#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8u n ALA 2 N 0.00 0.00 0.03 3.04 0.00 -1.26 -5.04 120.51 117.28 1z8u n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1z8u n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1z8u n ALA 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1z8u n LEU 3 N 0.00 -0.52 -1.96 0.00 -0.00 -1.26 -5.13 117.00 108.12 1z8u n LEU 3 Ca 0.00 0.32 -0.01 0.00 -0.00 0.00 0.00 56.01 56.32 1z8u n LEU 3 Cb 0.00 0.74 -0.01 0.00 -0.00 0.00 0.00 43.42 44.15 1z8u n LEU 3 CO 0.00 -0.01 -0.35 -0.11 -0.00 0.00 0.00 177.39 176.92 1z8u n LEU 4 N -2.45 -4.98 -0.35 -1.96 0.00 -1.26 -4.35 117.00 101.65 1z8u n LEU 4 Ca 0.00 1.80 -0.05 0.00 0.00 0.00 0.00 56.01 57.75 1z8u n LEU 4 Cb 0.00 -2.49 -0.01 0.00 0.00 0.00 0.00 43.42 40.92 1z8u n LEU 4 CO 0.00 -2.10 0.56 0.50 0.00 0.00 0.00 177.39 176.35 1z8u h LYS 5 N 2.77 -0.05 -0.70 1.96 1.63 -2.00 -1.97 116.57 118.20 1z8u h LYS 5 Ca -0.09 0.00 0.15 0.00 -0.85 0.00 0.00 60.65 59.87 1z8u h LYS 5 Cb 0.20 0.01 -0.13 0.00 -0.60 0.00 0.00 32.23 31.71 1z8u h LYS 5 CO 0.00 -0.04 -0.08 0.00 -3.45 0.00 0.00 179.45 175.88 1z8u h ALA 6 N 0.97 0.60 -0.38 5.00 0.00 -1.99 -1.48 119.26 121.97 1z8u h ALA 6 Ca 0.26 0.25 -0.13 0.00 0.00 0.00 0.00 54.91 55.28 1z8u h ALA 6 Cb 0.54 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1z8u h ALA 6 CO -0.90 -0.42 -0.30 -0.91 0.00 0.00 0.00 179.25 176.72 1z8u h ASN 7 N 0.05 0.86 0.26 0.00 2.35 -1.63 -2.98 115.58 114.50 1z8u h ASN 7 Ca 0.36 -0.35 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1z8u h ASN 7 Cb 0.59 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1z8u h ASN 7 CO -0.67 1.10 -0.17 0.50 -1.65 0.00 0.00 177.43 176.54 1z8u h LYS 8 N 0.70 0.00 -0.10 0.81 3.64 -0.85 -2.58 116.57 118.19 1z8u h LYS 8 Ca 0.08 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.36 1z8u h LYS 8 Cb 0.85 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1z8u h LYS 8 CO 0.07 0.17 -0.30 -0.44 -2.27 0.00 0.00 179.45 176.68 1z8u h ASP 9 N 0.00 0.44 -0.42 4.20 3.32 -1.24 -3.04 116.42 119.68 1z8u h ASP 9 Ca -0.00 -0.60 0.05 0.00 0.02 0.00 0.00 57.03 56.49 1z8u h ASP 9 Cb 0.35 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1z8u h ASP 9 CO 0.02 0.97 0.17 -0.07 -1.72 0.00 0.00 179.24 178.61 1z8u h LEU 10 N -0.06 0.22 -0.88 1.55 4.07 -1.36 -1.84 115.31 117.01 1z8u h LEU 10 Ca -0.01 0.04 0.04 0.00 0.08 0.00 0.00 57.88 58.03 1z8u h LEU 10 Cb 0.92 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 42.61 1z8u h LEU 10 CO 0.07 0.16 0.56 0.40 -1.08 0.00 0.00 178.44 178.55 1z8u h ILE 11 N 0.36 1.11 -0.68 1.22 2.04 -1.52 0.14 117.51 120.18 1z8u h ILE 11 Ca 0.19 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 1z8u h ILE 11 Cb 0.15 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.15 1z8u h ILE 11 CO -0.17 0.19 0.25 0.28 0.00 0.00 0.00 178.15 178.70 1z8u h SER 12 N 1.06 0.96 0.79 1.72 0.02 -1.33 0.11 113.55 116.88 1z8u h SER 12 Ca 0.36 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1z8u h SER 12 Cb 0.07 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 62.37 1z8u h SER 12 CO -0.14 0.89 -0.38 0.00 -1.14 0.00 0.00 176.83 176.06 1z8u h ALA 13 N 1.11 -1.06 -0.63 3.77 0.00 -0.49 -0.12 119.26 121.84 1z8u h ALA 13 Ca 0.22 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1z8u h ALA 13 Cb 0.25 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 18.35 1z8u h ALA 13 CO -0.01 -1.08 0.07 0.78 0.00 0.00 0.00 179.25 179.01 1z8u h GLY 14 N -1.10 0.75 2.00 0.00 0.00 -0.57 0.37 103.07 104.52 1z8u h GLY 14 Ca -0.11 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1z8u h GLY 14 CO 0.18 -0.17 -0.17 1.41 0.00 0.00 0.00 176.54 177.78 1z8u h LEU 15 N 0.19 0.00 0.02 3.11 3.38 -0.61 0.46 115.31 121.85 1z8u h LEU 15 Ca 0.33 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.03 1z8u h LEU 15 Cb 0.53 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.30 1z8u h LEU 15 CO -0.48 0.17 -1.11 0.50 0.09 0.00 0.00 178.44 177.61 1z8u h LYS 16 N 0.00 0.61 -0.09 1.13 3.64 0.11 -2.53 116.57 119.45 1z8u h LYS 16 Ca -0.00 -0.72 -0.11 0.00 -1.27 0.00 0.00 60.65 58.54 1z8u h LYS 16 Cb 0.32 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1z8u h LYS 16 CO 0.02 1.31 -0.45 0.93 -2.27 0.00 0.00 179.45 178.98 1z8u h GLU 17 N 0.32 0.21 -0.00 1.90 5.08 0.51 -2.64 114.58 119.96 1z8u h GLU 17 Ca -0.14 -0.11 -0.15 0.00 -1.00 0.00 0.00 59.36 57.96 1z8u h GLU 17 Cb 1.77 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.00 1z8u h GLU 17 CO 0.21 0.63 -0.70 0.35 -1.00 0.00 0.00 179.01 178.49 1z8u h PHE 18 N 0.17 0.01 -0.00 4.33 3.57 -0.10 -2.59 116.94 122.33 1z8u h PHE 18 Ca 0.01 -0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.34 1z8u h PHE 18 Cb 0.87 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.59 1z8u h PHE 18 CO 0.01 0.71 -0.79 1.03 -2.23 0.00 0.00 178.31 177.04 1z8u h SER 19 N 0.00 0.06 0.92 0.41 0.87 -1.24 -2.64 113.55 111.93 1z8u h SER 19 Ca -0.01 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.38 1z8u h SER 19 Cb 1.25 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.17 1z8u h SER 19 CO 0.09 0.82 -0.59 1.62 -0.53 0.00 0.00 176.83 178.24 1z8u h VAL 20 N 0.03 1.21 -0.26 2.23 3.04 -1.40 -1.26 116.25 119.83 1z8u h VAL 20 Ca -0.01 -2.20 -0.10 0.00 -1.01 0.00 0.00 66.70 63.38 1z8u h VAL 20 Cb 1.39 2.26 -0.00 0.00 -2.01 0.00 0.00 31.29 32.92 1z8u h VAL 20 CO 0.11 0.58 -0.23 0.25 -1.01 0.00 0.00 177.57 177.27 1z8u h LEU 21 N 0.00 0.66 -0.46 3.16 5.85 -1.32 -2.62 115.31 120.58 1z8u h LEU 21 Ca -0.01 -0.46 -0.17 0.00 0.84 0.00 0.00 57.88 58.09 1z8u h LEU 21 Cb 1.21 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1z8u h LEU 21 CO 0.08 0.98 -0.55 -0.07 -0.34 0.00 0.00 178.44 178.53 1z8u h LEU 22 N 0.34 0.70 -1.40 2.25 3.38 -1.43 -3.19 115.31 115.97 1z8u h LEU 22 Ca 0.05 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 1z8u h LEU 22 Cb 0.78 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1z8u h LEU 22 CO 0.06 1.11 -0.18 0.78 0.09 0.00 0.00 178.44 180.30 1z8u h ASN 23 N 0.48 0.17 0.27 -0.43 2.35 -1.18 -2.17 115.58 115.08 1z8u h ASN 23 Ca 0.01 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1z8u h ASN 23 Cb 1.11 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1z8u h ASN 23 CO 0.11 0.36 -0.06 0.00 -1.65 0.00 0.00 177.43 176.20 1z8u n GLN 24 N -4.25 0.82 -2.19 0.81 10.64 -0.99 -4.84 117.38 117.37 1z8u n GLN 24 Ca -0.01 -0.22 -0.41 0.00 -1.83 0.00 0.00 57.00 54.52 1z8u n GLN 24 Cb 0.29 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.14 1z8u n GLN 24 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 1z8u s GLN 25 N -2.33 4.37 -0.35 2.61 -1.52 -0.82 -4.99 119.66 116.63 1z8u s GLN 25 Ca 0.34 2.08 -0.01 0.00 -1.95 0.00 0.00 55.36 55.82 1z8u s GLN 25 Cb 0.21 -3.20 0.08 0.00 -0.22 0.00 0.00 33.01 29.89 1z8u s GLN 25 CO 0.43 -0.30 0.09 0.08 -0.25 0.00 0.00 175.29 175.34 1z8u s VAL 26 N 0.27 2.92 0.27 1.09 1.01 -1.26 -5.00 120.40 119.70 1z8u s VAL 26 Ca 0.58 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.70 1z8u s VAL 26 Cb -0.37 -2.90 0.26 0.00 0.00 0.00 0.00 36.38 33.37 1z8u s VAL 26 CO 0.37 -0.44 1.80 -0.26 0.00 0.00 0.00 175.10 176.57 1z8u h PHE 27 N 7.93 0.96 0.00 5.22 0.04 -1.98 -0.49 116.94 128.62 1z8u h PHE 27 Ca -0.14 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1z8u h PHE 27 Cb 1.05 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.91 1z8u h PHE 27 CO 0.56 0.31 0.00 -1.71 -0.60 0.00 0.00 178.31 176.87 1z8u n ASN 28 N -4.75 0.00 0.00 2.17 2.85 -1.26 -1.32 115.26 112.96 1z8u n ASN 28 Ca 0.18 -0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 1z8u n ASN 28 Cb 0.40 -0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.41 1z8u n ASN 28 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1z8u n ASP 29 N -1.01 0.78 -0.24 1.20 8.00 -0.20 -4.82 116.55 120.25 1z8u n ASP 29 Ca 0.02 -1.17 -0.07 0.00 0.71 0.00 0.00 54.79 54.28 1z8u n ASP 29 Cb 0.01 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.15 1z8u n ASP 29 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1z8u h ALA 30 N 0.00 0.87 0.00 2.24 0.00 -1.08 -3.45 119.26 117.84 1z8u h ALA 30 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1z8u h ALA 30 Cb 0.34 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1z8u h ALA 30 CO 0.00 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1z8u n LEU 31 N -4.33 0.00 -4.73 0.00 4.77 -1.26 -4.90 117.00 106.55 1z8u n LEU 31 Ca 0.05 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 1z8u n LEU 31 Cb 0.22 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.43 1z8u n LEU 31 CO 0.41 0.00 0.69 0.54 -1.33 0.00 0.00 177.39 177.70 1z8u s VAL 32 N -0.01 2.75 0.56 4.08 0.11 -1.26 -5.06 120.40 121.57 1z8u s VAL 32 Ca 0.00 0.25 0.00 0.00 -2.93 0.00 0.00 61.98 59.30 1z8u s VAL 32 Cb 0.00 -2.53 0.03 0.00 -1.53 0.00 0.00 36.38 32.35 1z8u s VAL 32 CO 0.00 -0.32 0.79 -0.94 -3.33 0.00 0.00 175.10 171.31 1z8u s SER 33 N -3.04 5.28 0.13 3.54 1.04 -1.26 -4.88 113.70 114.50 1z8u s SER 33 Ca 0.64 0.07 -0.20 0.00 0.48 0.00 0.00 55.95 56.94 1z8u s SER 33 Cb -0.20 -0.96 -0.03 0.00 0.10 0.00 0.00 66.02 64.93 1z8u s SER 33 CO 0.56 -1.15 1.70 -0.08 0.98 0.00 0.00 173.24 175.25 1z8u h GLU 34 N 0.02 -0.04 -0.43 4.02 4.81 -1.97 0.18 114.58 121.18 1z8u h GLU 34 Ca -0.43 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 58.89 1z8u h GLU 34 Cb 1.29 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.59 1z8u h GLU 34 CO 0.54 -0.02 -0.18 1.49 -0.73 0.00 0.00 179.01 180.10 1z8u h GLU 35 N -0.04 -0.09 0.00 1.92 4.81 -2.00 -1.70 114.58 117.49 1z8u h GLU 35 Ca 0.09 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 