#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m79 s ASP 2 N 0.00 4.52 0.14 0.00 1.47 -1.26 -4.83 116.67 116.71 3m79 s ASP 2 Ca 0.00 0.54 -0.18 0.00 1.18 0.00 0.00 52.55 54.10 3m79 s ASP 2 Cb 0.00 -1.07 0.02 0.00 -0.34 0.00 0.00 42.92 41.54 3m79 s ASP 2 CO 0.00 -1.84 1.75 0.25 0.68 0.00 0.00 175.17 176.01 3m79 h LEU 3 N -0.88 0.09 -0.60 2.11 6.46 -1.95 -1.89 115.31 118.65 3m79 h LEU 3 Ca -0.45 0.04 0.05 0.00 -0.12 0.00 0.00 57.88 57.40 3m79 h LEU 3 Cb 1.31 0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 41.22 3m79 h LEU 3 CO 0.60 0.09 0.32 -0.08 -0.62 0.00 0.00 178.44 178.74 3m79 h GLU 4 N 0.22 0.58 -0.47 1.25 4.81 -1.99 -0.10 114.58 118.88 3m79 h GLU 4 Ca 0.13 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3m79 h GLU 4 Cb 0.11 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 3m79 h GLU 4 CO -0.15 0.38 0.12 -0.44 -0.73 0.00 0.00 179.01 178.20 3m79 h ASP 5 N 0.60 0.70 -0.85 1.04 3.32 -1.85 -1.15 116.42 118.23 3m79 h ASP 5 Ca 0.27 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3m79 h ASP 5 Cb 0.16 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 3m79 h ASP 5 CO -0.17 0.75 0.53 0.78 -1.72 0.00 0.00 179.24 179.40 3m79 h ASN 6 N 0.63 1.01 -0.55 6.45 2.35 -1.00 -1.67 115.58 122.80 3m79 h ASN 6 Ca 0.15 -0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.79 3m79 h ASN 6 Cb 0.31 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 3m79 h ASN 6 CO 0.00 0.76 0.14 0.24 -1.65 0.00 0.00 177.43 176.93 3m79 h MET 7 N 1.16 0.93 -0.24 0.81 2.86 -0.81 -0.91 114.93 118.74 3m79 h MET 7 Ca 0.31 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3m79 h MET 7 Cb -0.07 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 3m79 h MET 7 CO -0.06 0.83 0.11 1.49 1.06 0.00 0.00 176.91 180.34 3m79 h GLU 8 N 0.89 0.35 -0.28 1.72 4.81 -0.85 -0.55 114.58 120.67 3m79 h GLU 8 Ca 0.19 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3m79 h GLU 8 Cb 0.32 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 3m79 h GLU 8 CO -0.00 0.37 -0.21 0.00 -0.73 0.00 0.00 179.01 178.44 3m79 h THR 9 N 0.25 1.26 -0.10 0.32 1.03 -1.11 0.14 112.91 114.69 3m79 h THR 9 Ca 0.08 -1.20 0.02 0.00 -0.01 0.00 0.00 66.41 65.30 3m79 h THR 9 Cb 0.14 1.27 -0.02 0.00 -1.07 0.00 0.00 68.15 68.47 3m79 h THR 9 CO -0.01 0.38 -0.02 -0.07 -0.01 0.00 0.00 175.52 175.80 3m79 h LEU 10 N 0.46 -0.08 -0.15 0.00 3.38 -1.02 -2.11 115.31 115.80 3m79 h LEU 10 Ca 0.07 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3m79 h LEU 10 Cb 0.62 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3m79 h LEU 10 CO 0.04 -0.03 0.02 -1.13 0.09 0.00 0.00 178.44 177.44 3m79 h ASN 11 N 0.01 0.24 -0.39 -0.43 -1.24 -0.78 -1.49 115.58 111.49 3m79 h ASN 11 Ca 0.05 -0.27 0.07 0.00 0.71 0.00 0.00 56.30 56.86 3m79 h ASN 11 Cb 0.07 -0.06 -0.06 0.00 0.73 0.00 0.00 38.32 38.99 3m79 h ASN 11 CO -0.10 0.45 0.01 0.44 -1.29 0.00 0.00 177.43 176.95 3m79 h ASP 12 N 0.02 -0.13 0.91 1.15 3.32 -0.74 -2.58 116.42 118.37 3m79 h ASP 12 Ca 0.04 0.09 -0.15 0.00 0.02 0.00 0.00 57.03 57.03 3m79 h ASP 12 Cb 0.31 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 3m79 h ASP 12 CO 0.00 -0.03 -0.73 0.78 -1.72 0.00 0.00 179.24 177.54 3m79 h ASN 13 N 0.12 0.00 -0.76 6.45 4.21 -1.33 -2.34 115.58 121.93 3m79 h ASN 13 Ca 0.19 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.71 3m79 h ASN 13 Cb 0.26 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.43 3m79 h ASN 13 CO -0.31 0.73 0.49 0.25 -1.29 0.00 0.00 177.43 177.30 3m79 h LEU 14 N 0.00 0.88 -0.70 1.61 5.85 -1.11 -1.68 115.31 120.16 3m79 h LEU 14 Ca -0.01 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 