#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 0.40 -0.23 3.17 0.74 -1.26 -5.14 119.66 117.34 1z4h s GLN 2 Ca 0.00 0.58 0.00 0.00 0.05 0.00 0.00 55.36 55.99 1z4h s GLN 2 Cb 0.00 0.12 0.06 0.00 1.10 0.00 0.00 33.01 34.30 1z4h s GLN 2 CO 0.00 -0.09 -0.04 -1.58 -0.55 0.00 0.00 175.29 173.04 1z4h s HIS 3 N 0.57 2.23 -0.28 1.67 5.65 -1.26 -5.09 115.29 118.78 1z4h s HIS 3 Ca -0.03 -1.66 -0.10 0.00 0.25 0.00 0.00 55.06 53.53 1z4h s HIS 3 Cb -0.05 -1.53 -0.03 0.00 -1.18 0.00 0.00 32.58 29.79 1z4h s HIS 3 CO -0.03 -0.76 0.14 -1.21 -0.65 0.00 0.00 174.74 172.23 1z4h s GLU 4 N 1.45 3.69 0.21 2.88 0.41 -1.26 -5.07 118.70 121.01 1z4h s GLU 4 Ca -0.05 -0.48 0.03 0.00 -0.41 0.00 0.00 54.97 54.06 1z4h s GLU 4 Cb -0.19 -3.53 -0.05 0.00 -1.78 0.00 0.00 34.13 28.58 1z4h s GLU 4 CO -0.07 -0.25 -0.00 -0.48 -0.49 0.00 0.00 175.26 173.97 1z4h s LEU 5 N 1.68 2.17 0.36 1.80 2.34 -1.26 -5.16 118.68 120.60 1z4h s LEU 5 Ca 0.06 -1.20 0.07 0.00 0.06 0.00 0.00 54.13 53.13 1z4h s LEU 5 Cb -0.16 -0.20 -0.02 0.00 -0.56 0.00 0.00 46.19 45.25 1z4h s LEU 5 CO 0.07 -0.53 0.37 0.00 -1.06 0.00 0.00 176.35 175.21 1z4h s GLN 6 N -3.88 2.78 0.30 1.48 -2.07 -1.26 -4.99 119.66 112.02 1z4h s GLN 6 Ca 0.27 -1.28 0.20 0.00 -1.82 0.00 0.00 55.36 52.73 1z4h s GLN 6 Cb 0.06 -2.55 1.06 0.00 -1.09 0.00 0.00 33.01 30.48 1z4h s GLN 6 CO 0.07 -0.01 1.15 -2.30 -1.32 0.00 0.00 175.29 172.89 1z4h n PRO 7 N -1.51 -0.03 -3.45 9.60 -0.02 -1.26 -3.43 135.00 134.90 1z4h n PRO 7 Ca 0.01 0.96 -0.43 0.00 -2.02 0.00 0.00 63.50 62.01 1z4h n PRO 7 Cb 0.60 -1.82 -0.08 0.00 -0.02 0.00 0.00 33.50 32.18 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 -4.47 5.97 0.00 2.55 2.15 -1.26 0.74 116.67 122.35 1z4h s ASP 8 Ca -0.06 -1.55 0.00 0.00 0.43 0.00 0.00 52.55 51.37 1z4h s ASP 8 Cb 0.24 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.74 1z4h s ASP 8 CO 0.59 -0.67 0.00 -0.24 -0.17 0.00 0.00 175.17 174.68 1z4h n SER 9 N 5.10 0.00 -4.44 -0.34 2.88 -1.22 -4.99 113.62 110.61 1z4h n SER 9 Ca -0.12 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.04 1z4h n SER 9 Cb 0.42 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.77 1z4h n SER 9 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1z4h s LEU 10 N 0.00 4.08 0.34 2.46 2.34 -1.26 -2.87 118.68 123.76 1z4h s LEU 10 Ca 0.00 -0.51 0.07 0.00 0.06 0.00 0.00 54.13 53.75 1z4h s LEU 10 Cb 0.00 -2.00 -0.02 0.00 -0.56 0.00 0.00 46.19 43.61 1z4h s LEU 10 CO 0.00 -0.19 0.32 0.68 -1.06 0.00 0.00 