#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 4.92 0.16 0.00 1.47 -1.26 -4.82 116.67 117.14 3m79 s ASP 2 Ca 0.00 0.96 -0.17 0.00 1.18 0.00 0.00 52.55 54.52 3m79 s ASP 2 Cb 0.00 -1.59 0.08 0.00 -0.34 0.00 0.00 42.92 41.07 3m79 s ASP 2 CO 0.00 -1.66 1.71 0.25 0.68 0.00 0.00 175.17 176.15 3m79 h LEU 3 N -0.88 -0.12 -0.55 2.11 5.85 -1.95 -1.78 115.31 117.98 3m79 h LEU 3 Ca -0.46 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.39 3m79 h LEU 3 Cb 1.29 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.42 3m79 h LEU 3 CO 0.65 -0.03 0.29 -0.08 -0.34 0.00 0.00 178.44 178.93 3m79 h GLU 4 N 0.11 0.55 -0.59 1.25 4.81 -1.99 0.56 114.58 119.29 3m79 h GLU 4 Ca 0.18 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3m79 h GLU 4 Cb 0.24 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 3m79 h GLU 4 CO -0.29 0.36 0.23 -0.44 -0.73 0.00 0.00 179.01 178.15 3m79 h ASP 5 N 0.56 0.81 -0.92 1.04 3.32 -1.84 -0.69 116.42 118.70 3m79 h ASP 5 Ca 0.24 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3m79 h ASP 5 Cb 0.13 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.43 3m79 h ASP 5 CO -0.16 0.76 0.59 0.78 -1.72 0.00 0.00 179.24 179.50 3m79 h ASN 6 N 0.81 1.08 -0.57 6.45 2.35 -0.94 -1.76 115.58 122.99 3m79 h ASN 6 Ca 0.19 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.84 3m79 h ASN 6 Cb 0.21 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 3m79 h ASN 6 CO -0.02 0.80 0.15 0.24 -1.65 0.00 0.00 177.43 176.95 3m79 h MET 7 N 1.26 0.94 -0.36 0.81 2.86 -0.52 -1.34 114.93 118.57 3m79 h MET 7 Ca 0.33 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.76 3m79 h MET 7 Cb -0.11 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 3m79 h MET 7 CO -0.07 0.84 0.16 0.93 1.06 0.00 0.00 176.91 179.83 3m79 h GLU 8 N 0.90 0.53 -0.22 1.72 4.39 -0.82 -0.83 114.58 120.26 3m79 h GLU 8 Ca 0.20 -0.09 -0.11 0.00 0.34 0.00 0.00 59.36 59.69 3m79 h GLU 8 Cb 0.32 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 3m79 h GLU 8 CO -0.00 0.50 -0.35 1.79 -1.16 0.00 0.00 179.01 179.79 3m79 h THR 9 N 0.44 1.29 -0.15 1.13 1.35 -1.15 0.13 112.91 115.95 3m79 h THR 9 Ca 0.12 -1.45 0.02 0.00 -0.55 0.00 0.00 66.41 64.55 3m79 h THR 9 Cb 0.15 1.51 -0.02 0.00 -1.73 0.00 0.00 68.15 68.06 3m79 h THR 9 CO -0.01 0.45 0.02 -0.07 -0.25 0.00 0.00 175.52 175.66 3m79 h LEU 10 N 0.39 -0.01 -0.16 3.87 3.38 -1.09 -1.77 115.31 119.93 3m79 h LEU 10 Ca 0.04 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3m79 h LEU 10 Cb 0.80 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3m79 h LEU 10 CO 0.06 0.02 -0.00 -1.13 0.09 0.00 0.00 178.44 177.48 3m79 h ASN 11 N 0.08 0.28 -0.52 -0.43 -1.24 -0.84 -1.29 115.58 111.61 3m79 h ASN 11 Ca 0.07 -0.32 0.07 0.00 0.71 0.00 0.00 56.30 56.83 3m79 h ASN 11 Cb 0.06 -0.07 -0.06 0.00 0.73 0.00 0.00 38.32 38.98 3m79 h ASN 11 CO -0.09 0.53 0.20 0.44 -1.29 0.00 0.00 177.43 177.22 3m79 h ASP 12 N 0.02 0.23 0.96 1.15 5.19 -0.77 -2.49 116.42 120.70 3m79 h ASP 12 Ca 0.04 0.06 -0.15 0.00 -0.62 0.00 0.00 57.03 56.37 3m79 h ASP 12 Cb 0.39 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.91 3m79 h ASP 12 CO 0.01 0.15 -0.69 0.78 -3.12 0.00 0.00 179.24 176.37 3m79 h ASN 13 N 0.39 0.00 -0.70 6.45 4.21 -1.27 -2.25 115.58 122.42 3m79 h ASN 13 Ca 0.25 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.74 3m79 h ASN 13 Cb 0.26 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.42 3m79 h ASN 13 CO -0.24 0.69 0.37 0.25 -1.29 0.00 0.00 177.43 177.22 3m79 h LEU 14 N 0.00 0.88 -0.87 1.61 5.85 -1.07 -1.69 115.31 120.01 3m79 h LEU 14 Ca -0.01 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 3m79 h LEU 14 Cb 1.36 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 3m79 h LEU 14 CO 0.09 0.73 0.22 0.11 -0.34 0.00 0.00 178.44 179.26 3m79 h LYS 15 N 0.96 1.06 -0.45 1.25 1.57 -1.30 -1.85 116.57 117.80 3m79 h LYS 15 Ca 0.24 -0.21 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3m79 h LYS 15 Cb 0.06 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.16 3m79 h LYS 15 CO -0.04 0.90 0.21 0.28 -0.57 0.00 0.00 179.45 180.23 3m79 h VAL 16 N 1.02 0.95 -0.34 0.50 2.07 -1.12 -2.27 116.25 117.05 3m79 h VAL 16 Ca 0.23 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 3m79 h VAL 16 Cb 0.27 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 3m79 h VAL 16 CO -0.01 0.08 0.21 0.40 0.02 0.00 0.00 177.57 178.27 3m79 h ILE 17 N 0.43 1.11 -0.88 4.57 2.04 -1.00 -1.29 117.51 122.49 3m79 h ILE 17 Ca 0.20 -0.25 0.14 0.00 1.00 0.00 0.00 64.86 65.95 3m79 h ILE 17 Cb 0.12 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 3m79 h ILE 17 CO -0.15 0.11 0.57 -0.33 0.00 0.00 0.00 178.15 178.35 3m79 h GLU 18 N 0.45 0.67 -0.28 2.37 5.08 -1.07 -2.61 114.58 119.19 3m79 h GLU 18 Ca 0.12 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3m79 h GLU 18 Cb -0.01 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.09 3m79 h GLU 18 CO -0.02 0.44 0.00 1.63 -1.00 0.00 0.00 179.01 180.06 3m79 n LYS 19 N -4.55 2.34 -2.11 2.33 5.02 -0.88 -5.01 118.16 115.30 3m79 n LYS 19 Ca 0.17 -2.13 -0.38 0.00 -2.02 0.00 0.00 58.31 53.96 3m79 n LYS 19 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 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 -1.53 2.98 -0.05 7.82 0.00 -0.51 -4.97 121.76 125.50 3m79 s ALA 20 Ca 0.34 1.08 0.18 0.00 0.00 0.00 0.00 51.96 53.55 3m79 s ALA 20 Cb 0.21 -3.44 -0.27 0.00 0.00 0.00 0.00 23.12 19.61 3m79 s ALA 20 CO 0.29 -0.86 0.34 -0.25 0.00 0.00 0.00 175.76 175.29 3m79 n ASP 21 N -0.51 0.84 -4.13 0.00 8.00 -1.26 -5.05 116.55 114.44 3m79 n ASP 21 Ca 0.07 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.48 3m79 n ASP 21 Cb 0.47 1.68 -0.10 0.00 -0.02 0.00 0.00 41.12 43.15 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 -4.25 0.25 0.24 -2.24 2.20 -1.26 -5.06 114.94 104.81 3m79 s ASN 22 Ca -0.07 -1.18 -0.05 0.00 -0.94 0.00 0.00 52.86 50.62 3m79 s ASN 22 Cb 0.11 0.33 0.26 0.00 -2.00 0.00 0.00 41.25 39.95 3m79 s ASN 22 CO 0.75 -0.77 1.79 0.00 -2.94 0.00 0.00 177.10 175.93 3m79 h ALA 23 N 2.79 1.11 -0.84 3.54 0.00 -1.90 -2.89 119.26 121.07 3m79 h ALA 23 Ca -0.35 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.40 3m79 h ALA 23 Cb 1.21 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 3m79 h ALA 23 CO 0.57 0.61 0.53 0.00 0.00 0.00 0.00 179.25 180.96 3m79 h ALA 24 N 1.24 1.12 -0.46 0.00 0.00 -1.97 0.16 119.26 119.34 3m79 h ALA 24 Ca 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3m79 h ALA 24 Cb 0.27 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3m79 h ALA 24 CO -0.01 0.34 0.25 1.96 0.00 0.00 0.00 179.25 181.80 3m79 h GLN 25 N 1.02 0.64 -0.37 0.00 4.20 -1.95 -1.88 115.11 116.77 3m79 h GLN 25 Ca 0.34 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.93 3m79 h GLN 25 Cb 0.05 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3m79 h GLN 25 CO -0.13 0.51 0.04 0.28 -0.67 0.00 0.00 178.83 178.85 3m79 h VAL 26 N 0.61 1.25 -0.21 -0.54 2.07 -1.27 -2.36 116.25 115.79 3m79 h VAL 26 Ca 0.16 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.80 3m79 h VAL 26 Cb 0.05 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 3m79 h VAL 26 CO -0.03 