#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z4h s GLN 2 N 0.00 4.62 -0.18 2.12 -0.21 -1.26 -5.04 119.66 119.72 1z4h s GLN 2 Ca 0.00 1.44 0.01 0.00 0.02 0.00 0.00 55.36 56.82 1z4h s GLN 2 Cb 0.00 -3.42 0.01 0.00 1.00 0.00 0.00 33.01 30.60 1z4h s GLN 2 CO 0.00 0.07 -0.18 -1.01 -2.12 0.00 0.00 175.29 172.05 1z4h s HIS 3 N 0.55 2.78 -0.44 0.91 3.76 -1.26 -5.09 115.29 116.50 1z4h s HIS 3 Ca 0.50 -1.47 -0.12 0.00 -0.15 0.00 0.00 55.06 53.82 1z4h s HIS 3 Cb -0.22 -1.92 0.07 0.00 1.11 0.00 0.00 32.58 31.62 1z4h s HIS 3 CO 0.29 -0.72 0.32 -1.21 -0.85 0.00 0.00 174.74 172.57 1z4h s GLU 4 N 1.18 2.78 0.34 1.40 2.02 -1.26 -5.06 118.70 120.11 1z4h s GLU 4 Ca 0.02 -1.39 0.07 0.00 0.02 0.00 0.00 54.97 53.70 1z4h s GLU 4 Cb -0.14 -3.94 -0.02 0.00 0.10 0.00 0.00 34.13 30.14 1z4h s GLU 4 CO -0.09 -0.97 0.36 -0.48 0.02 0.00 0.00 175.26 174.10 1z4h s LEU 5 N 1.53 3.71 0.37 1.80 0.05 -1.26 -5.14 118.68 119.73 1z4h s LEU 5 Ca 0.03 -0.41 0.09 0.00 0.05 0.00 0.00 54.13 53.89 1z4h s LEU 5 Cb -0.23 -2.39 -0.07 0.00 -2.05 0.00 0.00 46.19 41.45 1z4h s LEU 5 CO 0.04 -0.41 -0.04 0.00 -0.55 0.00 0.00 176.35 175.39 1z4h s GLN 6 N -4.07 1.90 0.12 1.48 -2.07 -1.26 -5.03 119.66 110.73 1z4h s GLN 6 Ca 0.43 -1.97 -0.02 0.00 -1.82 0.00 0.00 55.36 51.98 1z4h s GLN 6 Cb -0.07 -1.72 0.24 0.00 -1.09 0.00 0.00 33.01 30.37 1z4h s GLN 6 CO 0.28 0.07 0.66 -2.30 -1.32 0.00 0.00 175.29 172.68 1z4h n PRO 7 N -0.88 -0.04 -3.43 9.60 -0.02 -1.26 -3.11 135.00 135.86 1z4h n PRO 7 Ca -0.05 0.65 -0.44 0.00 -2.02 0.00 0.00 63.50 61.65 1z4h n PRO 7 Cb 0.64 -0.99 -0.08 0.00 -0.02 0.00 0.00 33.50 33.06 1z4h n PRO 7 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1z4h s ASP 8 N -5.07 6.02 0.07 2.55 2.15 -1.26 0.62 116.67 121.75 1z4h s ASP 8 Ca -0.06 -1.47 -0.27 0.00 0.43 0.00 0.00 52.55 51.17 1z4h s ASP 8 Cb 0.12 -2.14 0.09 0.00 -0.30 0.00 0.00 42.92 40.69 1z4h s ASP 8 CO 0.33 -0.66 1.13 -0.55 -0.17 0.00 0.00 175.17 175.25 1z4h s SER 9 N 2.66 -0.10 -0.33 -0.34 0.15 -1.18 -4.98 113.70 109.58 1z4h s SER 9 Ca 0.04 -0.30 -0.10 0.00 0.70 0.00 0.00 55.95 56.29 1z4h s SER 9 Cb -0.25 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 1z4h s SER 9 CO 0.05 -0.61 0.18 -1.48 1.20 0.00 0.00 173.24 172.57 1z4h s LEU 10 N -3.02 4.35 0.34 3.45 2.34 -1.26 -1.85 118.68 123.03 1z4h s LEU 10 Ca 0.14 -0.66 0.07 0.00 0.06 0.00 0.00 54.13 53.74 1z4h s LEU 10 Cb 0.01 -2.02 -0.02 0.00 -0.56 0.00 0.00 46.19 43.60 1z4h s LEU 10 CO -0.00 -0.26 0.40 0.68 -1.06 0.00 0.00 176.35 176.11 1z4h s