176.35 176.11 1z4h s VAL 11 N 1.61 3.64 0.33 1.48 -7.23 0.16 -4.93 120.40 115.46 1z4h s VAL 11 Ca 0.05 -1.30 0.09 0.00 -1.81 0.00 0.00 61.98 59.00 1z4h s VAL 11 Cb -0.17 -3.23 -0.05 0.00 0.56 0.00 0.00 36.38 33.49 1z4h s VAL 11 CO 0.06 -0.17 0.01 -0.62 -0.31 0.00 0.00 175.10 174.07 1z4h s ASP 12 N -4.03 4.23 0.13 4.85 -1.08 -1.26 -0.92 116.67 118.59 1z4h s ASP 12 Ca 0.42 -0.94 -0.20 0.00 -0.52 0.00 0.00 52.55 51.30 1z4h s ASP 12 Cb -0.06 -0.57 -0.03 0.00 -1.46 0.00 0.00 42.92 40.79 1z4h s ASP 12 CO 0.27 -0.20 1.70 -0.07 0.52 0.00 0.00 175.17 177.39 1z4h h LEU 13 N 1.82 -0.20 -1.33 -1.34 -0.00 -1.98 0.33 115.31 112.61 1z4h h LEU 13 Ca -0.43 0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.48 1z4h h LEU 13 Cb 1.25 0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 42.02 1z4h h LEU 13 CO 0.65 -0.07 0.11 0.50 -0.00 0.00 0.00 178.44 179.63 1z4h h LYS 14 N -0.02 0.56 -0.50 1.13 3.64 -1.99 -1.63 116.57 117.77 1z4h h LYS 14 Ca 0.09 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1z4h h LYS 14 Cb 0.15 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1z4h h LYS 14 CO -0.20 0.51 0.16 0.35 -2.27 0.00 0.00 179.45 178.00 1z4h h PHE 15 N 0.55 0.79 -0.92 1.91 3.57 -1.60 -1.72 116.94 119.53 1z4h h PHE 15 Ca 0.13 -0.08 0.13 0.00 3.53 0.00 0.00 57.97 61.68 1z4h h PHE 15 Cb 0.19 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 38.63 1z4h h PHE 15 CO 0.01 0.69 0.59 0.82 -2.23 0.00 0.00 178.31 178.19 1z4h h ILE 16 N 0.67 0.88 -0.68 1.41 2.04 0.53 0.63 117.51 122.99 1z4h h ILE 16 Ca 0.16 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.69 1z4h h ILE 16 Cb 0.26 -0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 1z4h h ILE 16 CO -0.01 0.15 0.21 0.24 0.00 0.00 0.00 178.15 178.74 1z4h h MET 17 N 0.81 1.05 0.00 2.37 2.86 -0.86 -1.70 114.93 119.45 1z4h h MET 17 Ca 0.46 -0.22 -0.09 0.00 -2.06 0.00 0.00 59.70 57.79 1z4h h MET 17 Cb 0.61 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1z4h h MET 17 CO -0.22 0.90 -0.44 0.00 1.06 0.00 0.00 176.91 178.20 1z4h h ALA 18 N 1.21 1.13 -0.81 6.32 0.00 -0.11 -0.05 119.26 126.94 1z4h h ALA 18 Ca 0.22 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1z4h h ALA 18 Cb 0.29 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1z4h h ALA 18 CO -0.01 0.56 0.36 0.22 0.00 0.00 0.00 179.25 180.38 1z4h h ASP 19 N 0.00 1.09 0.00 0.00 3.58 0.10 -3.42 116.42 117.77 1z4h h ASP 19 Ca -0.00 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.30 