0.31 0.06 0.11 0.02 0.00 0.00 177.57 178.04 3m79 h LYS 27 N 0.47 0.15 -0.38 1.57 1.57 -0.61 -0.77 116.57 118.57 3m79 h LYS 27 Ca 0.11 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 3m79 h LYS 27 Cb 0.40 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 3m79 h LYS 27 CO 0.01 0.10 0.13 0.22 -0.57 0.00 0.00 179.45 179.34 3m79 h ASP 28 N 0.15 0.14 -0.46 0.86 1.82 -1.36 -1.48 116.42 116.10 3m79 h ASP 28 Ca 0.09 0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.74 3m79 h ASP 28 Cb 0.07 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.09 3m79 h ASP 28 CO -0.11 0.12 0.15 0.00 -1.61 0.00 0.00 179.24 177.79 3m79 h ALA 29 N 1.24 0.60 -0.44 -0.78 0.00 -1.14 -2.27 119.26 116.46 3m79 h ALA 29 Ca 0.17 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3m79 h ALA 29 Cb 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3m79 h ALA 29 CO -0.17 0.24 -0.12 -0.07 0.00 0.00 0.00 179.25 179.12 3m79 h LEU 30 N 0.60 0.80 -0.54 0.00 3.38 -1.03 -1.44 115.31 117.07 3m79 h LEU 30 Ca 0.15 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.90 3m79 h LEU 30 Cb 0.25 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3m79 h LEU 30 CO -0.01 0.93 0.33 0.74 0.09 0.00 0.00 178.44 180.53 3m79 h THR 31 N 0.73 1.07 -0.47 0.22 2.02 -1.16 0.66 112.91 115.98 3m79 h THR 31 Ca 0.12 -0.23 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 3m79 h THR 31 Cb 0.61 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 3m79 h THR 31 CO 0.04 0.12 -0.10 0.11 0.37 0.00 0.00 175.52 176.06 3m79 h LYS 32 N 0.66 0.89 -0.61 6.66 1.57 -1.14 -2.52 116.57 122.08 3m79 h LYS 32 Ca 0.22 -0.33 0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3m79 h LYS 32 Cb 0.01 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 3m79 h LYS 32 CO -0.09 0.98 0.38 0.52 -0.57 0.00 0.00 179.45 180.67 3m79 h MET 33 N 0.74 0.75 -0.50 3.15 2.86 -1.08 -1.66 114.93 119.18 3m79 h MET 33 Ca 0.12 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.79 3m79 h MET 33 Cb 0.64 -0.17 -0.06 0.00 0.06 0.00 0.00 31.60 32.07 3m79 h MET 33 CO 0.04 0.49 0.13 0.00 1.06 0.00 0.00 176.91 178.64 3m79 h ALA 34 N 1.25 0.58 -0.57 6.32 0.00 -0.71 0.08 119.26 126.21 3m79 h ALA 34 Ca 0.24 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 3m79 h ALA 34 Cb -0.02 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3m79 h ALA 34 CO -0.08 -0.27 0.20 0.00 0.00 0.00 0.00 179.25 179.10 3m79 h ALA 35 N 1.36 0.75 -0.32 0.00 0.00 -1.20 -1.85 119.26 118.00 3m79 h ALA 35 Ca 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3m79 h ALA 35 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3m79 h ALA 35 CO -0.29 0.38 0.09 0.00 0.00 0.00 0.00 179.25 179.44 3m79 h ALA 36 N 1.06 0.42 -0.51 0.00 0.00 -0.92 -1.34 119.26 117.97 3m79 h ALA 36 Ca 0.19 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3m79 h ALA 36 Cb 0.24 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3m79 h ALA 36 CO -0.01 0.06 0.31 0.00 0.00 0.00 0.00 179.25 179.61 3m79 h ALA 37 N 0.93 0.65 -0.76 0.00 0.00 -0.96 -1.04 119.26 118.07 3m79 h ALA 37 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3m79 h ALA 37 Cb 0.26 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3m79 h ALA 37 CO -0.00 0.03 0.39 0.00 0.00 0.00 0.00 179.25 179.67 3m79 h ALA 38 N 1.21 0.98 0.00 0.00 0.00 -1.24 -2.66 119.26 117.56 3m79 h ALA 38 Ca 0.20 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 3m79 h ALA 38 Cb -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3m79 h ALA 38 CO -0.08 0.52 -0.37 0.22 0.00 0.00 0.00 179.25 179.55 3m79 h ASP 39 N 1.07 