VAL 11 N 1.61 3.71 0.31 1.48 -7.23 0.22 -4.93 120.40 115.57 1z4h s VAL 11 Ca 0.04 -1.17 0.09 0.00 -1.81 0.00 0.00 61.98 59.14 1z4h s VAL 11 Cb -0.18 -3.27 -0.05 0.00 0.56 0.00 0.00 36.38 33.44 1z4h s VAL 11 CO 0.07 -0.15 0.01 -1.81 -0.31 0.00 0.00 175.10 172.91 1z4h s ASP 12 N -4.11 4.33 0.26 4.85 1.11 -1.26 -1.88 116.67 119.97 1z4h s ASP 12 Ca 0.44 -0.84 -0.05 0.00 0.18 0.00 0.00 52.55 52.29 1z4h s ASP 12 Cb -0.08 -0.65 0.32 0.00 1.07 0.00 0.00 42.92 43.58 1z4h s ASP 12 CO 0.29 -0.13 1.92 -0.07 1.18 0.00 0.00 175.17 178.36 1z4h h LEU 13 N 1.84 1.10 -0.34 1.23 4.07 -1.97 0.63 115.31 121.87 1z4h h LEU 13 Ca -0.43 -0.02 0.03 0.00 0.08 0.00 0.00 57.88 57.54 1z4h h LEU 13 Cb 1.25 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 42.70 1z4h h LEU 13 CO 0.63 0.78 0.17 0.50 -1.08 0.00 0.00 178.44 179.43 1z4h h LYS 14 N 1.29 0.34 -0.32 1.13 3.11 -2.00 -1.77 116.57 118.35 1z4h h LYS 14 Ca 0.38 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 58.19 1z4h h LYS 14 Cb -0.07 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.07 1z4h h LYS 14 CO -0.10 0.22 0.18 0.35 -2.81 0.00 0.00 179.45 177.29 1z4h h PHE 15 N 0.35 0.44 -0.96 1.91 3.57 -1.71 -2.32 116.94 118.21 1z4h h PHE 15 Ca 0.15 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.84 1z4h h PHE 15 Cb 0.06 -0.14 -0.11 0.00 2.79 0.00 0.00 35.95 38.55 1z4h h PHE 15 CO -0.10 0.34 0.54 0.82 -2.23 0.00 0.00 178.31 177.68 1z4h h ILE 16 N 0.41 0.63 -1.00 1.41 2.04 -0.37 0.58 117.51 121.21 1z4h h ILE 16 Ca 0.11 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.82 1z4h h ILE 16 Cb 0.04 -0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 35.99 1z4h h ILE 16 CO -0.02 0.12 0.65 0.24 0.00 0.00 0.00 178.15 179.13 1z4h h MET 17 N 0.64 1.14 -0.17 2.37 2.86 -0.76 0.45 114.93 121.46 1z4h h MET 17 Ca 0.57 -0.07 -0.14 0.00 -2.06 0.00 0.00 59.70 58.01 1z4h h MET 17 Cb 0.97 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 32.38 1z4h h MET 17 CO -0.43 0.75 -0.43 0.00 1.06 0.00 0.00 176.91 177.87 1z4h h ALA 18 N 1.46 0.28 0.00 6.32 0.00 -0.89 0.42 119.26 126.85 1z4h h ALA 18 Ca 0.43 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1z4h h ALA 18 Cb 0.15 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1z4h h ALA 18 CO -0.17 0.40 -0.17 0.22 0.00 0.00 0.00 179.25 179.54 1z4h h ASP 19 N 0.25 0.00 0.00 0.00 -0.00 -0.12 -3.27 116.42 113.29 1z4h h ASP 19 Ca -0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.03 56.62 1z4h h ASP 19 Cb 1.04 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 