1z4h h ASP 19 Cb 0.86 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.63 1z4h h ASP 19 CO 0.06 0.94 0.00 0.35 -2.88 0.00 0.00 179.24 177.71 1z4h n THR 20 N -4.29 0.00 0.00 2.25 -2.24 -0.83 -5.08 114.28 104.09 1z4h n THR 20 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1z4h n THR 20 Cb 0.16 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 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 2.84 0.00 3.76 3.38 0.00 -0.04 -5.03 105.19 110.10 1z4h n GLY 21 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1z4h n GLY 21 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z4h s PHE 22 N 0.00 1.93 0.35 1.61 0.40 -1.26 -5.06 117.98 115.95 1z4h s PHE 22 Ca 0.00 -0.90 0.05 0.00 -0.60 0.00 0.00 56.93 55.48 1z4h s PHE 22 Cb 0.00 -1.68 -0.01 0.00 0.51 0.00 0.00 43.02 41.84 1z4h s PHE 22 CO 0.00 0.17 0.50 0.20 0.70 0.00 0.00 175.22 176.79 1z4h s GLY 23 N -3.91 1.56 0.32 4.36 0.00 -1.26 -4.46 107.32 103.93 1z4h s GLY 23 Ca 0.13 -1.36 0.09 0.00 0.00 0.00 0.00 44.72 43.58 1z4h s GLY 23 CO 0.07 -1.27 1.62 0.07 0.00 0.00 0.00 173.10 173.59 1z4h h LYS 24 N 0.81 0.14 -0.51 2.90 2.10 -1.99 -0.68 116.57 119.34 1z4h h LYS 24 Ca -0.46 -0.01 0.04 0.00 -2.00 0.00 0.00 60.65 58.22 1z4h h LYS 24 Cb 1.25 -0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 32.51 1z4h h LYS 24 CO 0.54 0.09 0.28 0.00 -2.00 0.00 0.00 179.45 178.36 1z4h h THR 25 N 0.14 0.99 -0.51 0.07 1.03 -2.00 -0.80 112.91 111.84 1z4h h THR 25 Ca 0.67 -0.19 -0.01 0.00 -0.01 0.00 0.00 66.41 66.88 1z4h h THR 25 Cb 1.54 0.40 -0.02 0.00 -1.07 0.00 0.00 68.15 68.99 1z4h h THR 25 CO -0.73 0.10 0.28 0.15 -0.01 0.00 0.00 175.52 175.31 1z4h h PHE 26 N 0.54 0.70 0.41 0.00 3.04 -1.53 -2.76 116.94 117.34 1z4h h PHE 26 Ca 0.22 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.14 1z4h h PHE 26 Cb 0.09 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.37 1z4h h PHE 26 CO -0.09 0.52 -0.35 0.82 -2.02 0.00 0.00 178.31 177.20 1z4h h ILE 27 N 0.68 0.00 -0.73 1.41 2.04 -0.78 0.28 117.51 120.40 1z4h h ILE 27 Ca 0.18 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.10 1z4h h ILE 27 Cb 0.06 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.08 1z4h h ILE 27 CO -0.03 0.00 0.43 1.88 0.00 0.00 0.00 178.15 180.43 1z4h h TYR 28 N -0.74 0.79 0.04 1.37 -1.99 -1.24 0.26 116.97 115.46 1z4h h TYR 28 Ca -0.05 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.70 1z4h h TYR 28 Cb 0.62 -0.25 0.00 0.00 2.00 0.00 0.00 36.73 39.10 1z4h h TYR 28 