3m79 h LEU 14 Cb 1.38 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 3m79 h LEU 14 CO 0.10 0.65 0.27 0.11 -0.34 0.00 0.00 178.44 179.23 3m79 h LYS 15 N 1.03 1.05 -0.56 1.25 6.56 -1.27 -2.22 116.57 122.42 3m79 h LYS 15 Ca 0.28 -0.20 0.04 0.00 -1.06 0.00 0.00 60.65 59.71 3m79 h LYS 15 Cb -0.10 -0.17 -0.05 0.00 -0.57 0.00 0.00 32.23 31.35 3m79 h LYS 15 CO -0.06 0.88 0.30 0.28 -2.06 0.00 0.00 179.45 178.79 3m79 h VAL 16 N 1.00 0.98 -0.35 0.50 2.07 -1.18 -2.24 116.25 117.03 3m79 h VAL 16 Ca 0.23 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.56 3m79 h VAL 16 Cb 0.23 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3m79 h VAL 16 CO -0.02 0.10 0.21 0.40 0.02 0.00 0.00 177.57 178.29 3m79 h ILE 17 N 0.58 1.06 -0.56 4.57 2.04 -1.07 -1.30 117.51 122.83 3m79 h ILE 17 Ca 0.24 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.99 3m79 h ILE 17 Cb 0.13 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3m79 h ILE 17 CO -0.15 0.08 0.37 -0.33 0.00 0.00 0.00 178.15 178.12 3m79 h GLU 18 N 0.44 0.60 -0.14 2.37 5.08 -1.08 -2.50 114.58 119.35 3m79 h GLU 18 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3m79 h GLU 18 Cb -0.02 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3m79 h GLU 18 CO -0.05 0.40 0.00 1.63 -1.00 0.00 0.00 179.01 179.98 3m79 n LYS 19 N -4.47 2.32 -2.21 2.33 5.02 -0.87 -5.01 118.16 115.27 3m79 n LYS 19 Ca 0.07 -1.94 -0.37 0.00 -2.02 0.00 0.00 58.31 54.05 3m79 n LYS 19 Cb 0.16 -1.48 -0.00 0.00 -0.02 0.00 0.00 35.03 33.70 3m79 n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3m79 s ALA 20 N -1.84 2.90 -0.05 7.82 0.00 -0.51 -4.97 121.76 125.11 3m79 s ALA 20 Ca 0.32 0.96 0.15 0.00 0.00 0.00 0.00 51.96 53.38 3m79 s ALA 20 Cb 0.21 -3.40 -0.22 0.00 0.00 0.00 0.00 23.12 19.71 3m79 s ALA 20 CO 0.31 -0.76 0.34 -0.25 0.00 0.00 0.00 175.76 175.39 3m79 n ASP 21 N -0.71 1.60 -4.21 0.00 8.00 -1.26 -5.05 116.55 114.92 3m79 n ASP 21 Ca 0.08 -0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.42 3m79 n ASP 21 Cb 0.48 1.64 -0.10 0.00 -0.02 0.00 0.00 41.12 43.12 3m79 n ASP 21 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3m79 s ASN 22 N -3.62 0.87 0.30 -2.24 2.20 -1.26 -5.06 114.94 106.12 3m79 s ASN 22 Ca -0.05 -1.20 0.02 0.00 -0.94 0.00 0.00 52.86 50.69 3m79 s ASN 22 Cb 0.09 0.19 0.46 0.00 -2.00 0.00 0.00 41.25 39.99 3m79 s ASN 22 CO 0.61 -0.64 1.79 0.00 -2.94 0.00 0.00 177.10 175.91 3m79 h ALA 23 N 2.73 1.20 -0.85 3.54 0.00 -1.91 -2.96 119.26 121.02 3m79 h ALA 23 Ca -0.36 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 3m79 h ALA 23 Cb 1.21 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3m79 h ALA 23 CO 0.61 0.52 0.49 0.00 0.00 0.00 0.00 179.25 180.86 3m79 h ALA 24 N 1.37 1.08 -0.19 0.00 0.00 -1.97 0.18 119.26 119.73 3m79 h ALA 24 Ca 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m79 h ALA 24 Cb 0.48 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3m79 h ALA 24 CO 0.03 0.57 0.13 0.37 0.00 0.00 0.00 179.25 180.35 3m79 h GLN 25 N 1.17 0.26 -0.34 0.00 4.15 -1.96 -1.57 115.11 116.82 3m79 h GLN 25 Ca 0.30 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.67 3m79 h GLN 25 Cb -0.01 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3m79 h GLN 25 CO -0.05 0.17 0.07 0.28 -1.93 0.00 0.00 178.83 177.37 3m79 h VAL 26 N 0.26 1.23 -0.14 2.39 2.07 -1.32 -2.25 116.25 118.48 3m79 h VAL 26 Ca 0.07 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.85 3m79 h VAL 26 Cb -0.03 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 3m79 h VAL 26 CO -0.02 0.26 -0.08 0.11 0.02 0.00 0.00 177.57 177.87 3m79 h LYS 