40.31 1z4h h ASP 19 CO 0.09 0.17 -2.30 0.35 -0.00 0.00 0.00 179.24 177.56 1z4h n THR 20 N -3.55 1.53 -0.23 2.25 -2.24 0.15 -5.00 114.28 107.18 1z4h n THR 20 Ca -0.01 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1z4h n THR 20 Cb 0.32 -1.94 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 1z4h n THR 20 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1z4h n GLY 21 N 1.29 0.70 2.07 3.38 0.00 0.15 -5.06 105.19 107.72 1z4h n GLY 21 Ca -0.49 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.36 1z4h n GLY 21 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1z4h n PHE 22 N -2.07 0.27 -2.90 1.61 3.01 -1.23 -5.03 117.46 111.12 1z4h n PHE 22 Ca 0.00 -1.56 -0.20 0.00 1.01 0.00 0.00 57.45 56.70 1z4h n PHE 22 Cb 0.00 -0.06 0.06 0.00 -0.01 0.00 0.00 39.48 39.47 1z4h n PHE 22 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1z4h s GLY 23 N -2.56 1.78 0.23 1.37 0.00 -1.26 -4.58 107.32 102.30 1z4h s GLY 23 Ca 0.09 -1.92 -0.11 0.00 0.00 0.00 0.00 44.72 42.78 1z4h s GLY 23 CO 0.06 -1.49 1.61 0.50 0.00 0.00 0.00 173.10 173.78 1z4h h LYS 24 N 0.08 0.01 -0.59 2.90 1.57 -1.99 -1.92 116.57 116.63 1z4h h LYS 24 Ca -0.34 -0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.54 1z4h h LYS 24 Cb 1.28 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.51 1z4h h LYS 24 CO 0.42 0.01 0.18 0.00 -0.57 0.00 0.00 179.45 179.49 1z4h h THR 25 N 0.01 0.73 -0.45 -0.16 1.03 -2.00 0.48 112.91 112.56 1z4h h THR 25 Ca 0.37 -0.12 -0.03 0.00 -0.01 0.00 0.00 66.41 66.62 1z4h h THR 25 Cb 0.58 0.36 -0.02 0.00 -1.07 0.00 0.00 68.15 68.00 1z4h h THR 25 CO -0.76 0.06 0.16 0.15 -0.01 0.00 0.00 175.52 175.13 1z4h h PHE 26 N 0.34 0.70 0.57 0.00 3.04 -1.75 -2.61 116.94 117.22 1z4h h PHE 26 Ca 0.30 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 62.17 1z4h h PHE 26 Cb 0.40 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.70 1z4h h PHE 26 CO -0.20 0.61 -0.40 0.82 -2.02 0.00 0.00 178.31 177.12 1z4h h ILE 27 N 0.58 0.00 -0.82 1.41 2.04 -0.63 0.47 117.51 120.56 1z4h h ILE 27 Ca 0.15 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.06 1z4h h ILE 27 Cb 0.22 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.24 1z4h h ILE 27 CO -0.01 0.00 0.51 1.88 0.00 0.00 0.00 178.15 180.53 1z4h h TYR 28 N -0.92 0.94 0.19 1.37 -1.99 -1.04 0.31 116.97 115.83 1z4h h TYR 28 Ca -0.07 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.67 1z4h h TYR 28 Cb 0.75 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 39.18 1z4h h TYR 28 