1z8u h GLU 35 Cb 0.18 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1z8u h GLU 35 CO -0.20 -0.06 -0.41 -0.44 -0.73 0.00 0.00 179.01 177.17 1z8u h ASP 36 N -0.09 0.00 -0.37 1.04 3.32 -1.84 -2.90 116.42 115.58 1z8u h ASP 36 Ca 0.21 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 1z8u h ASP 36 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1z8u h ASP 36 CO -0.49 0.41 -0.20 -0.03 -1.72 0.00 0.00 179.24 177.21 1z8u h MET 37 N 0.00 0.86 -0.80 3.56 4.05 -0.27 -0.07 114.93 122.26 1z8u h MET 37 Ca -0.00 -0.34 -0.01 0.00 -0.28 0.00 0.00 59.70 59.06 1z8u h MET 37 Cb 1.04 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.76 1z8u h MET 37 CO 0.05 0.98 0.44 0.28 0.23 0.00 0.00 176.91 178.89 1z8u h VAL 38 N 0.75 1.23 -0.34 -5.77 2.07 -1.15 0.78 116.25 113.83 1z8u h VAL 38 Ca 0.10 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 1z8u h VAL 38 Cb 0.74 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1z8u h VAL 38 CO 0.06 0.26 0.03 0.74 0.02 0.00 0.00 177.57 178.68 1z8u h THR 39 N 1.11 1.25 0.19 2.57 2.02 -1.22 -0.50 112.91 118.33 1z8u h THR 39 Ca 0.28 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 1z8u h THR 39 Cb 0.02 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1z8u h THR 39 CO -0.05 0.30 -0.12 0.58 0.37 0.00 0.00 175.52 176.60 1z8u h VAL 40 N 0.40 0.75 -0.89 3.16 2.07 -0.43 0.11 116.25 121.42 1z8u h VAL 40 Ca 0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.68 1z8u h VAL 40 Cb 0.40 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1z8u h VAL 40 CO 0.01 0.00 0.58 0.58 0.02 0.00 0.00 177.57 178.76 1z8u h VAL 41 N -0.30 1.07 -0.41 2.57 2.07 -0.80 0.41 116.25 120.87 1z8u h VAL 41 Ca -0.02 -0.35 -0.11 0.00 0.82 0.00 0.00 66.70 67.05 1z8u h VAL 41 Cb 0.25 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1z8u h VAL 41 CO 0.02 0.19 -0.18 -0.33 0.02 0.00 0.00 177.57 177.28 1z8u h GLU 42 N 1.02 0.78 -0.32 1.57 5.08 -0.58 -1.32 114.58 120.80 1z8u h GLU 42 Ca 0.38 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1z8u h GLU 42 Cb 0.18 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1z8u h GLU 42 CO -0.14 0.90 -0.08 -0.44 -1.00 0.00 0.00 179.01 178.26 1z8u h ASP 43 N 0.69 0.50 -0.38 1.42 3.45 0.48 -1.31 116.42 121.26 1z8u h ASP 43 Ca 0.10 -0.12 -0.06 0.00 0.43 0.00 0.00 57.03 57.38 1z8u h ASP 43 Cb 0.68 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.31 1z8u h ASP 43 CO 0.05 0.62 -0.01 -0.50 -1.57 0.00 0.00 179.24 177.83 1z8u h TRP 44 N 0.49 0.75 -0.21 4.55 6.55 -0.32 -1.98 115.95 125.77 1z8u h TRP 44 Ca 0.10 -0.13 -0.08 0.00 0.95 0.00 0.00 58.89 59.73 1z8u h TRP 44 Cb 0.43 -0.19 -0.00 0.00 -0.86 0.00 0.00 29.16 28.54 1z8u h TRP 44 CO 0.01 0.78 -0.16 0.52 -1.05 0.00 0.00 178.44 178.54 1z8u h MET 45 N 0.50 0.49 -0.76 0.49 2.86 -1.00 -1.94 114.93 115.58 1z8u h MET 45 Ca 0.11 -0.24 0.07 0.00 -2.06 0.00 0.00 59.70 57.58 1z8u h MET 45 Cb 0.48 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.10 1z8u h MET 45 CO 0.02 0.80 0.50 -0.91 1.06 0.00 0.00 176.91 178.38 1z8u h ASN 46 N 0.18 0.67 -0.29 1.22 2.35 -1.26 0.01 115.58 118.45 1z8u h ASN 46 Ca 0.04 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.74 1z8u h ASN 