27 N 0.40 -0.07 -0.40 1.57 1.57 -0.58 -0.78 116.57 118.28 3m79 h LYS 27 Ca 0.11 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3m79 h LYS 27 Cb 0.32 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3m79 h LYS 27 CO 0.00 -0.05 0.25 0.22 -0.57 0.00 0.00 179.45 179.31 3m79 h ASP 28 N -0.08 0.43 -0.39 0.86 3.58 -1.25 -1.35 116.42 118.23 3m79 h ASP 28 Ca 0.08 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 3m79 h ASP 28 Cb 0.20 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.13 3m79 h ASP 28 CO -0.19 0.31 0.20 0.00 -2.88 0.00 0.00 179.24 176.69 3m79 h ALA 29 N 1.15 0.50 -0.70 -0.78 0.00 -1.21 -2.26 119.26 115.97 3m79 h ALA 29 Ca 0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3m79 h ALA 29 Cb -0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3m79 h ALA 29 CO -0.04 0.05 0.24 -0.07 0.00 0.00 0.00 179.25 179.42 3m79 h LEU 30 N 0.50 0.99 -0.61 0.00 3.38 -0.99 -1.09 115.31 117.49 3m79 h LEU 30 Ca 0.14 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.95 3m79 h LEU 30 Cb 0.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3m79 h LEU 30 CO -0.02 0.91 0.40 0.74 0.09 0.00 0.00 178.44 180.56 3m79 h THR 31 N 1.03 1.15 -0.47 0.22 2.02 -1.09 -0.31 112.91 115.46 3m79 h THR 31 Ca 0.23 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 3m79 h THR 31 Cb 0.26 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3m79 h THR 31 CO -0.01 0.15 0.13 0.11 0.37 0.00 0.00 175.52 176.27 3m79 h LYS 32 N 0.81 0.74 -0.74 6.66 1.57 -1.07 -2.43 116.57 122.12 3m79 h LYS 32 Ca 0.22 -0.17 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 3m79 h LYS 32 Cb -0.08 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 3m79 h LYS 32 CO -0.05 0.71 0.47 0.52 -0.57 0.00 0.00 179.45 180.52 3m79 h MET 33 N 0.63 0.89 -0.79 3.15 2.86 -1.00 -1.70 114.93 118.96 3m79 h MET 33 Ca 0.15 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.76 3m79 h MET 33 Cb 0.29 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.71 3m79 h MET 33 CO -0.00 0.59 0.51 0.00 1.06 0.00 0.00 176.91 179.07 3m79 h ALA 34 N 1.31 1.02 -0.39 6.32 0.00 -0.83 0.61 119.26 127.30 3m79 h ALA 34 Ca 0.29 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.05 3m79 h ALA 34 Cb 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3m79 h ALA 34 CO -0.11 0.36 -0.19 0.00 0.00 0.00 0.00 179.25 179.31 3m79 h ALA 35 N 1.31 0.54 -0.38 0.00 0.00 -1.17 -1.96 119.26 117.60 3m79 h ALA 35 Ca 0.30 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3m79 h ALA 35 Cb -0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3m79 h ALA 35 CO -0.09 0.49 0.13 0.00 0.00 0.00 0.00 179.25 179.79 3m79 h ALA 36 N 0.80 0.50 -0.68 0.00 0.00 -0.95 -1.46 119.26 117.48 3m79 h ALA 36 Ca 0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3m79 h ALA 36 Cb 0.75 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3m79 h ALA 36 CO 0.06 0.13 0.40 0.00 0.00 0.00 0.00 179.25 179.84 3m79 h ALA 37 N 0.98 0.87 -0.68 0.00 0.00 -0.86 -1.16 119.26 118.41 3m79 h ALA 37 Ca 0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3m79 h ALA 37 Cb 0.23 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3m79 h ALA 37 CO -0.01 0.35 0.23 0.00 0.00 0.00 0.00 179.25 179.83 3m79 h ALA 38 N 1.21 1.13 0.00 0.00 0.00 -1.25 -2.68 119.26 117.67 3m79 h ALA 38 Ca 0.24 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3m79 h ALA 38 Cb -0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3m79 h ALA 38 CO -0.04 0.61 -0.54 0.22 0.00 0.00 0.00 179.25 179.50 3m79 h ASP 39 N 1.00 0.00 1.48 0.00 3.58 -0.94 -3.00 116.42 118.54 3m79 h ASP 39 Ca 0.22 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.67 3m79 h ASP 39 Cb 0.