Cb -0.41 -3.76 0.06 0.00 -1.68 0.00 0.00 37.83 32.03 2js3 s LYS 73 CO 0.48 -0.81 1.11 -3.38 -0.76 0.00 0.00 175.35 172.00 2js3 s HIS 74 N 3.21 2.99 -0.12 3.18 -3.43 -1.26 -4.86 115.29 115.00 2js3 s HIS 74 Ca 0.35 1.02 -0.14 0.00 -0.80 0.00 0.00 55.06 55.50 2js3 s HIS 74 Cb -0.13 -3.19 -0.05 0.00 -1.43 0.00 0.00 32.58 27.79 2js3 s HIS 74 CO 0.15 -1.63 0.31 0.00 -2.00 0.00 0.00 174.74 171.58 2js3 s ALA 75 N -3.30 3.63 -1.53 -1.38 0.00 -1.26 -4.97 121.76 112.94 2js3 s ALA 75 Ca 0.60 -0.41 0.24 0.00 0.00 0.00 0.00 51.96 52.40 2js3 s ALA 75 Cb -0.13 -2.37 1.25 0.00 0.00 0.00 0.00 23.12 21.87 2js3 s ALA 75 CO 0.53 0.20 1.79 -0.25 0.00 0.00 0.00 175.76 178.03 2js3 n ASP 76 N 3.11 0.00 0.06 0.00 8.00 -1.26 -2.08 116.55 124.38 2js3 n ASP 76 Ca -0.13 -0.18 0.13 0.00 0.71 0.00 0.00 54.79 55.32 2js3 n ASP 76 Cb 0.52 -0.23 0.35 0.00 -0.02 0.00 0.00 41.12 41.73 2js3 n ASP 76 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2js3 n ASP 77 N -1.23 0.58 -4.81 -2.24 2.03 -1.26 -4.89 116.55 104.73 2js3 n ASP 77 Ca 0.13 0.30 -0.33 0.00 0.52 0.00 0.00 54.79 55.40 2js3 n ASP 77 Cb 0.17 -0.28 -0.05 0.00 -0.72 0.00 0.00 41.12 40.24 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 -0.83 0.28 0.03 0.00 -0.04 -1.26 -2.87 135.00 130.31 2js3 n PRO 79 Ca 0.08 0.10 0.02 0.00 -0.04 0.00 0.00 63.50 63.66 2js3 n PRO 79 Cb 0.53 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.85 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 1.17 -0.25 0.52 2.07 -1.91 -1.59 116.25 116.25 2js3 h VAL 80 Ca 0.00 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 2js3 h VAL 80 Cb 0.08 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2js3 h VAL 80 CO 0.00 0.22 0.14 0.58 0.02 0.00 0.00 177.57 178.52 2js3 h VAL 81 N 0.44 1.12 -0.64 2.57 2.07 -1.87 -0.61 116.25 119.33 2js3 h VAL 81 Ca 0.10 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.25 2js3 h VAL 81 Cb 0.24 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2js3 h VAL 81 CO 0.00 0.12 0.18 0.40 0.02 0.00 0.00 177.57 178.29 2js3 h ILE 82 N 0.29 1.25 -0.53 4.57 1.08 -1.68 -2.24 117.51 120.26 2js3 h ILE 82 Ca 0.09 -0.90 0.01 0.00 -0.39 0.00 0.00 64.86 63.67 2js3 h ILE 82 Cb 0.07 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 2js3 h ILE 82 CO -0.01 0.34 0.35 0.00 -0.69 0.00 0.00 178.15 178.13 2js3 h ALA 83 N 1.07 0.67 -0.83 1.87 0.00 -1.02 -2.04 119.26 118.98 2js3 h ALA 83 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2js3 h ALA 83 Cb 0.33 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2js3 h ALA 83 CO -0.00 0.10 0.49 0.87 0.00 0.00 0.00 179.25 180.70 2js3 h LYS 84 N 0.70 1.14 -0.45 0.00 1.57 -0.86 -1.63 116.57 117.04 2js3 h LYS 84 Ca 0.20 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2js3 h LYS 84 Cb -0.06 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 31.99 2js3 h LYS 84 CO -0.05 0.81 0.29 1.96 -0.57 0.00 0.00 179.45 181.89 2js3 h GLN 85 N 1.15 0.59 0.19 3.15 4.20 -0.84 -0.57 115.11 122.98 2js3 h GLN 85 Ca 