CO -0.15 0.39 -0.02 0.22 -0.00 0.00 0.00 178.16 178.60 1z4h h ASP 29 N 0.79 -0.04 -0.35 3.88 -0.00 -1.37 -2.43 116.42 116.90 1z4h h ASP 29 Ca 0.32 -0.26 -0.05 0.00 -0.00 0.00 0.00 57.03 57.04 1z4h h ASP 29 Cb 0.17 0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 39.50 1z4h h ASP 29 CO -0.17 0.23 0.01 -0.09 -0.00 0.00 0.00 179.24 179.22 1z4h h ARG 30 N -0.32 0.60 -0.26 0.28 9.65 0.14 -2.32 114.38 122.16 1z4h h ARG 30 Ca -0.01 -0.19 -0.17 0.00 -1.10 0.00 0.00 59.98 58.52 1z4h h ARG 30 Cb 0.29 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.81 1z4h h ARG 30 CO 0.01 0.71 -0.53 0.82 2.80 0.00 0.00 179.97 183.78 1z4h h ILE 31 N 0.42 1.29 -0.65 1.20 5.03 -0.57 -0.92 117.51 123.31 1z4h h ILE 31 Ca 0.10 -1.74 0.04 0.00 -0.12 0.00 0.00 64.86 63.14 1z4h h ILE 31 Cb 0.43 1.66 -0.05 0.00 -3.03 0.00 0.00 36.82 35.83 1z4h h ILE 31 CO 0.02 0.56 0.39 0.11 -0.68 0.00 0.00 178.15 178.55 1z4h h LYS 32 N 0.58 0.74 0.00 2.37 1.57 -1.42 -1.00 116.57 119.41 1z4h h LYS 32 Ca 0.02 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1z4h h LYS 32 Cb 1.11 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 1z4h h LYS 32 CO 0.11 0.49 -0.10 1.03 -0.57 0.00 0.00 179.45 180.41 1z4h h SER 33 N 0.76 0.00 0.00 0.86 0.87 -1.04 -3.23 113.55 111.77 1z4h h SER 33 Ca 0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1z4h h SER 33 Cb 0.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1z4h h SER 33 CO -0.13 0.10 0.00 0.61 -0.53 0.00 0.00 176.83 176.89 1z4h n GLY 34 N -1.11 -2.72 2.68 5.77 0.00 -0.38 -4.87 105.19 104.56 1z4h n GLY 34 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 1z4h n GLY 34 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1z4h n ASP 35 N -1.18 -1.63 -2.96 1.61 4.64 -1.17 -4.89 116.55 110.97 1z4h n ASP 35 Ca 0.00 -2.01 -0.00 0.00 -1.38 0.00 0.00 54.79 51.40 1z4h n ASP 35 Cb 0.00 0.93 -0.00 0.00 -1.04 0.00 0.00 41.12 41.00 1z4h n ASP 35 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1z4h n LEU 36 N 1.64 -5.66 -4.72 -2.67 4.77 -1.22 -4.70 117.00 104.44 1z4h n LEU 36 Ca 0.04 0.94 -0.61 0.00 -0.03 0.00 0.00 56.01 56.35 1z4h n LEU 36 Cb 0.69 -2.41 -0.08 0.00 -2.33 0.00 0.00 43.42 39.28 1z4h n LEU 36 CO -0.10 -2.35 1.25 -2.65 -1.33 0.00 0.00 177.39 172.21 1z4h n PRO 37 N 1.09 0.78 0.00 3.23 -0.02 -1.26 -4.82 135.00 134.00 1z4h n PRO 37 Ca -0.01 0.28 0.14 0.00 -2.02 0.00 0.00 63.50 61.89 1z4h n PRO 37 Cb 0.27 -1.91 0.63 0.00 -0.02 0.00 0.00 33.50 32.47 1z4h n PRO 37 