46 Cb 0.69 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 1z8u h ASN 46 CO 0.04 0.42 -0.03 0.15 -1.65 0.00 0.00 177.43 176.36 1z8u h PHE 47 N 0.76 0.60 -0.69 1.19 -0.00 -1.17 -0.26 116.94 117.37 1z8u h PHE 47 Ca 0.33 -0.12 0.00 0.00 -0.00 0.00 0.00 57.97 58.19 1z8u h PHE 47 Cb 0.32 -0.15 -0.03 0.00 -0.00 0.00 0.00 35.95 36.08 1z8u h PHE 47 CO -0.00 0.71 0.44 1.88 -0.00 0.00 0.00 178.31 181.34 1z8u h TYR 48 N 0.32 0.90 -0.20 0.41 -1.99 -0.42 -0.42 116.97 115.56 1z8u h TYR 48 Ca 0.08 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.81 1z8u h TYR 48 Cb 0.49 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.91 1z8u h TYR 48 CO 0.04 0.59 0.11 0.82 -0.00 0.00 0.00 178.16 179.72 1z8u h ILE 49 N 0.94 1.11 0.00 -2.88 1.08 -0.89 -0.48 117.51 116.39 1z8u h ILE 49 Ca 0.25 -0.29 -0.04 0.00 -0.39 0.00 0.00 64.86 64.40 1z8u h ILE 49 Cb -0.07 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 34.61 1z8u h ILE 49 CO -0.05 0.10 -0.17 0.78 -0.69 0.00 0.00 178.15 178.13 1z8u h ASN 50 N 0.22 0.00 0.04 1.72 2.35 -0.68 0.55 115.58 119.78 1z8u h ASN 50 Ca 0.07 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1z8u h ASN 50 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1z8u h ASN 50 CO -0.01 0.17 -0.02 0.22 -1.65 0.00 0.00 177.43 176.14 1z8u h TYR 51 N 0.00 -0.04 0.00 1.19 5.03 -0.58 -3.26 116.97 119.30 1z8u h TYR 51 Ca -0.00 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 1z8u h TYR 51 Cb 0.34 0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.63 1z8u h TYR 51 CO 0.00 0.62 -0.22 1.88 -1.32 0.00 0.00 178.16 179.12 1z8u h TYR 52 N -0.80 0.00 0.00 -3.82 0.05 -0.86 -1.71 116.97 109.82 1z8u h TYR 52 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1z8u h TYR 52 Cb 0.68 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.42 1z8u h TYR 52 CO 0.16 0.22 0.25 -0.09 -1.05 0.00 0.00 178.16 177.65 1z8u h ARG 53 N 0.00 0.00 -0.02 4.88 2.43 0.07 1.19 114.38 122.94 1z8u h ARG 53 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1z8u h ARG 53 Cb 0.65 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1z8u h ARG 53 CO 0.03 0.00 -0.03 1.04 -1.51 0.00 0.00 179.97 179.49 1z8u n GLN 54 N -2.47 1.02 -0.08 0.20 1.13 -0.65 -4.62 117.38 111.90 1z8u n GLN 54 Ca -0.02 -1.23 -0.11 0.00 -1.94 0.00 0.00 57.00 53.70 1z8u n GLN 54 Cb 0.29 -1.25 -0.08 0.00 0.11 0.00 0.00 30.24 29.31 1z8u n GLN 54 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1z8u n GLN 55 N 0.65 0.50 -1.22 -1.09 1.13 0.39 -5.00 117.38 112.74 1z8u n GLN 55 Ca 0.08 0.09 -0.34 0.00 -1.94 0.00 0.00 57.00 54.88 1z8u n GLN 55 Cb 0.33 -1.34 0.11 0.00 0.11 0.00 0.00 30.24 29.45 1z8u n GLN 55 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1z8u n VAL 56 N -2.97 2.44 -4.38 5.09 0.24 -0.23 -5.02 118.33 113.51 1z8u n VAL 56 Ca -0.30 -0.28 -0.21 0.00 -2.04 0.00 0.00 64.34 61.51 1z8u n VAL 56 Cb 0.83 -1.17 -0.09 0.00 -1.47 0.00 0.00 33.84 31.94 1z8u n VAL 56 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1z8u s THR 57 N -1.97 0.40 0.00 3.34 -1.32 -1.26 -5.01 115.64 109.82 1z8u s THR 57 Ca 0.73 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.21 1z8u s THR 57 Cb -0.31 -2.49 0.00 0.00 -1.51 0.00 0.00 72.50 