0.30 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.96 2js3 h GLN 85 Cb -0.03 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.62 2js3 h GLN 85 CO -0.05 0.39 -0.09 0.82 -0.67 0.00 0.00 178.83 179.23 2js3 h ILE 86 N 0.60 0.88 0.00 2.54 2.04 -0.89 0.63 117.51 123.32 2js3 h ILE 86 Ca 0.16 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2js3 h ILE 86 Cb -0.06 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2js3 h ILE 86 CO -0.03 0.08 0.00 0.17 0.00 0.00 0.00 178.15 178.36 2js3 h LEU 87 N -0.42 0.00 0.19 1.44 8.10 -1.26 -2.48 115.31 120.88 2js3 h LEU 87 Ca -0.03 0.00 -0.31 0.00 0.11 0.00 0.00 57.88 57.66 2js3 h LEU 87 Cb 0.32 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 40.56 2js3 h LEU 87 CO 0.04 0.00 -1.47 -1.28 -4.11 0.00 0.00 178.44 171.63 2js3 h SER 88 N 0.00 0.63 -1.67 0.17 0.87 -0.88 -3.48 113.55 109.18 2js3 h SER 88 Ca 0.00 -0.92 -0.40 0.00 -1.23 0.00 0.00 61.79 59.24 2js3 h SER 88 Cb 0.47 -0.20 -0.10 0.00 -0.44 0.00 0.00 62.40 62.13 2js3 h SER 88 CO 0.00 1.68 -0.42 -1.20 -0.53 0.00 0.00 176.83 176.36 2js3 n SER 89 N -3.78 -5.45 -3.95 6.23 7.64 0.19 -4.95 113.62 109.56 2js3 n SER 89 Ca -0.21 0.28 -0.31 0.00 1.01 0.00 0.00 58.87 59.65 2js3 n SER 89 Cb 1.01 -4.59 -0.15 0.00 -1.01 0.00 0.00 64.21 59.47 2js3 n SER 89 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2js3 s ARG 90 N -4.18 1.35 -0.59 1.43 3.52 -1.26 -5.08 118.95 114.14 2js3 s ARG 90 Ca 0.00 -1.60 -0.25 0.00 -0.13 0.00 0.00 55.73 53.75 2js3 s ARG 90 Cb 0.00 -2.86 0.04 0.00 -1.56 0.00 0.00 34.95 30.57 2js3 s ARG 90 CO 0.00 -0.91 1.01 -1.25 -0.81 0.00 0.00 175.30 173.34 2js3 s PRO 91 N 1.11 3.31 -0.50 5.12 0.05 -1.26 -5.01 135.00 137.82 2js3 s PRO 91 Ca 0.09 -0.28 -0.19 0.00 0.05 0.00 0.00 61.00 60.67 2js3 s PRO 91 Cb -0.19 -4.08 0.06 0.00 0.05 0.00 0.00 34.50 30.34 2js3 s PRO 91 CO -0.12 -1.62 0.60 0.15 0.05 0.00 0.00 177.00 176.07 2js3 s LYS 92 N 4.25 3.11 0.00 4.56 -0.14 -1.26 -4.79 119.74 125.46 2js3 s LYS 92 Ca 0.31 -0.95 0.00 0.00 -1.36 0.00 0.00 55.97 53.97 2js3 s LYS 92 Cb -0.12 -4.11 0.00 0.00 -1.68 0.00 0.00 37.83 31.92 2js3 s LYS 92 CO 0.18 -1.21 0.00 -0.11 -0.76 0.00 0.00 175.35 173.46 2js3 n LEU 93 N 6.07 0.00 0.00 3.17 7.94 -1.26 -2.74 117.00 130.18 2js3 n LEU 93 Ca -0.07 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 2js3 n LEU 93 Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 2js3 n LEU 93 CO 0.53 0.00 0.00 1.57 -1.11 0.00 0.00 177.39 178.38 2js3 n HIS 94 N 0.00 0.00 -4.87 1.96 -0.00 -1.26 -5.16 115.22 105.89 2js3 n HIS 94 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2js3 n HIS 94 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 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 -1.44 0.00 0.42 1.57 0.00 -1.11 -5.11 120.51 114.85 2js3 n ALA 95 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2js3 n ALA 95 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2js3 n ALA 95 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05