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1z4h n LYS 38 N 4.84 0.42 -1.18 -0.52 4.01 -1.26 -4.87 118.16 119.60 1z4h n LYS 38 Ca 0.28 -0.10 -0.37 0.00 -0.51 0.00 0.00 58.31 57.61 1z4h n LYS 38 Cb 0.07 -1.50 0.05 0.00 -0.51 0.00 0.00 35.03 33.14 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 -1.21 -2.94 -3.53 7.82 0.00 -1.26 -4.82 120.51 114.57 1z4h n ALA 39 Ca 0.12 -0.30 -0.40 0.00 0.00 0.00 0.00 53.44 52.86 1z4h n ALA 39 Cb 0.28 -1.55 -0.05 0.00 0.00 0.00 0.00 19.45 18.13 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 -2.09 3.40 -0.66 0.00 3.01 -0.74 -4.92 119.74 117.74 1z4h s LYS 40 Ca 0.57 -2.96 -0.17 0.00 -1.01 0.00 0.00 55.97 52.40 1z4h s LYS 40 Cb -0.35 -4.13 0.14 0.00 -1.01 0.00 0.00 37.83 32.48 1z4h s LYS 40 CO 0.67 -1.25 0.70 0.08 0.51 0.00 0.00 175.35 176.06 1z4h s VAL 41 N -0.78 5.09 -0.06 3.17 1.01 -1.26 -3.62 120.40 123.96 1z4h s VAL 41 Ca 0.24 -1.52 0.16 0.00 0.00 0.00 0.00 61.98 60.87 1z4h s VAL 41 Cb -0.11 -4.47 -0.25 0.00 0.00 0.00 0.00 36.38 31.55 1z4h s VAL 41 CO -0.09 -1.07 0.30 0.00 0.00 0.00 0.00 175.10 174.23 1z4h n ILE 42 N 5.11 0.26 -1.51 2.22 0.13 -1.26 -4.50 119.36 119.81 1z4h n ILE 42 Ca -0.02 -0.46 -0.08 0.00 -1.10 0.00 0.00 62.75 61.09 1z4h n ILE 42 Cb 0.43 -0.06 0.18 0.00 -0.84 0.00 0.00 39.64 39.36 1z4h n ILE 42 CO 0.00 0.00 0.00 1.57 2.80 0.00 0.00 176.55 180.92 1z4h n HIS 43 N -2.21 1.32 0.00 9.51 -0.00 -1.26 -4.91 115.22 117.67 1z4h n HIS 43 Ca -0.09 -1.74 0.00 0.00 0.46 0.00 0.00 57.72 56.36 1z4h n HIS 43 Cb 0.58 -0.53 0.00 0.00 -0.12 0.00 0.00 29.99 29.92 1z4h n HIS 43 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1z4h n GLY 44 N -1.09 1.40 3.06 1.57 0.00 -1.26 -4.73 105.19 104.14 1z4h n GLY 44 Ca 0.36 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.25 1z4h n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z4h s ARG 45 N 0.00 0.20 0.00 1.61 0.52 -1.26 -5.04 118.95 114.97 1z4h s ARG 45 Ca 0.00 0.72 0.00 0.00 -0.52 0.00 0.00 55.73 55.93 1z4h s ARG 45 Cb 0.00 -0.02 0.00 0.00 0.52 0.00 0.00 34.95 35.45 1z4h s ARG 45 CO 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 175.30 175.08 1z4h n ALA 46 N 4.98 0.30 -3.00 2.13 0.00 -1.26 -4.83 120.51 118.82 1z4h n ALA 46 Ca -0.13 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 1z4h n ALA 46 Cb 0.51 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.81 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 0.63 0.33 0.16 0.00 0.52 -1.24 -4.77 118.95 114.58 1z4h s