CO -0.11 0.49 -0.09 0.22 -0.00 0.00 0.00 178.16 178.67 1z4h h ASP 29 N 0.95 -0.21 -0.67 3.88 1.82 -1.36 -2.35 116.42 118.47 1z4h h ASP 29 Ca 0.35 -0.26 -0.07 0.00 -0.39 0.00 0.00 57.03 56.66 1z4h h ASP 29 Cb 0.13 0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.17 1z4h h ASP 29 CO -0.16 0.17 0.13 -0.09 -1.61 0.00 0.00 179.24 177.68 1z4h h ARG 30 N -0.63 1.11 -0.11 0.28 9.65 0.42 0.76 114.38 125.86 1z4h h ARG 30 Ca -0.03 -0.28 -0.23 0.00 -1.10 0.00 0.00 59.98 58.34 1z4h h ARG 30 Cb 0.46 -0.14 0.01 0.00 -1.39 0.00 0.00 29.97 28.91 1z4h h ARG 30 CO 0.04 1.00 -0.84 0.82 2.80 0.00 0.00 179.97 183.79 1z4h h ILE 31 N 1.04 1.29 -0.87 1.20 5.03 -0.49 0.22 117.51 124.93 1z4h h ILE 31 Ca 0.21 -2.06 0.02 0.00 -0.12 0.00 0.00 64.86 62.91 1z4h h ILE 31 Cb 0.41 2.09 -0.05 0.00 -3.03 0.00 0.00 36.82 36.24 1z4h h ILE 31 CO 0.01 0.65 0.58 0.11 -0.68 0.00 0.00 178.15 178.81 1z4h h LYS 32 N 0.48 1.12 0.00 2.37 1.57 -1.28 -0.35 116.57 120.48 1z4h h LYS 32 Ca -0.07 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1z4h h LYS 32 Cb 1.46 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1z4h h LYS 32 CO 0.17 0.74 -0.03 1.03 -0.57 0.00 0.00 179.45 180.79 1z4h h SER 33 N 1.15 0.00 0.24 0.86 0.87 -0.38 -2.38 113.55 113.91 1z4h h SER 33 Ca 0.33 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.88 1z4h h SER 33 Cb -0.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1z4h h SER 33 CO -0.08 0.03 -0.11 1.23 -0.53 0.00 0.00 176.83 177.36 1z4h h GLY 34 N 1.80 -0.34 -1.55 5.77 0.00 0.12 -3.45 103.07 105.43 1z4h h GLY 34 Ca -0.00 0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.38 1z4h h GLY 34 CO 0.00 -0.12 -0.17 1.34 0.00 0.00 0.00 176.54 177.59 1z4h n ASP 35 N -3.41 -0.60 -2.40 0.19 -0.08 -1.12 -4.77 116.55 104.36 1z4h n ASP 35 Ca -0.04 -1.42 -0.02 0.00 -1.51 0.00 0.00 54.79 51.80 1z4h n ASP 35 Cb 0.13 0.18 -0.02 0.00 2.34 0.00 0.00 41.12 43.75 1z4h n ASP 35 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1z4h n LEU 36 N 0.00 -6.42 -4.64 -2.67 4.77 -0.90 -4.85 117.00 102.29 1z4h n LEU 36 Ca -0.17 2.65 -0.47 0.00 -0.03 0.00 0.00 56.01 57.99 1z4h n LEU 36 Cb 0.56 -3.23 -0.04 0.00 -2.33 0.00 0.00 43.42 38.38 1z4h n LEU 36 CO -0.08 -3.24 1.03 -0.81 -1.33 0.00 0.00 177.39 172.96 1z4h n PRO 37 N 1.77 1.79 0.00 3.23 -0.04 -1.26 -4.86 135.00 135.62 1z4h n PRO 37 Ca -0.13 0.64 0.13 0.00 -0.04 0.00 0.00 63.50 64.10 1z4h n PRO 37 Cb 0.21 -2.33 0.42 0.00 -0.04 0.00 0.00 33.50 31.76 1z4h n PRO 37 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1z4h