68.19 1z8u s THR 57 CO 0.50 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.52 1z8u n GLY 58 N -0.67 -0.25 3.84 6.08 0.00 -1.26 -4.30 105.19 108.63 1z8u n GLY 58 Ca -0.00 -2.21 -0.33 0.00 0.00 0.00 0.00 46.02 43.48 1z8u n GLY 58 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1z8u s GLU 59 N 0.00 4.06 0.01 1.61 2.12 -1.26 -4.78 118.70 120.46 1z8u s GLU 59 Ca 0.00 0.78 0.00 0.00 0.36 0.00 0.00 54.97 56.12 1z8u s GLU 59 Cb 0.00 -2.37 0.02 0.00 0.26 0.00 0.00 34.13 32.03 1z8u s GLU 59 CO 0.00 0.11 0.71 -2.30 -0.54 0.00 0.00 175.26 173.25 1z8u n PRO 60 N -0.42 0.00 0.07 4.30 -0.02 -1.26 -0.40 135.00 137.28 1z8u n PRO 60 Ca 0.04 0.21 -0.23 0.00 -2.02 0.00 0.00 63.50 61.50 1z8u n PRO 60 Cb 0.53 -1.82 -0.15 0.00 -0.02 0.00 0.00 33.50 32.05 1z8u n PRO 60 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1z8u h GLN 61 N 0.00 0.39 0.20 -0.52 4.20 -1.99 -3.30 115.11 114.10 1z8u h GLN 61 Ca 0.00 -0.67 -0.34 0.00 0.06 0.00 0.00 58.65 57.70 1z8u h GLN 61 Cb 0.62 0.25 0.02 0.00 0.30 0.00 0.00 27.48 28.66 1z8u h GLN 61 CO 0.00 1.32 -1.61 0.93 -0.67 0.00 0.00 178.83 178.80 1z8u h GLU 62 N 0.06 0.43 -0.30 1.46 4.39 -1.08 -3.19 114.58 116.35 1z8u h GLU 62 Ca -0.33 -0.73 0.07 0.00 0.34 0.00 0.00 59.36 58.70 1z8u h GLU 62 Cb 2.07 0.27 -0.07 0.00 -0.10 0.00 0.00 28.75 30.92 1z8u h GLU 62 CO 0.17 1.35 -0.21 -0.09 -1.16 0.00 0.00 179.01 179.08 1z8u h ARG 63 N 0.07 -0.17 0.11 2.33 2.43 -1.44 0.35 114.38 118.06 1z8u h ARG 63 Ca -0.31 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 1z8u h ARG 63 Cb 2.08 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.67 1z8u h ARG 63 CO 0.20 -0.11 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.05 1z8u h ASP 64 N -0.18 -0.12 -0.85 -3.80 3.32 -1.72 -2.93 116.42 110.14 1z8u h ASP 64 Ca 0.16 -0.21 0.14 0.00 0.02 0.00 0.00 57.03 57.14 1z8u h ASP 64 Cb 0.42 0.03 -0.06 0.00 0.22 0.00 0.00 39.33 39.94 1z8u h ASP 64 CO -0.41 0.14 0.55 0.11 -1.72 0.00 0.00 179.24 177.91 1z8u h LYS 65 N -0.39 0.61 0.25 3.56 1.57 -1.45 -0.23 116.57 120.51 1z8u h LYS 65 Ca -0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1z8u h LYS 65 Cb 0.32 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1z8u h LYS 65 CO 0.02 0.41 -0.12 0.00 -0.57 0.00 0.00 179.45 179.19 1z8u h ALA 66 N 1.61 -0.34 -0.41 3.86 0.00 -0.18 -1.55 119.26 122.24 1z8u h ALA 66 Ca 0.42 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 1z8u h ALA 66 Cb 0.72 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1z8u h ALA 66 CO -0.18 -0.63 -0.07 -0.07 0.00 0.00 0.00 179.25 178.31 1z8u h LEU 67 N -0.46 0.69 -1.59 0.00 3.38 -1.26 -1.65 115.31 114.42 1z8u h LEU 67 Ca -0.03 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1z8u h LEU 67 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1z8u h LEU 67 CO 0.06 0.80 -0.22 1.56 0.09 0.00 0.00 178.44 180.72 1z8u h GLN 68 N 0.65 0.00 0.10 1.13 4.20 -0.94 -1.49 115.11 118.77 1z8u h GLN 68 Ca 0.12 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.69 1z8u h GLN 68 Cb 0.50 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.30 1z8u h GLN 68 CO 0.03 0.22 -0.60 1.49 -0.67 0.00 0.00 178.83 179.30 1z8u h GLU 69 N 0.00 0.22 -0.89 1.46 4.81 -0.78 -3.01 