0.00 1.35 0.00 3.58 -0.95 -2.90 116.42 118.55 3m79 h ASP 39 Ca 0.27 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.72 3m79 h ASP 39 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 3m79 h ASP 39 CO -0.04 0.37 0.00 0.00 -2.88 0.00 0.00 179.24 176.69 3m79 n ALA 40 N -2.32 2.20 -0.27 -0.78 0.00 -0.42 -4.33 120.51 114.59 3m79 n ALA 40 Ca -0.01 -0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.46 3m79 n ALA 40 Cb 0.48 -1.46 0.14 0.00 0.00 0.00 0.00 19.45 18.61 3m79 n ALA 40 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 3m79 h TRP 41 N 0.00 -0.25 -0.14 0.00 2.91 -1.30 -1.78 115.95 115.39 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 0.67 0.23 0.00 0.00 -0.51 0.00 0.00 29.16 29.56 3m79 h TRP 41 CO 0.00 -0.31 0.00 -1.13 -1.03 0.00 0.00 178.44 175.97 3m79 n SER 42 N -5.45 2.02 -4.79 2.65 3.41 -1.26 -4.84 113.62 105.37 3m79 n SER 42 Ca 0.13 -1.72 -0.35 0.00 -0.26 0.00 0.00 58.87 56.67 3m79 n SER 42 Cb 0.46 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 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 -1.83 2.89 -0.27 7.33 0.00 -0.67 -5.04 121.76 124.17 3m79 s ALA 43 Ca 0.34 0.70 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 3m79 s ALA 43 Cb 0.19 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.01 3m79 s ALA 43 CO 0.29 -0.41 0.08 0.99 0.00 0.00 0.00 175.76 176.71 3m79 s THR 44 N -1.83 4.24 0.51 0.00 2.01 -1.26 -5.02 115.64 114.28 3m79 s THR 44 Ca 0.66 -0.37 -0.21 0.00 0.31 0.00 0.00 61.69 62.09 3m79 s THR 44 Cb -0.20 -3.07 -0.07 0.00 0.01 0.00 0.00 72.50 69.17 3m79 s THR 44 CO 0.24 0.22 1.12 -2.16 -0.69 0.00 0.00 174.62 173.36 3m79 s PRO 45 N 1.58 3.55 0.29 4.92 0.04 -1.26 -4.87 135.00 139.24 3m79 s PRO 45 Ca 0.05 1.62 0.03 0.00 0.04 0.00 0.00 61.00 62.74 3m79 s PRO 45 Cb -0.16 -2.14 0.69 0.00 0.04 0.00 0.00 34.50 32.93 3m79 s PRO 45 CO 0.04 -0.69 1.72 -1.35 0.04 0.00 0.00 177.00 176.75 3m79 h PRO 46 N 1.51 0.47 0.00 0.56 0.11 -1.99 0.02 132.00 132.68 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 1.25 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3m79 h PRO 46 CO 0.58 0.31 0.00 1.63 -0.21 0.00 0.00 178.00 180.31 3m79 n LYS 47 N -4.98 0.12 -0.18 1.05 5.02 -1.26 -2.29 118.16 115.64 3m79 n LYS 47 Ca 0.21 0.37 0.06 0.00 -2.02 0.00 0.00 58.31 56.93 3m79 n LYS 47 Cb 0.60 -1.74 0.14 0.00 -0.02 0.00 0.00 35.03 34.01 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 -1.98 2.85 -0.17 -0.35 4.77 -0.04 -4.74 117.00 117.35 3m79 n LEU 48 Ca 0.02 -2.46 0.10 0.00 -0.03 0.00 0.00 56.01 53.65 3m79 n LEU 48 Cb 0.20 -0.29 0.42 0.00 -2.33 0.00 0.00 43.42 41.41 3m79 n LEU 48 CO 0.17 0.66 1.21 -0.33 -1.33 0.00 0.00 177.39 177.76 3m79 h GLU 49 N 1.12 0.58 -0.00 3.23 5.08 -1.07 -1.87 114.58 121.65 3m79 h GLU 49 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3m79 h GLU 49 Cb 0.91 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3m79 h GLU 49 CO 0.06 0.39 -0.07 -0.40 -1.00 0.00 0.00 179.01 177.99 3m79 n ASP 50 N -4.49 0.33 -4.93 1.42 5.75 -1.26 -4.89 116.55 108.48 3m79 n ASP 50 Ca 0.12 -0.54 -0.28 0.00 -0.01 0.00 0.00 54.79 54.09 3m79 n ASP 50 Cb 0.36 -0.12 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 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 -2.43 3.48 0.48 0.11 1.02 -0.70 -5.09 119.74 116.61 3m79 s LYS 51 Ca 0.31 -0.44 -0.23 0.00 0.02 0.00 0.00 55.97 55.64 3m79 s LYS 51 Cb 0.20 -2.93 -0.07 0.00 -0.52 0.00 0.00 37.83 34.52 3m79 s LYS 51 CO 0.46 0.49 1.25 0.45 -0.92 0.00 0.00 175.35 177.07 3m79 s SER 52 N -3.00 5.88 0.49 2.83 0.15 -1.26 -4.91 113.70 