n LYS 38 N 2.72 0.75 -1.02 0.54 4.01 -1.26 -4.93 118.16 118.97 1z4h n LYS 38 Ca 0.16 -0.41 -0.36 0.00 -0.51 0.00 0.00 58.31 57.19 1z4h n LYS 38 Cb 0.27 -1.49 0.05 0.00 -0.51 0.00 0.00 35.03 33.35 1z4h n LYS 38 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1z4h n ALA 39 N -0.77 -4.30 -3.40 7.82 0.00 -1.26 -4.85 120.51 113.76 1z4h n ALA 39 Ca 0.12 -0.55 -0.44 0.00 0.00 0.00 0.00 53.44 52.58 1z4h n ALA 39 Cb 0.33 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 1z4h n ALA 39 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1z4h s LYS 40 N -2.24 3.90 -0.10 0.00 3.01 0.33 -4.90 119.74 119.73 1z4h s LYS 40 Ca 0.48 -3.09 0.03 0.00 -1.01 0.00 0.00 55.97 52.38 1z4h s LYS 40 Cb -0.24 -4.41 -0.01 0.00 -1.01 0.00 0.00 37.83 32.16 1z4h s LYS 40 CO 0.76 -1.25 -0.21 0.54 0.51 0.00 0.00 175.35 175.70 1z4h s VAL 41 N -1.01 2.37 0.00 3.17 0.11 -1.26 -2.82 120.40 120.96 1z4h s VAL 41 Ca 0.28 -0.92 0.00 0.00 -2.93 0.00 0.00 61.98 58.41 1z4h s VAL 41 Cb -0.10 -1.93 0.00 0.00 -1.53 0.00 0.00 36.38 32.82 1z4h s VAL 41 CO -0.09 0.55 0.00 0.00 -3.33 0.00 0.00 175.10 172.24 1z4h n ILE 42 N 3.37 0.00 -0.82 7.04 0.13 -1.26 -4.80 119.36 123.02 1z4h n ILE 42 Ca -0.18 0.00 -0.06 0.00 -1.10 0.00 0.00 62.75 61.41 1z4h n ILE 42 Cb 0.53 -0.29 0.28 0.00 -0.84 0.00 0.00 39.64 39.32 1z4h n ILE 42 CO 0.00 0.00 0.00 1.41 2.80 0.00 0.00 176.55 180.76 1z4h n HIS 43 N -1.23 2.25 0.00 9.51 8.25 -1.26 -4.85 115.22 127.89 1z4h n HIS 43 Ca 0.00 -1.10 0.00 0.00 -0.26 0.00 0.00 57.72 56.36 1z4h n HIS 43 Cb 0.17 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 30.63 1z4h n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1z4h n GLY 44 N -0.10 2.76 3.05 -1.41 0.00 -1.26 -4.90 105.19 103.32 1z4h n GLY 44 Ca 0.37 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.27 1z4h n GLY 44 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1z4h s ARG 45 N -0.05 0.22 0.00 1.61 1.70 -1.26 -5.05 118.95 116.11 1z4h s ARG 45 Ca 0.00 0.16 0.00 0.00 -0.47 0.00 0.00 55.73 55.42 1z4h s ARG 45 Cb 0.00 0.10 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 1z4h s ARG 45 CO 0.00 -0.03 0.00 0.00 -1.08 0.00 0.00 175.30 174.19 1z4h n ALA 46 N 2.83 0.00 -3.74 7.88 0.00 -1.26 -4.55 120.51 121.67 1z4h n ALA 46 Ca -0.14 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 1z4h n ALA 46 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.86 1z4h n ALA 46 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1z4h s ARG 47 N 0.50 0.70 -0.02 0.00 0.52 -1.13 -4.85 118.95 114.67 1z4h s ARG 47 Ca 0.00 0.04 -0.01 0.00 -0.52 0.00 0.00 55.73 55.24 1z4h s ARG 47 Cb 0.00 -0.95 -0.04 0.00 0.52 0.00 0.00 34.95 34.48 1z4h s ARG 47 CO 0.00 -0.24 0.07 -0.46 0.02 0.00 0.00 175.30 174.68 1z4h s TRP 48 N 1.66 3.27 0.08 -0.53 -0.11 -0.79 -0.52 118.94 122.00 1z4h s TRP 48 Ca 0.00 0.21 -0.21 0.00 1.22 0.00 0.00 56.10 57.33 1z4h s TRP 48 Cb -0.13 -1.75 -0.07 0.00 -1.50 0.00 0.00 33.47 30.02 1z4h s TRP 48 CO -0.04 0.54 0.61 -0.51 -4.62 0.00 0.00 176.95 172.94 1z4h s LEU 49 N -1.54 4.53 0.38 5.86 1.43 -1.26 0.70 118.68 128.77 1z4h s LEU 49 Ca 0.21 1.32 0.09 0.00 -1.03 0.00 0.00 54.13 54.72 1z4h s LEU 49 Cb -0.12 -2.98 0.77 0.00 0.03 0.00 0.00 46.19 43.89 1z4h s LEU 49 CO 0.11 0.24 1.92 0.22 0.23 0.00 0.00 176.35 179.07 1z4h h TYR 50 N 4.66 0.30 -0.98 0.29 3.20 -1.44 -2.31 116.97 120.69 1z4h h TYR 50 Ca -0.48 -0.03 0.21 0.00 3.14 0.00 0.00 58.73 61.56 1z4h h TYR 50 Cb 1.21 -0.09 -0.11 0.00 1.54 0.00 0.00 36.73 39.28 1z4h h TYR 50 CO 0.67 0.38 0.57 0.07 -1.64 0.00 0.00 178.16 178.21 1z4h h ARG 51 N 0.28 0.64 -0.33 1.82 0.11 -0.10 0.29 114.38 117.09 1z4h h ARG 51 Ca 0.06 -0.04 -0.04 0.00 0.10 0.00 0.00 59.98 60.06 1z4h h ARG 51 Cb 0.34 -0.14 -0.02 0.00 1.11 0.00 0.00 29.97 31.26 1z4h h ARG 51 CO 0.02 0.42 0.03 -0.44 0.10 0.00 0.00 179.97 180.09 1z4h h ASP 52 N 0.66 0.46 -0.24 0.08 3.45 -1.70 -0.54 116.42 118.58 1z4h h ASP 52 Ca 0.59 -0.08 -0.19 0.00 0.43 0.00 0.00 57.03 57.78 1z4h h ASP 52 Cb 0.99 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.65 1z4h h ASP 52 CO -0.43 0.51 -0.60 0.45 -1.57 0.00 0.00 179.24 177.60 1z4h h HIS 53 N 0.48 1.09 -0.67 4.55 3.86 -0.81 -2.51 115.15 121.13 1z4h h HIS 53 Ca 0.11 -0.41 0.09 0.00 -1.16 0.00 0.00 60.37 59.00 1z4h h HIS 53 Cb 0.27 -0.20 -0.07 0.00 1.06 0.00 0.00 27.41 28.48 1z4h h HIS 53 CO 0.01 1.24 0.32 0.00 0.86 0.00 0.00 177.93 180.36 1z4h h GLU 55 N 0.55 0.08 -0.10 0.00 4.39 -1.13 -0.44 114.58 117.94 1z4h h GLU 55 Ca 0.33 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 60.00 1z4h h GLU 55 Cb 0.35 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1z4h h GLU 55 CO -0.27 0.39 0.03 0.27 -1.16 0.00 0.00 179.01 178.28 1z4h h PHE 56 N -0.25 0.16 -0.24 4.33 -5.15 -0.97 -2.11 116.94 112.72 1z4h h PHE 56 Ca 0.01 -0.01 0.04 0.00 -0.20 0.00 0.00 57.97 57.81 1z4h h PHE 56 Cb 0.36 -0.05 -0.01 0.00 0.22 0.00 0.00 35.95 36.47 1z4h h PHE 56 CO 0.04 0.28 0.16 0.87 -2.00 0.00 0.00 178.31 177.67 1z4h h LYS 57 N -0.02 0.14 0.82 6.09 1.79 -0.15 -2.11 116.57 