ARG 47 Ca 0.00 -0.09 0.05 0.00 -0.52 0.00 0.00 55.73 55.17 1z4h s ARG 47 Cb 0.00 -0.36 -0.04 0.00 0.52 0.00 0.00 34.95 35.08 1z4h s ARG 47 CO 0.00 0.03 0.10 -0.46 0.02 0.00 0.00 175.30 174.99 1z4h s TRP 48 N 0.16 3.08 0.05 -0.53 -0.11 -0.10 -1.78 118.94 119.71 1z4h s TRP 48 Ca -0.01 -0.04 -0.06 0.00 1.22 0.00 0.00 56.10 57.20 1z4h s TRP 48 Cb -0.04 -1.49 -0.05 0.00 -1.50 0.00 0.00 33.47 30.39 1z4h s TRP 48 CO -0.00 0.52 0.32 -0.51 -4.62 0.00 0.00 176.95 172.65 1z4h s LEU 49 N -2.99 4.34 0.21 5.86 1.02 -1.26 0.41 118.68 126.27 1z4h s LEU 49 Ca 0.30 0.60 -0.06 0.00 0.02 0.00 0.00 54.13 54.99 1z4h s LEU 49 Cb -0.10 -2.89 0.17 0.00 0.02 0.00 0.00 46.19 43.39 1z4h s LEU 49 CO 0.22 0.19 1.66 0.22 0.02 0.00 0.00 176.35 178.66 1z4h h TYR 50 N 3.63 1.00 -0.99 0.29 3.20 -1.45 -2.68 116.97 119.97 1z4h h TYR 50 Ca -0.49 -0.19 0.15 0.00 3.14 0.00 0.00 58.73 61.35 1z4h h TYR 50 Cb 1.19 -0.26 -0.09 0.00 1.54 0.00 0.00 36.73 39.11 1z4h h TYR 50 CO 0.66 0.94 0.62 0.07 -1.64 0.00 0.00 178.16 178.81 1z4h h ARG 51 N 0.82 0.82 -0.56 1.82 0.11 0.04 0.82 114.38 118.25 1z4h h ARG 51 Ca 0.14 -0.05 -0.03 0.00 0.10 0.00 0.00 59.98 60.14 1z4h h ARG 51 Cb 0.60 -0.19 -0.03 0.00 1.11 0.00 0.00 29.97 31.47 1z4h h ARG 51 CO 0.04 0.54 0.22 -0.44 0.10 0.00 0.00 179.97 180.43 1z4h h ASP 52 N 0.85 0.73 -0.50 0.08 3.45 -1.75 -0.91 116.42 118.37 1z4h h ASP 52 Ca 0.53 -0.09 -0.11 0.00 0.43 0.00 0.00 57.03 57.79 1z4h h ASP 52 Cb 0.71 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 39.27 1z4h h ASP 52 CO -0.30 0.66 -0.09 0.45 -1.57 0.00 0.00 179.24 178.39 1z4h h HIS 53 N 0.80 1.08 -0.77 4.55 3.86 -0.94 -2.30 115.15 121.42 1z4h h HIS 53 Ca 0.19 -0.21 0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1z4h h HIS 53 Cb 0.16 -0.27 -0.07 0.00 1.06 0.00 0.00 27.41 28.29 1z4h h HIS 53 CO 0.01 1.00 0.44 0.00 0.86 0.00 0.00 177.93 180.24 1z4h h GLU 55 N 0.77 0.07 -0.20 0.00 4.39 -1.10 -0.68 114.58 117.83 1z4h h GLU 55 Ca 0.36 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 60.01 1z4h h GLU 55 Cb 0.28 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1z4h h GLU 55 CO -0.22 0.37 0.02 0.27 -1.16 0.00 0.00 179.01 178.29 1z4h h PHE 56 N -0.24 0.37 -0.81 4.33 -5.15 -0.87 -1.53 116.94 113.04 1z4h h PHE 56 Ca 0.01 -0.06 0.04 0.00 -0.20 0.00 0.00 57.97 57.76 1z4h h PHE 56 Cb 0.34 -0.10 -0.05 0.00 0.22 0.00 0.00 35.95 36.36 1z4h h PHE 56 CO 0.04 0.51 0.53 0.87 -2.00 0.00 0.00 178.31 178.26 1z4h h LYS 57 N 0.12 0.95 0.27 6.09 