113.88 3m79 s SER 52 Ca 0.37 2.50 0.30 0.00 0.70 0.00 0.00 55.95 59.82 3m79 s SER 52 Cb -0.11 -2.62 1.63 0.00 -1.71 0.00 0.00 66.02 63.21 3m79 s SER 52 CO 0.28 -1.13 1.90 -0.65 1.20 0.00 0.00 173.24 174.85 3m79 h PRO 53 N 1.93 0.00 -0.36 5.44 0.11 -1.98 -1.42 132.00 135.72 3m79 h PRO 53 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3m79 h PRO 53 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3m79 h PRO 53 CO 0.59 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.91 3m79 n ASP 54 N -2.61 3.01 -4.77 -2.05 2.03 -1.26 -4.58 116.55 106.32 3m79 n ASP 54 Ca -0.02 -1.91 -0.33 0.00 0.52 0.00 0.00 54.79 53.05 3m79 n ASP 54 Cb 0.13 -0.24 0.06 0.00 -0.72 0.00 0.00 41.12 40.36 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 -1.06 4.91 0.37 1.67 1.04 -0.53 -4.84 113.70 115.25 3m79 s SER 55 Ca 0.28 1.99 0.09 0.00 0.48 0.00 0.00 55.95 58.79 3m79 s SER 55 Cb 0.15 -2.55 0.84 0.00 0.10 0.00 0.00 66.02 64.56 3m79 s SER 55 CO 0.21 -1.76 1.90 -0.65 0.98 0.00 0.00 173.24 173.91 3m79 h PRO 56 N -0.22 0.65 -0.13 4.02 0.11 -1.95 -1.52 132.00 132.95 3m79 h PRO 56 Ca -0.46 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3m79 h PRO 56 Cb 1.25 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3m79 h PRO 56 CO 0.53 0.43 0.07 0.93 -0.21 0.00 0.00 178.00 179.75 3m79 h GLU 57 N 0.66 0.18 -0.40 1.05 3.07 -1.92 -0.99 114.58 116.23 3m79 h GLU 57 Ca 0.41 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 59.13 3m79 h GLU 57 Cb 0.64 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.50 3m79 h GLU 57 CO -0.17 0.21 -0.20 0.52 -1.40 0.00 0.00 179.01 177.97 3m79 h MET 58 N 0.10 0.78 -0.51 2.33 2.86 -1.67 0.34 114.93 119.16 3m79 h MET 58 Ca 0.04 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.36 3m79 h MET 58 Cb 0.08 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3m79 h MET 58 CO -0.01 0.92 0.24 0.45 1.06 0.00 0.00 176.91 179.57 3m79 h HIS 59 N 0.69 0.74 -0.53 -0.22 3.86 -1.28 -0.81 115.15 117.60 3m79 h HIS 59 Ca 0.10 -0.04 -0.10 0.00 -1.16 0.00 0.00 60.37 59.17 3m79 h HIS 59 Cb 0.70 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 3m79 h HIS 59 CO 0.04 0.58 -0.07 0.22 0.86 0.00 0.00 177.93 179.56 3m79 h ASP 60 N 0.68 0.95 -0.05 2.45 3.58 -0.85 0.27 116.42 123.45 3m79 h ASP 60 Ca 0.17 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.34 3m79 h ASP 60 Cb 0.12 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 40.91 3m79 h ASP 60 CO -0.02 1.04 0.02 0.15 -2.88 0.00 0.00 179.24 177.55 3m79 h PHE 61 N 0.87 0.04 -0.58 0.28 3.57 -0.16 -2.47 116.94 118.48 3m79 h PHE 61 Ca 0.15 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.58 3m79 h PHE 61 Cb 0.60 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 3m79 h PHE 61 CO 0.04 0.02 0.09 0.00 -2.23 0.00 0.00 178.31 176.23 3m79 h ARG 62 N 0.05 0.94 -0.91 1.11 3.08 -1.01 -2.83 114.38 114.80 3m79 h ARG 62 Ca 0.02 -0.23 0.12 0.00 0.07 0.00 0.00 59.98 59.96 3m79 h ARG 62 Cb 0.01 -0.12 -0.08 0.00 0.08 0.00 0.00 29.97 29.85 3m79 h ARG 62 CO -0.02 0.87 0.54 1.25 -1.07 0.00 0.00 179.97 181.54 3m79 h HIS 63 N 0.89 0.96 -0.96 3.04 2.76 -0.70 -1.35 115.15 119.80 3m79 h HIS 63 Ca 0.18 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.46 3m79 h HIS 63 Cb 0.39 -0.29 -0.07 0.00 1.55 0.00 0.00 27.41 28.99 3m79 h HIS 63 CO 0.02 0.35 0.62 0.78 -1.30 0.00 0.00 177.93 178.40 3m79 h GLY 64 N 0.84 1.43 1.33 5.26 0.00 -1.19 -1.71 103.07 109.03 3m79 h GLY 64 Ca 0.46 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.27 3m79 h GLY 64 CO -0.29 0.29 -0.08 0.74 0.00 0.00 0.00 176.54 177.21 