123.13 1z4h h LYS 57 Ca 0.03 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.45 1z4h h LYS 57 Cb 0.20 -0.03 0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1z4h h LYS 57 CO -0.00 0.09 -0.39 -0.97 -1.08 0.00 0.00 179.45 177.10 1z4h h ASN 58 N 0.14 -0.93 1.79 0.86 -1.24 -0.40 0.73 115.58 116.53 1z4h h ASN 58 Ca 0.10 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1z4h h ASN 58 Cb 0.23 0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.52 1z4h h ASN 58 CO -0.01 -0.63 0.00 0.07 -1.29 0.00 0.00 177.43 175.57 1z4h h LYS 59 N -1.16 0.00 0.00 6.67 -0.00 -1.34 -2.33 116.57 118.41 1z4h h LYS 59 Ca -0.11 0.00 -0.11 0.00 -0.00 0.00 0.00 60.65 60.43 1z4h h LYS 59 Cb 0.85 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.06 1z4h h LYS 59 CO 0.18 0.00 -0.53 -0.07 -0.00 0.00 0.00 179.45 179.04 1z4h h LEU 60 N 0.00 0.00 -0.78 7.07 3.38 -1.33 -1.90 115.31 121.75 1z4h h LEU 60 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1z4h h LEU 60 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1z4h h LEU 60 CO 0.00 0.53 -0.51 0.25 0.09 0.00 0.00 178.44 178.80 1z4h h LEU 61 N 0.00 0.28 -0.05 1.67 5.85 -0.31 -2.43 115.31 120.32 1z4h h LEU 61 Ca -0.01 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1z4h h LEU 61 Cb 1.30 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1z4h h LEU 61 CO 0.07 0.74 -0.21 -0.24 -0.34 0.00 0.00 178.44 178.46 1z4h n SER 62 N -3.95 0.28 -4.31 1.25 2.88 -1.03 -4.93 113.62 103.81 1z4h n SER 62 Ca -0.02 0.01 -0.38 0.00 -1.33 0.00 0.00 58.87 57.15 1z4h n SER 62 Cb 0.55 -0.13 -0.04 0.00 -0.75 0.00 0.00 64.21 63.83 1z4h n SER 62 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1z4h n ARG 63 N -1.40 -2.36 -3.05 -1.46 1.74 -0.73 -4.89 116.66 104.51 1z4h n ARG 63 Ca 0.08 0.29 -0.24 0.00 -0.77 0.00 0.00 57.85 57.21 1z4h n ARG 63 Cb 0.33 -4.91 -0.04 0.00 -1.02 0.00 0.00 32.46 26.82 1z4h n ARG 63 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1z4h n ALA 64 N -4.30 3.72 -2.21 7.54 0.00 -1.09 -4.73 120.51 119.44 1z4h n ALA 64 Ca 0.06 -4.25 -0.01 0.00 0.00 0.00 0.00 53.44 49.24 1z4h n ALA 64 Cb 0.50 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 19.12 1z4h n ALA 64 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1z4h n ASN 65 N 0.00 0.05 0.00 0.00 2.04 -1.26 -5.00 115.26 111.08 1z4h n ASN 65 Ca 0.29 -1.90 0.00 0.00 -0.44 0.00 0.00 54.58 52.53 1z4h n ASN 65 Cb 0.48 -0.04 0.00 0.00 -2.53 0.00 0.00 39.78 37.70 1z4h n ASN 65 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43