114.58 116.39 1z8u h GLU 69 Ca -0.00 -0.37 0.18 0.00 -0.13 0.00 0.00 59.36 59.04 1z8u h GLU 69 Cb 0.45 0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.90 1z8u h GLU 69 CO 0.03 1.18 0.58 1.25 -0.73 0.00 0.00 179.01 181.32 1z8u h LEU 70 N -0.54 0.48 -0.59 1.64 5.85 -1.09 0.11 115.31 121.17 1z8u h LEU 70 Ca -0.11 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 1z8u h LEU 70 Cb 1.47 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1z8u h LEU 70 CO 0.11 0.21 -0.05 -0.09 -0.34 0.00 0.00 178.44 178.28 1z8u h ARG 71 N 0.49 1.06 -0.35 1.25 2.43 -1.29 0.09 114.38 118.07 1z8u h ARG 71 Ca 0.46 -0.36 -0.11 0.00 -0.81 0.00 0.00 59.98 59.15 1z8u h ARG 71 Cb 1.01 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1z8u h ARG 71 CO -0.19 1.06 -0.23 1.96 -1.51 0.00 0.00 179.97 181.06 1z8u h GLN 72 N 0.96 0.69 -0.08 0.20 4.20 -0.69 -2.03 115.11 118.35 1z8u h GLN 72 Ca 0.16 -0.27 -0.19 0.00 0.06 0.00 0.00 58.65 58.40 1z8u h GLN 72 Cb 0.62 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 1z8u h GLN 72 CO 0.04 0.86 -0.75 0.93 -0.67 0.00 0.00 178.83 179.24 1z8u h GLU 73 N 0.60 0.44 -0.13 1.46 4.39 -1.00 -1.72 114.58 118.62 1z8u h GLU 73 Ca 0.08 -0.37 -0.02 0.00 0.34 0.00 0.00 59.36 59.40 1z8u h GLU 73 Cb 0.72 0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1z8u h GLU 73 CO 0.06 1.00 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.84 1z8u h LEU 74 N 0.29 0.23 -1.29 1.33 3.38 -0.89 -1.59 115.31 116.78 1z8u h LEU 74 Ca -0.04 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.70 1z8u h LEU 74 Cb 1.34 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.97 1z8u h LEU 74 CO 0.13 0.49 0.54 0.78 0.09 0.00 0.00 178.44 180.47 1z8u h ASN 75 N -0.04 0.73 0.23 -0.43 -0.26 -1.36 0.41 115.58 114.86 1z8u h ASN 75 Ca 0.04 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 1z8u h ASN 75 Cb 0.38 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 37.49 1z8u h ASN 75 CO 0.01 0.45 -0.14 0.74 -1.06 0.00 0.00 177.43 177.43 1z8u h THR 76 N 0.82 0.71 0.00 2.81 2.02 -0.83 -1.01 112.91 117.43 1z8u h THR 76 Ca 0.37 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.47 1z8u h THR 76 Cb 0.37 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1z8u h THR 76 CO -0.14 0.00 -0.37 -0.07 0.37 0.00 0.00 175.52 175.31 1z8u h LEU 77 N -0.35 0.00 -0.09 2.58 3.38 -0.41 -3.29 115.31 117.13 1z8u h LEU 77 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1z8u h LEU 77 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1z8u h LEU 77 CO 0.02 0.37 -0.11 0.00 0.09 0.00 0.00 178.44 178.81 1z8u h ALA 78 N 1.63 0.14 -0.52 1.53 0.00 0.30 -3.34 119.26 119.00 1z8u h ALA 78 Ca -0.00 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.68 1z8u h ALA 78 Cb 0.71 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 1z8u h ALA 78 CO 0.05 -0.01 0.11 -0.91 0.00 0.00 0.00 179.25 178.49 1z8u h ASN 79 N -0.20 0.01 -0.75 0.00 2.35 -1.27 0.01 115.58 115.72 1z8u h ASN 79 Ca 0.01 0.09 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 1z8u h ASN 79 Cb 0.65 0.13 -0.04 0.00 0.05 0.00 0.00 38.32 39.11 1z8u h ASN 79 CO 0.03 0.03 0.50 -0.65 -1.65 0.00 0.00 177.43 175.68 1z8u h PRO 80 N 0.24 0.87 0.63 0.81 0.11 -1.72 