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.30 3m79 h ASP 39 CO -0.01 0.54 0.00 0.00 -2.88 0.00 0.00 179.24 176.88 3m79 h ALA 40 N 1.46 1.00 -0.90 -0.78 0.00 -0.90 -3.39 119.26 115.77 3m79 h ALA 40 Ca -0.01 0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.11 3m79 h ALA 40 Cb 0.97 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.59 3m79 h ALA 40 CO 0.07 0.00 -0.11 2.35 0.00 0.00 0.00 179.25 181.56 3m79 h TRP 41 N 0.00 -0.27 -0.01 0.00 2.91 -1.35 -1.34 115.95 115.89 3m79 h TRP 41 Ca 0.00 0.07 0.00 0.00 1.13 0.00 0.00 58.89 60.09 3m79 h TRP 41 Cb 0.74 0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.65 3m79 h TRP 41 CO 0.00 -0.37 -0.02 -1.13 -1.03 0.00 0.00 178.44 175.89 3m79 n SER 42 N -5.50 1.36 -4.79 2.65 3.41 -1.26 -4.82 113.62 104.66 3m79 n SER 42 Ca 0.16 -1.41 -0.35 0.00 -0.26 0.00 0.00 58.87 57.01 3m79 n SER 42 Cb 0.54 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 3m79 n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m79 s ALA 43 N -2.05 2.96 -0.28 7.33 0.00 -0.51 -5.04 121.76 124.17 3m79 s ALA 43 Ca 0.37 0.69 -0.08 0.00 0.00 0.00 0.00 51.96 52.95 3m79 s ALA 43 Cb 0.21 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 3m79 s ALA 43 CO 0.35 -0.33 0.09 0.99 0.00 0.00 0.00 175.76 176.86 3m79 s THR 44 N -1.80 4.21 0.49 0.00 2.01 -1.26 -5.01 115.64 114.28 3m79 s THR 44 Ca 0.63 -0.46 -0.22 0.00 0.31 0.00 0.00 61.69 61.95 3m79 s THR 44 Cb -0.20 -3.10 -0.07 0.00 0.01 0.00 0.00 72.50 69.14 3m79 s THR 44 CO 0.25 0.16 1.19 -2.16 -0.69 0.00 0.00 174.62 173.37 3m79 s PRO 45 N 1.56 3.58 0.31 4.92 0.04 -1.26 -4.88 135.00 139.27 3m79 s PRO 45 Ca 0.04 1.81 0.07 0.00 0.04 0.00 0.00 61.00 62.97 3m79 s PRO 45 Cb -0.16 -2.30 0.82 0.00 0.04 0.00 0.00 34.50 32.89 3m79 s PRO 45 CO 0.04 -0.71 1.72 -1.35 0.04 0.00 0.00 177.00 176.74 3m79 h PRO 46 N 1.79 0.53 0.00 0.56 0.11 -1.99 -0.26 132.00 132.73 3m79 h PRO 46 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3m79 h PRO 46 Cb 1.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3m79 h PRO 46 CO 0.59 0.35 0.00 1.63 -0.21 0.00 0.00 178.00 180.36 3m79 n LYS 47 N -4.92 0.09 -0.24 1.05 5.02 -1.26 -2.40 118.16 115.50 3m79 n LYS 47 Ca 0.25 0.29 0.06 0.00 -2.02 0.00 0.00 58.31 56.89 3m79 n LYS 47 Cb 0.70 -1.65 0.17 0.00 -0.02 0.00 0.00 35.03 34.22 3m79 n LYS 47 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3m79 n LEU 48 N -1.81 3.09 0.08 -0.35 4.77 -0.14 -4.74 117.00 117.89 3m79 n LEU 48 Ca 0.03 -2.48 0.05 0.00 -0.03 0.00 0.00 56.01 53.59 3m79 n LEU 48 Cb 0.22 -0.33 0.49 0.00 -2.33 0.00 0.00 43.42 41.47 3m79 n LEU 48 CO 0.18 0.68 1.14 -0.33 -1.33 0.00 0.00 177.39 177.72 3m79 h GLU 49 N 1.46 0.37 -0.04 3.23 5.08 -1.12 -1.86 114.58 121.70 3m79 h GLU 49 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3m79 h GLU 49 Cb 0.99 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.15 3m79 h GLU 49 CO 0.08 0.25 0.00 -0.40 -1.00 0.00 0.00 179.01 177.94 3m79 n ASP 50 N -4.49 1.20 -4.91 1.42 5.75 -1.26 -4.89 116.55 109.36 3m79 n ASP 50 Ca 0.01 -1.45 -0.30 0.00 -0.01 0.00 0.00 54.79 53.05 3m79 n ASP 50 Cb 0.08 -0.02 -0.04 0.00 -1.03 0.00 0.00 41.12 40.11 3m79 n ASP 50 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3m79 s LYS 51 N -1.96 3.55 0.44 0.11 -0.14 -0.70 -5.08 119.74 115.95 3m79 s LYS 51 Ca 0.38 -0.25 -0.24 0.00 -1.36 0.00 0.00 55.97 54.50 3m79 s LYS 51 Cb 0.20 -2.87 -0.08 0.00 -1.68 0.00 0.00 37.83 33.40 3m79 s LYS 51 CO 0.32 0.46 1.23 0.45 -0.76 0.00 0.00 175.35 177.05 3m79 s SER 52 N -2.76 6.21 0.46 2.83 0.15 -1.26 -4.91 113.70 114.41 