3m79 h PHE 65 N 1.07 0.87 -0.30 5.60 -1.00 -1.29 -1.19 116.94 120.70 3m79 h PHE 65 Ca 0.42 -0.15 0.06 0.00 2.81 0.00 0.00 57.97 61.11 3m79 h PHE 65 Cb 0.23 -0.23 -0.06 0.00 3.61 0.00 0.00 35.95 39.51 3m79 h PHE 65 CO -0.00 0.84 -0.07 -1.49 -1.61 0.00 0.00 178.31 175.98 3m79 h TRP 66 N 0.73 -0.15 0.06 -0.55 6.55 -0.73 -0.03 115.95 121.83 3m79 h TRP 66 Ca 0.13 0.03 -0.00 0.00 0.95 0.00 0.00 58.89 59.99 3m79 h TRP 66 Cb 0.56 0.11 -0.00 0.00 -0.86 0.00 0.00 29.16 28.97 3m79 h TRP 66 CO 0.03 -0.12 -0.03 0.82 -1.05 0.00 0.00 178.44 178.08 3m79 h ILE 67 N 0.00 0.93 -0.45 1.49 1.08 -1.18 -1.75 117.51 117.63 3m79 h ILE 67 Ca 0.14 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.65 3m79 h ILE 67 Cb 0.21 0.93 -0.04 0.00 -3.07 0.00 0.00 36.82 34.85 3m79 h ILE 67 CO -0.30 0.00 0.21 0.25 -0.69 0.00 0.00 178.15 177.62 3m79 h LEU 68 N -0.09 0.30 -0.45 1.44 5.85 -0.98 -1.74 115.31 119.63 3m79 h LEU 68 Ca -0.01 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3m79 h LEU 68 Cb 0.07 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3m79 h LEU 68 CO 0.01 0.21 0.30 0.40 -0.34 0.00 0.00 178.44 179.02 3m79 h ILE 69 N 0.43 1.12 -0.76 4.05 2.04 -0.88 0.14 117.51 123.64 3m79 h ILE 69 Ca 0.20 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.87 3m79 h ILE 69 Cb 0.12 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 3m79 h ILE 69 CO -0.15 0.11 0.48 1.23 0.00 0.00 0.00 178.15 179.82 3m79 h GLY 70 N 0.61 1.10 1.12 5.37 0.00 -1.12 -1.67 103.07 108.49 3m79 h GLY 70 Ca 0.17 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 3m79 h GLY 70 CO -0.04 0.30 -0.09 1.46 0.00 0.00 0.00 176.54 178.18 3m79 h GLN 71 N 0.93 1.03 -0.33 4.80 4.20 -0.69 -2.37 115.11 122.69 3m79 h GLN 71 Ca 0.31 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 3m79 h GLN 71 Cb 0.02 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 3m79 h GLN 71 CO -0.12 1.06 0.12 0.82 -0.67 0.00 0.00 178.83 180.04 3m79 h ILE 72 N 0.92 1.19 -0.41 2.54 2.04 -0.83 -1.55 117.51 121.42 3m79 h ILE 72 Ca 0.15 -0.61 0.08 0.00 1.00 0.00 0.00 64.86 65.48 3m79 h ILE 72 Cb 0.65 0.98 -0.09 0.00 -0.74 0.00 0.00 36.82 37.62 3m79 h ILE 72 CO 0.05 0.21 -0.30 -0.74 0.00 0.00 0.00 178.15 177.37 3m79 h HIS 73 N 0.38 -0.81 -0.42 1.37 2.76 -1.23 0.19 115.15 117.38 3m79 h HIS 73 Ca 0.11 0.06 -0.12 0.00 -2.20 0.00 0.00 60.37 58.22 3m79 h HIS 73 Cb 0.21 0.42 -0.01 0.00 1.55 0.00 0.00 27.41 29.58 3m79 h HIS 73 CO 0.00 -0.36 -0.19 0.22 -1.30 0.00 0.00 177.93 176.30 3m79 h ASP 74 N -0.22 0.90 -0.73 3.26 1.82 -1.34 -2.68 116.42 117.42 3m79 h ASP 74 Ca 0.18 -0.40 0.01 0.00 -0.39 0.00 0.00 57.03 56.44 3m79 h ASP 74 Cb 0.52 -0.25 -0.04 0.00 0.68 0.00 0.00 39.33 40.25 3m79 h ASP 74 CO -0.53 1.10 0.49 0.00 -1.61 0.00 0.00 179.24 178.68 3m79 h ALA 75 N 0.83 1.50 -0.65 -0.78 0.00 -1.03 -2.37 119.26 116.76 3m79 h ALA 75 Ca 0.10 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3m79 h ALA 75 Cb 0.75 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3m79 h ALA 75 CO 0.06 0.46 0.11 1.25 0.00 0.00 0.00 179.25 181.13 3m79 h LEU 76 N 0.97 1.00 -0.47 0.00 5.85 -0.79 -1.05 115.31 120.82 3m79 h LEU 76 Ca 0.27 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.80 3m79 h LEU 76 Cb -0.08 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.65 3m79 h LEU 76 CO -0.06 0.99 0.25 0.45 -0.34 0.00 0.00 178.44 179.73 3m79 h HIS 77 N 0.99 0.46 -0.61 1.25 3.86 -1.10 0.81 115.15 120.81 3m79 h HIS 77 Ca 0.20 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.44 3m79 h HIS 77 Cb 0.41 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 