0.13 132.00 133.07 1z8u h PRO 80 Ca 0.26 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.29 1z8u h PRO 80 Cb 0.35 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 31.27 1z8u h PRO 80 CO -0.34 0.57 -0.30 0.35 -0.21 0.00 0.00 178.00 178.07 1z8u h PHE 81 N 0.89 -0.78 -0.41 0.65 3.57 -1.40 -1.15 116.94 118.31 1z8u h PHE 81 Ca 0.31 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.91 1z8u h PHE 81 Cb 0.09 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 1z8u h PHE 81 CO -0.00 -0.44 0.30 -0.07 -2.23 0.00 0.00 178.31 175.87 1z8u h LEU 82 N -1.02 0.00 -0.01 0.59 3.38 -0.67 -1.31 115.31 116.26 1z8u h LEU 82 Ca -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1z8u h LEU 82 Cb 0.69 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1z8u h LEU 82 CO 0.14 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.67 1z8u h ALA 83 N 1.77 0.01 -0.02 1.53 0.00 -0.26 -2.46 119.26 119.84 1z8u h ALA 83 Ca 0.19 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1z8u h ALA 83 Cb 0.80 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1z8u h ALA 83 CO -0.00 -0.37 0.01 0.87 0.00 0.00 0.00 179.25 179.75 1z8u h LYS 84 N -0.20 0.03 -0.94 0.00 1.57 -0.12 -2.40 116.57 114.51 1z8u h LYS 84 Ca 0.00 -0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.97 1z8u h LYS 84 Cb 0.22 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.45 1z8u h LYS 84 CO -0.00 0.18 0.60 -0.92 -0.57 0.00 0.00 179.45 178.74 1z8u h TYR 85 N -0.13 0.73 -0.12 -1.35 5.03 -1.39 0.63 116.97 120.36 1z8u h TYR 85 Ca 0.01 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.35 1z8u h TYR 85 Cb 0.16 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 1z8u h TYR 85 CO -0.02 0.19 0.02 -0.09 -1.32 0.00 0.00 178.16 176.94 1z8u h ARG 86 N 0.55 0.07 -0.47 1.82 2.43 -0.96 -1.22 114.38 116.61 1z8u h ARG 86 Ca 0.50 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.58 1z8u h ARG 86 Cb 1.04 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.56 1z8u h ARG 86 CO -0.24 0.04 -0.08 -0.44 -1.51 0.00 0.00 179.97 177.74 1z8u h ASP 87 N 0.07 0.81 -0.43 -3.80 3.45 0.06 -2.71 116.42 113.87 1z8u h ASP 87 Ca 0.06 -0.24 0.05 0.00 0.43 0.00 0.00 57.03 57.33 1z8u h ASP 87 Cb 0.05 -0.22 -0.05 0.00 -0.56 0.00 0.00 39.33 38.56 1z8u h ASP 87 CO -0.08 0.93 0.16 0.15 -1.57 0.00 0.00 179.24 178.83 1z8u h PHE 88 N 0.75 0.29 -0.65 4.55 3.57 0.45 -1.64 116.94 124.26 1z8u h PHE 88 Ca 0.13 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1z8u h PHE 88 Cb 0.57 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1z8u h PHE 88 CO 0.03 0.11 0.43 -0.07 -2.23 0.00 0.00 178.31 176.59 1z8u h LEU 89 N 0.34 0.70 -2.18 0.59 4.07 -1.01 -2.91 115.31 114.91 1z8u h LEU 89 Ca 0.20 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.15 1z8u h LEU 89 Cb 0.18 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.75 1z8u h LEU 89 CO -0.20 0.49 0.00 0.11 -1.08 0.00 0.00 178.44 177.77 1z8u h LYS 90 N 0.82 0.00 0.00 1.13 6.56 -0.99 -3.52 116.57 120.57 1z8u h LYS 90 Ca 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 1z8u h LYS 90 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1z8u h LYS 90 CO -0.06 0.00 0.00 0.43 -2.06 0.00 0.00 179.45 177.76