3m79 s SER 52 Ca 0.39 2.48 0.27 0.00 0.70 0.00 0.00 55.95 59.79 3m79 s SER 52 Cb -0.12 -2.62 1.49 0.00 -1.71 0.00 0.00 66.02 63.06 3m79 s SER 52 CO 0.27 -0.90 1.82 -0.65 1.20 0.00 0.00 173.24 174.98 3m79 h PRO 53 N 2.34 0.00 -0.45 5.44 0.11 -1.98 -0.98 132.00 136.48 3m79 h PRO 53 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3m79 h PRO 53 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3m79 h PRO 53 CO 0.61 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.93 3m79 n ASP 54 N -2.52 3.36 -4.74 -2.05 2.03 -1.26 -4.58 116.55 106.78 3m79 n ASP 54 Ca -0.02 -1.95 -0.33 0.00 0.52 0.00 0.00 54.79 53.01 3m79 n ASP 54 Cb 0.14 -0.30 0.08 0.00 -0.72 0.00 0.00 41.12 40.33 3m79 n ASP 54 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 3m79 s SER 55 N -1.17 4.41 0.40 1.67 1.04 -0.37 -4.83 113.70 114.85 3m79 s SER 55 Ca 0.36 2.14 0.11 0.00 0.48 0.00 0.00 55.95 59.04 3m79 s SER 55 Cb 0.20 -2.56 0.91 0.00 0.10 0.00 0.00 66.02 64.67 3m79 s SER 55 CO 0.27 -2.10 1.94 -0.65 0.98 0.00 0.00 173.24 173.67 3m79 h PRO 56 N -0.47 0.55 -0.18 4.02 0.11 -1.95 -1.62 132.00 132.46 3m79 h PRO 56 Ca -0.46 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3m79 h PRO 56 Cb 1.27 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3m79 h PRO 56 CO 0.50 0.36 0.05 0.93 -0.21 0.00 0.00 178.00 179.64 3m79 h GLU 57 N 0.56 0.27 -0.34 1.05 3.07 -1.92 -1.20 114.58 116.08 3m79 h GLU 57 Ca 0.35 -0.06 -0.10 0.00 -0.50 0.00 0.00 59.36 59.05 3m79 h GLU 57 Cb 0.58 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 3m79 h GLU 57 CO -0.12 0.39 -0.20 0.52 -1.40 0.00 0.00 179.01 178.20 3m79 h MET 58 N 0.11 0.64 -0.36 2.33 2.86 -1.69 0.20 114.93 119.02 3m79 h MET 58 Ca 0.06 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 3m79 h MET 58 Cb 0.23 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 3m79 h MET 58 CO -0.00 0.80 0.15 0.45 1.06 0.00 0.00 176.91 179.36 3m79 h HIS 59 N 0.57 0.55 -0.77 -0.22 3.86 -1.29 -0.99 115.15 116.86 3m79 h HIS 59 Ca 0.09 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.21 3m79 h HIS 59 Cb 0.65 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 3m79 h HIS 59 CO 0.03 0.50 0.30 0.22 0.86 0.00 0.00 177.93 179.83 3m79 h ASP 60 N 0.44 1.07 0.03 2.45 3.58 -0.88 0.06 116.42 123.18 3m79 h ASP 60 Ca 0.12 -0.17 -0.00 0.00 0.42 0.00 0.00 57.03 57.40 3m79 h ASP 60 Cb 0.18 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.95 3m79 h ASP 60 CO -0.01 0.96 -0.01 0.15 -2.88 0.00 0.00 179.24 177.44 3m79 h PHE 61 N 1.13 -0.03 -0.41 0.28 3.57 -0.45 -2.46 116.94 118.56 3m79 h PHE 61 Ca 0.26 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 3m79 h PHE 61 Cb 0.23 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 3m79 h PHE 61 CO 0.02 0.04 0.06 0.00 -2.23 0.00 0.00 178.31 176.21 3m79 h ARG 62 N -0.10 0.62 -0.90 1.11 3.08 -1.02 -2.81 114.38 114.36 3m79 h ARG 62 Ca -0.00 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 59.95 3m79 h ARG 62 Cb 0.09 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 29.99 3m79 h ARG 62 CO 0.01 0.60 0.59 1.25 -1.07 0.00 0.00 179.97 181.35 3m79 h HIS 63 N 0.60 1.11 -0.73 3.04 2.76 -0.70 -1.95 115.15 119.28 3m79 h HIS 63 Ca 0.13 0.03 0.09 0.00 -2.20 0.00 0.00 60.37 58.42 3m79 h HIS 63 Cb 0.29 -0.37 -0.05 0.00 1.55 0.00 0.00 27.41 28.83 3m79 h HIS 63 CO 0.01 0.66 0.48 0.78 -1.30 0.00 0.00 177.93 178.56 3m79 h GLY 64 N 1.16 0.92 1.36 5.26 0.00 -1.17 -1.99 103.07 108.60 3m79 h GLY 64 Ca 0.35 -0.27 -0.16 0.00 0.00 0.00 0.00 47.33 47.25 3m79 h GLY 64 CO -0.11 0.17 -0.51 0.74 0.00 0.00 0.00 176.54 176.83 3m79 h PHE 65 N 0.66 0.85 -0.49 