1.79 -0.54 -1.93 116.57 123.31 1z4h h LYS 57 Ca 0.06 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1z4h h LYS 57 Cb 0.36 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 1z4h h LYS 57 CO 0.01 0.63 -0.22 -0.97 -1.08 0.00 0.00 179.45 177.82 1z4h h ASN 58 N 0.98 -0.57 0.35 0.86 -1.24 -0.60 0.14 115.58 115.50 1z4h h ASN 58 Ca 0.33 0.05 -0.12 0.00 0.71 0.00 0.00 56.30 57.27 1z4h h ASN 58 Cb 0.08 0.19 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 1z4h h ASN 58 CO -0.10 -0.33 -0.50 0.07 -1.29 0.00 0.00 177.43 175.28 1z4h h LYS 59 N -0.50 0.17 0.00 6.67 2.10 -1.10 -2.56 116.57 121.35 1z4h h LYS 59 Ca -0.01 -0.10 -0.10 0.00 -2.00 0.00 0.00 60.65 58.44 1z4h h LYS 59 Cb 0.44 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.77 1z4h h LYS 59 CO -0.02 0.64 -0.47 -0.07 -2.00 0.00 0.00 179.45 177.53 1z4h h LEU 60 N 0.14 0.00 0.82 7.07 3.38 -1.15 -0.19 115.31 125.38 1z4h h LEU 60 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1z4h h LEU 60 Cb 0.94 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.69 1z4h h LEU 60 CO 0.07 0.47 -0.39 0.25 0.09 0.00 0.00 178.44 178.93 1z4h h LEU 61 N 0.00 -0.93 -0.07 1.67 7.12 -0.29 -3.26 115.31 119.55 1z4h h LEU 61 Ca -0.00 0.03 -0.24 0.00 0.13 0.00 0.00 57.88 57.79 1z4h h LEU 61 Cb 1.10 0.24 0.01 0.00 -0.53 0.00 0.00 40.66 41.48 1z4h h LEU 61 CO 0.06 -0.66 -1.04 -1.28 -0.13 0.00 0.00 178.44 175.39 1z4h h SER 62 N -1.11 0.53 -3.36 1.25 0.87 -1.60 -3.44 113.55 106.69 1z4h h SER 62 Ca -0.11 -0.46 -0.55 0.00 -1.23 0.00 0.00 61.79 59.44 1z4h h SER 62 Cb 0.84 -0.16 -0.39 0.00 -0.44 0.00 0.00 62.40 62.24 1z4h h SER 62 CO 0.18 1.29 -0.77 -0.13 -0.53 0.00 0.00 176.83 176.87 1z4h s ARG 63 N -3.08 0.91 -0.73 2.24 0.52 -0.08 -5.03 118.95 113.70 1z4h s ARG 63 Ca -0.06 -0.62 -0.20 0.00 -0.52 0.00 0.00 55.73 54.34 1z4h s ARG 63 Cb 0.08 -2.23 -0.15 0.00 0.52 0.00 0.00 34.95 33.16 1z4h s ARG 63 CO 0.88 -0.66 1.91 0.00 0.02 0.00 0.00 175.30 177.45 1z4h n ALA 64 N 4.93 3.32 1.36 2.13 0.00 -1.25 -3.73 120.51 127.28 1z4h n ALA 64 Ca -0.09 -3.01 0.11 0.00 0.00 0.00 0.00 53.44 50.44 1z4h n ALA 64 Cb 0.46 -3.53 0.42 0.00 0.00 0.00 0.00 19.45 16.80 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 7.03 1.40 0.00 0.00 0.23 -1.26 -5.13 115.26 117.53 1z4h n ASN 65 Ca 0.48 -1.65 0.00 0.00 -0.53 0.00 0.00 54.58 52.88 1z4h n ASN 65 Cb 0.36 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 1z4h n ASN 65 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94