3m79 h HIS 77 CO 0.03 0.24 0.39 -0.07 0.86 0.00 0.00 177.93 179.38 3m79 h LEU 78 N 0.50 0.66 -0.76 2.43 3.38 -1.16 -1.20 115.31 119.15 3m79 h LEU 78 Ca 0.20 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3m79 h LEU 78 Cb 0.08 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3m79 h LEU 78 CO -0.13 0.47 0.38 0.00 0.09 0.00 0.00 178.44 179.25 3m79 h ALA 79 N 1.24 0.97 -0.01 1.53 0.00 -0.94 -1.29 119.26 120.78 3m79 h ALA 79 Ca 0.23 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3m79 h ALA 79 Cb -0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 3m79 h ALA 79 CO -0.07 0.52 -0.14 -0.91 0.00 0.00 0.00 179.25 178.65 3m79 h ASN 80 N 1.06 0.01 0.26 0.00 2.35 -0.36 -0.83 115.58 118.07 3m79 h ASN 80 Ca 0.26 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 3m79 h ASN 80 Cb 0.10 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 3m79 h ASN 80 CO -0.04 0.15 0.00 -0.62 -1.65 0.00 0.00 177.43 175.28 3m79 n GLU 81 N -4.37 0.68 -1.00 0.81 1.02 -0.50 -4.89 120.64 112.40 3m79 n GLU 81 Ca -0.02 0.01 -0.00 0.00 -0.02 0.00 0.00 57.16 57.12 3m79 n GLU 81 Cb 0.21 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.13 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 1.00 0.46 3.34 0.62 0.00 -0.32 -4.97 105.19 105.33 3m79 n GLY 82 Ca 0.18 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.98 3.39 0.24 1.61 5.02 -0.51 -4.85 118.16 120.07 3m79 n LYS 83 Ca -0.00 -3.69 -0.16 0.00 -2.02 0.00 0.00 58.31 52.44 3m79 n LYS 83 Cb 0.00 -3.08 -0.08 0.00 -0.02 0.00 0.00 35.03 31.86 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 4.55 0.30 -0.68 -0.18 2.07 -1.89 -0.24 116.25 120.18 3m79 h VAL 84 Ca 0.36 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.91 3m79 h VAL 84 Cb 0.82 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 3m79 h VAL 84 CO 1.36 0.00 0.42 0.11 0.02 0.00 0.00 177.57 179.48 3m79 h LYS 85 N -0.75 0.78 -0.68 1.57 1.79 -1.97 0.90 116.57 118.22 3m79 h LYS 85 Ca -0.03 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 3m79 h LYS 85 Cb 0.65 -0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 31.10 3m79 h LYS 85 CO -0.03 0.52 0.33 0.93 -1.08 0.00 0.00 179.45 180.12 3m79 h GLU 86 N 0.81 0.98 -0.44 3.15 3.07 -1.93 -0.02 114.58 120.20 3m79 h GLU 86 Ca 0.28 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 58.91 3m79 h GLU 86 Cb 0.05 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.77 3m79 h GLU 86 CO -0.12 0.77 -0.05 0.00 -1.40 0.00 0.00 179.01 178.21 3m79 h ALA 87 N 1.15 0.60 -0.76 3.43 0.00 -0.51 -0.65 119.26 122.53 3m79 h ALA 87 Ca 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3m79 h ALA 87 Cb 0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3m79 h ALA 87 CO -0.03 0.44 0.39 1.96 0.00 0.00 0.00 179.25 182.02 3m79 h GLN 88 N 0.65 1.08 -0.72 0.00 4.20 -0.66 0.00 115.11 119.66 3m79 h GLN 88 Ca 0.12 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3m79 h GLN 88 Cb 0.57 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 3m79 h GLN 88 CO 0.03 0.83 0.40 0.00 -0.67 0.00 0.00 178.83 179.42 3m79 h ALA 89 N 1.20 0.93 -0.77 3.87 0.00 -0.81 -0.53 119.26 123.15 3m79 h ALA 89 Ca 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3m79 h ALA 89 Cb 0.08 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 3m79 h ALA 89 CO -0.04 0.43 0.37 0.00 0.00 0.00 0.00 179.25 180.02 3m79 h ALA 90 N 1.20 0.99 -0.71 0.00 0.00 -0.68 -1.60 119.26 118.47 3m79 h ALA 90 Ca 0.25 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3m79 h ALA 90 Cb 0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3m79 