5.60 0.05 -1.38 -1.69 116.94 120.54 3m79 h PHE 65 Ca 0.33 -0.29 0.02 0.00 3.82 0.00 0.00 57.97 61.85 3m79 h PHE 65 Cb 0.42 -0.16 -0.03 0.00 2.00 0.00 0.00 35.95 38.18 3m79 h PHE 65 CO -0.00 1.05 0.30 2.35 -0.18 0.00 0.00 178.31 181.83 3m79 h TRP 66 N 0.53 0.57 -0.07 -0.55 2.91 -0.94 0.34 115.95 118.75 3m79 h TRP 66 Ca 0.02 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.06 3m79 h TRP 66 Cb 1.07 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.53 3m79 h TRP 66 CO 0.05 0.34 0.01 0.82 -1.03 0.00 0.00 178.44 178.63 3m79 h ILE 67 N 0.61 0.97 -0.23 2.65 1.08 -1.32 0.30 117.51 121.57 3m79 h ILE 67 Ca 0.19 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.68 3m79 h ILE 67 Cb -0.02 0.93 -0.03 0.00 -3.07 0.00 0.00 36.82 34.63 3m79 h ILE 67 CO -0.07 0.01 0.03 0.25 -0.69 0.00 0.00 178.15 177.68 3m79 h LEU 68 N 0.04 -0.03 -0.57 1.44 5.85 -1.15 -1.38 115.31 119.51 3m79 h LEU 68 Ca 0.03 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.86 3m79 h LEU 68 Cb 0.03 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 3m79 h LEU 68 CO -0.04 0.02 0.27 0.40 -0.34 0.00 0.00 178.44 178.74 3m79 h ILE 69 N 0.11 0.89 -0.53 4.05 2.04 -0.64 0.09 117.51 123.52 3m79 h ILE 69 Ca 0.11 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.80 3m79 h ILE 69 Cb 0.12 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 3m79 h ILE 69 CO -0.16 0.09 0.35 1.23 0.00 0.00 0.00 178.15 179.66 3m79 h GLY 70 N 0.50 0.75 1.31 5.37 0.00 -0.64 -1.51 103.07 108.84 3m79 h GLY 70 Ca 0.27 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 3m79 h GLY 70 CO -0.22 0.26 -0.20 1.46 0.00 0.00 0.00 176.54 177.85 3m79 h GLN 71 N 0.71 0.80 -0.45 4.80 4.20 -0.83 -2.14 115.11 122.19 3m79 h GLN 71 Ca 0.20 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 3m79 h GLN 71 Cb -0.07 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 3m79 h GLN 71 CO -0.05 0.94 0.15 0.82 -0.67 0.00 0.00 178.83 180.02 3m79 h ILE 72 N 0.70 1.22 -0.32 2.54 2.04 -0.80 -1.57 117.51 121.32 3m79 h ILE 72 Ca 0.10 -0.71 0.06 0.00 1.00 0.00 0.00 64.86 65.31 3m79 h ILE 72 Cb 0.71 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.57 3m79 h ILE 72 CO 0.05 0.26 -0.03 -0.74 0.00 0.00 0.00 178.15 177.69 3m79 h HIS 73 N 0.59 -0.08 -0.33 1.37 2.76 -1.15 -0.02 115.15 118.29 3m79 h HIS 73 Ca 0.15 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.31 3m79 h HIS 73 Cb 0.24 0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 3m79 h HIS 73 CO 0.01 -0.09 0.06 0.22 -1.30 0.00 0.00 177.93 176.83 3m79 h ASP 74 N 0.06 0.52 -0.97 3.26 3.58 -1.29 -2.49 116.42 119.08 3m79 h ASP 74 Ca 0.16 -0.25 0.08 0.00 0.42 0.00 0.00 57.03 57.44 3m79 h ASP 74 Cb 0.22 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.07 3m79 h ASP 74 CO -0.29 0.63 0.63 0.00 -2.88 0.00 0.00 179.24 177.33 3m79 h ALA 75 N 0.90 1.47 -0.61 -0.78 0.00 -1.06 -2.24 119.26 116.95 3m79 h ALA 75 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3m79 h ALA 75 Cb 0.33 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3m79 h ALA 75 CO 0.00 0.36 0.04 1.25 0.00 0.00 0.00 179.25 180.90 3m79 h LEU 76 N 1.08 1.00 -0.46 0.00 5.85 -0.80 -1.20 115.31 120.79 3m79 h LEU 76 Ca 0.44 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.94 3m79 h LEU 76 Cb 0.26 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 3m79 h LEU 76 CO -0.19 1.03 0.21 0.45 -0.34 0.00 0.00 178.44 179.60 3m79 h HIS 77 N 0.96 0.37 -0.70 1.25 3.86 -0.96 0.77 115.15 120.71 3m79 h HIS 77 Ca 0.18 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 3m79 h HIS 77 Cb 0.49 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.83 3m79 h HIS 77 CO 0.03 0.17 0.46 -0.07 0.86 0.00 0.00 177.93 179.38 3m79 h LEU 78 N 0.41 0.80 -0.85 2.43 3.38 -1.15 -1.42 115.31 118.90 3m79 h LEU 78 Ca 0.21 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 3m79 h LEU 78 Cb 0.15 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3m79 h LEU 78 CO -0.17 0.58 0.29 0.00 0.09 0.00 0.00 178.44 179.23 3m79 h ALA 79 N 1.25 1.08 -0.05 1.53 0.00 -0.92 -1.57 119.26 120.59 3m79 h ALA 79 Ca 0.25 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3m79 h ALA 79 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3m79 h ALA 79 CO -0.05 0.65 -0.20 -0.91 0.00 0.00 0.00 179.25 178.73 3m79 h ASN 80 N 1.10 0.08 0.39 0.00 2.35 -0.37 -0.91 115.58 118.22 3m79 h ASN 80 Ca 0.25 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3m79 h ASN 80 Cb 0.23 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.58 3m79 h ASN 80 CO -0.02 0.29 0.00 -0.62 -1.65 0.00 0.00 177.43 175.43 3m79 n GLU 81 N -4.26 0.50 -0.85 0.81 1.02 -0.58 -4.89 120.64 112.38 3m79 n GLU 81 Ca -0.02 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3m79 n GLU 81 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 3m79 n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m79 n GLY 82 N 0.94 0.57 3.28 0.62 0.00 -0.34 -4.97 105.19 105.29 3m79 n GLY 82 Ca 0.15 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 3m79 n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3m79 n LYS 83 N -2.85 3.30 0.22 1.61 5.02 -0.62 -4.84 118.16 120.00 3m79 n LYS 83 Ca 0.00 -3.45 -0.15 0.00 -2.02 0.00 0.00 58.31 52.69 3m79 n LYS 83 Cb 0.00 -3.19 -0.08 0.00 -0.02 0.00 0.00 35.03 31.74 3m79 n LYS 83 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3m79 h VAL 84 N 4.64 0.64 -0.76 -0.18 2.07 -1.89 -0.33 116.25 120.45 3m79 h VAL 84 Ca 0.41 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.87 3m79 h VAL 84 Cb 0.79 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3m79 h VAL 84 CO 1.47 0.01 0.38 0.07 0.02 0.00 0.00 177.57 179.52 3m79 h LYS 85 N -0.51 1.08 -0.62 1.57 2.10 -1.97 0.80 116.57 119.01 3m79 h LYS 85 Ca -0.05 -0.14 -0.03 0.00 -2.00 0.00 0.00 60.65 58.43 3m79 h LYS 85 Cb 0.39 -0.20 -0.03 0.00 -0.90 0.00 0.00 32.23 31.49 3m79 h LYS 85 CO 0.08 0.83 0.29 0.93 -2.00 0.00 0.00 179.45 179.58 3m79 h GLU 86 N 1.08 0.90 -0.40 0.07 3.07 -1.91 -0.25 114.58 117.14 3m79 h GLU 86 Ca 0.27 -0.14 -0.14 0.00 -0.50 0.00 0.00 59.36 58.85 3m79 h GLU 86 Cb 0.09 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 3m79 h GLU 86 CO -0.04 0.73 -0.31 0.00 -1.40 0.00 0.00 179.01 178.00 3m79 h ALA 87 N 1.12 0.70 -0.58 3.43 0.00 -0.52 -0.66 119.26 122.76 3m79 h ALA 87 Ca 0.21 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3m79 h ALA 87 Cb 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3m79 h ALA 87 CO -0.02 0.67 0.21 1.96 0.00 0.00 0.00 179.25 182.06 3m79 h GLN 88 N 0.74 0.89 -0.70 0.00 4.20 -0.71 0.07 115.11 119.60 3m79 h GLN 88 Ca 0.08 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3m79 h GLN 88 Cb 0.87 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 3m79 h GLN 88 CO 0.08 0.78 0.45 0.00 -0.67 0.00 0.00 178.83 179.47 3m79 h ALA 89 N 1.06 0.89 -0.80 3.87 0.00 -0.90 -0.80 119.26 122.59 3m79 h ALA 89 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3m79 h ALA 89 Cb 0.25 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3m79 h ALA 89 CO -0.01 0.33 0.51 0.00 0.00 0.00 0.00 179.25 180.08 3m79 h ALA 90 N 1.24 1.01 -0.39 0.00 0.00 -0.79 -1.87 119.26 118.47 3m79 h ALA 90 Ca 0.25 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3m79 h ALA 90 Cb -0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 3m79 h ALA 90 CO -0.05 0.45 -0.10 0.00 0.00 0.00 0.00 179.25 179.55 3m79 h ALA 91 N 1.28 1.10 -0.81 0.00 0.00 -0.61 -2.40 119.26 117.83 3m79 h ALA 91 Ca 0.29 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3m79 h ALA 91 Cb -0.09 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3m79 h ALA 91 CO -0.06 0.56 0.37 1.49 0.00 0.00 0.00 179.25 181.61 3m79 h GLU 92 N 0.62 1.17 0.00 0.00 4.57 -0.77 -2.35 114.58 117.82 3m79 h GLU 92 Ca 0.11 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.09 3m79 h GLU 92 Cb 0.53 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 3m79 h GLU 92 CO 0.03 0.91 -0.08 1.96 -1.18 0.00 0.00 179.01 180.66 3m79 h GLN 93 N 1.15 0.00 -0.27 1.92 4.20 -0.88 -2.11 115.11 119.13 3m79 h GLN 93 Ca 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.98 3m79 h GLN 93 Cb 0.14 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3m79 h GLN 93 CO -0.03 0.08 0.17 -0.07 -0.67 0.00 0.00 178.83 178.30 3m79 h LEU 94 N 0.00 0.31 -1.30 1.46 3.38 -0.95 -2.89 115.31 115.32 3m79 h LEU 94 Ca -0.00 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.07 3m79 h LEU 94 Cb 0.32 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 3m79 h LEU 94 CO 0.01 0.24 0.55 0.11 0.09 0.00 0.00 178.44 179.44 3m79 h LYS 95 N 0.37 0.73 -0.75 1.13 1.57 -1.45 0.07 116.57 118.24 3m79 h LYS 95 Ca 0.10 -0.04 0.14 0.00 -1.87 0.00 0.00 60.65 58.98 3m79 h LYS 95 Cb -0.02 -0.16 -0.14 0.00 0.08 0.00 0.00 32.23 31.99 3m79 h LYS 95 CO -0.02 0.48 -0.26 0.00 -0.57 0.00 0.00 179.45 179.08 3m79 h THR 97 N -0.05 1.37 -0.14 0.00 2.02 -1.17 -1.70 112.91 113.24 3m79 h THR 97 Ca 0.33 -1.35 0.05 0.00 0.77 0.00 0.00 66.41 66.20 3m79 h THR 97 Cb 0.57 2.01 -0.07 0.00 -1.74 0.00 0.00 68.15 68.92 3m79 h THR 97 CO -0.79 0.39 -0.34 0.00 0.37 0.00 0.00 175.52 175.15 3m79 h ASN 99 N -0.40 1.11 -0.50 0.00 -0.26 -0.64 -1.93 115.58 112.95 3m79 h ASN 99 Ca 0.10 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.70 3m79 h ASN 99 Cb 0.56 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.51 3m79 h ASN 99 CO -0.37 0.92 0.23 0.00 -1.06 0.00 0.00 177.43 177.15 3m79 h ALA 100 N 1.25 0.64 -0.24 -0.83 0.00 -1.15 -1.36 119.26 117.58 3m79 h ALA 100 Ca 0.30 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3m79 h ALA 100 Cb 0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3m79 h ALA 100 CO -0.04 0.22 -0.18 0.00 0.00 0.00 0.00 179.25 179.24 3m79 h HIS 102 N 0.25 0.54 -0.36 0.00 -0.00 -1.29 0.11 115.15 114.41 3m79 h HIS 102 Ca 0.04 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.46 3m79 h HIS 102 Cb 0.72 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.95 3m79 h HIS 102 CO 0.07 0.26 0.24 0.37 -0.00 0.00 0.00 177.93 178.87 3m79 h GLN 103 N 0.56 0.40 0.17 2.45 4.15 -1.25 -0.73 115.11 120.86 3m79 h GLN 103 Ca 0.26 -0.02 -0.32 0.00 0.77 0.00 0.00 58.65 59.33 3m79 h GLN 103 Cb 0.17 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 27.77 3m79 h GLN 103 CO -0.18 0.26 -1.59 0.87 -1.93 0.00 0.00 178.83 176.27 3m79 h LYS 104 N 0.41 0.35 0.00 1.69 1.57 -1.36 -3.43 116.57 115.80 3m79 h LYS 104 Ca 0.14 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3m79 h LYS 104 Cb 0.06 0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3m79 h LYS 104 CO -0.03 1.29 0.00 0.66 -0.57 0.00 0.00 179.45 180.80 3m79 n TYR 105 N -3.73 0.00 1.71 -1.35 4.02 0.35 -5.12 117.16 113.04 3m79 n TYR 105 Ca -0.24 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 57.80 3m79 n TYR 105 Cb 1.01 0.00 0.70 0.00 -0.02 0.00 0.00 39.34 41.03 3m79 n TYR 105 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72