h ALA 90 CO -0.04 0.55 0.21 0.00 0.00 0.00 0.00 179.25 179.97 3m79 h ALA 91 N 1.19 1.02 -0.84 0.00 0.00 -0.70 -2.28 119.26 117.66 3m79 h ALA 91 Ca 0.26 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3m79 h ALA 91 Cb 0.11 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3m79 h ALA 91 CO -0.03 0.65 0.55 1.49 0.00 0.00 0.00 179.25 181.90 3m79 h GLU 92 N 1.07 1.06 0.00 0.00 4.57 -0.73 -2.09 114.58 118.46 3m79 h GLU 92 Ca 0.23 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 3m79 h GLU 92 Cb 0.31 -0.24 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 3m79 h GLU 92 CO -0.01 0.70 -0.09 1.96 -1.18 0.00 0.00 179.01 180.40 3m79 h GLN 93 N 1.09 0.00 -0.31 1.92 4.20 -0.87 -2.11 115.11 119.04 3m79 h GLN 93 Ca 0.32 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.03 3m79 h GLN 93 Cb -0.06 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3m79 h GLN 93 CO -0.09 0.09 0.19 -0.07 -0.67 0.00 0.00 178.83 178.28 3m79 h LEU 94 N 0.00 0.36 -1.40 1.46 3.38 -0.82 -2.92 115.31 115.37 3m79 h LEU 94 Ca -0.00 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.05 3m79 h LEU 94 Cb 0.32 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 3m79 h LEU 94 CO 0.01 0.27 0.50 0.11 0.09 0.00 0.00 178.44 179.42 3m79 h LYS 95 N 0.42 0.65 -0.92 1.13 1.57 -1.42 -0.19 116.57 117.80 3m79 h LYS 95 Ca 0.11 -0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.94 3m79 h LYS 95 Cb -0.02 -0.15 -0.07 0.00 0.08 0.00 0.00 32.23 32.07 3m79 h LYS 95 CO -0.02 0.43 0.59 0.00 -0.57 0.00 0.00 179.45 179.88 3m79 h THR 97 N 0.96 1.45 -0.24 0.00 2.02 -1.22 -1.33 112.91 114.54 3m79 h THR 97 Ca 0.42 -1.65 0.05 0.00 0.77 0.00 0.00 66.41 66.01 3m79 h THR 97 Cb 0.36 2.37 -0.08 0.00 -1.74 0.00 0.00 68.15 69.06 3m79 h THR 97 CO -0.18 0.46 -0.40 0.00 0.37 0.00 0.00 175.52 175.77 3m79 h ASN 99 N -0.41 0.82 -0.62 0.00 -0.26 -0.66 -1.91 115.58 112.54 3m79 h ASN 99 Ca 0.11 -0.13 -0.05 0.00 -0.56 0.00 0.00 56.30 55.66 3m79 h ASN 99 Cb 0.60 -0.21 -0.03 0.00 -1.06 0.00 0.00 38.32 37.62 3m79 h ASN 99 CO -0.46 0.77 0.18 0.00 -1.06 0.00 0.00 177.43 176.87 3m79 h ALA 100 N 1.34 0.81 -0.17 -0.83 0.00 -1.05 -1.39 119.26 117.96 3m79 h ALA 100 Ca 0.19 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3m79 h ALA 100 Cb 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3m79 h ALA 100 CO -0.01 0.49 -0.48 0.00 0.00 0.00 0.00 179.25 179.25 3m79 h HIS 102 N 0.29 0.68 -0.91 0.00 -0.00 -1.28 0.78 115.15 114.72 3m79 h HIS 102 Ca -0.01 0.02 0.12 0.00 -0.00 0.00 0.00 60.37 60.50 3m79 h HIS 102 Cb 1.10 -0.21 -0.07 0.00 -0.00 0.00 0.00 27.41 28.23 3m79 h HIS 102 CO 0.10 0.35 0.58 0.37 -0.00 0.00 0.00 177.93 179.33 3m79 h GLN 103 N 0.70 0.81 0.15 2.45 4.15 -1.28 -0.62 115.11 121.48 3m79 h GLN 103 Ca 0.28 -0.05 -0.35 0.00 0.77 0.00 0.00 58.65 59.30 3m79 h GLN 103 Cb 0.13 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.64 3m79 h GLN 103 CO -0.16 0.54 -1.84 0.87 -1.93 0.00 0.00 178.83 176.31 3m79 h LYS 104 N 0.84 0.33 0.00 1.69 1.57 -1.36 -3.44 116.57 116.20 3m79 h LYS 104 Ca 0.44 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3m79 h LYS 104 Cb 0.53 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.05 3m79 h LYS 104 CO -0.20 1.25 -0.07 0.66 -0.57 0.00 0.00 179.45 180.52 3m79 n TYR 105 N -3.53 0.00 1.64 -1.35 4.02 0.22 -5.12 117.16 113.04 3m79 n TYR 105 Ca -0.27 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 57.76 3m79 n TYR 105 Cb 1.06 0.00 0.64 0.00 -0.02 0.00 0.00 39.34 41.02 3m79 n TYR 105 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72