#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 4.66 0.14 0.00 1.47 -1.26 -4.82 116.67 116.86 3m79 s ASP 2 Ca 0.00 0.70 -0.18 0.00 1.18 0.00 0.00 52.55 54.25 3m79 s ASP 2 Cb 0.00 -1.26 0.03 0.00 -0.34 0.00 0.00 42.92 41.35 3m79 s ASP 2 CO 0.00 -1.77 1.72 0.25 0.68 0.00 0.00 175.17 176.05 3m79 h LEU 3 N -0.89 -0.08 -0.65 2.11 6.46 -1.95 -1.88 115.31 118.44 3m79 h LEU 3 Ca -0.45 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.40 3m79 h LEU 3 Cb 1.32 0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 41.30 3m79 h LEU 3 CO 0.64 -0.00 0.38 -0.33 -0.62 0.00 0.00 178.44 178.51 3m79 h GLU 4 N 0.11 0.72 -0.52 1.25 5.08 -1.99 0.01 114.58 119.25 3m79 h GLU 4 Ca 0.14 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 3m79 h GLU 4 Cb 0.17 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 3m79 h GLU 4 CO -0.22 0.47 0.13 -0.44 -1.00 0.00 0.00 179.01 177.96 3m79 h ASP 5 N 0.74 0.77 -0.68 1.42 3.32 -1.84 -0.80 116.42 119.36 3m79 h ASP 5 Ca 0.27 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 3m79 h ASP 5 Cb 0.08 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 3m79 h ASP 5 CO -0.13 0.80 0.29 0.78 -1.72 0.00 0.00 179.24 179.26 3m79 h ASN 6 N 0.71 0.94 -0.34 6.45 2.35 -0.88 -1.73 115.58 123.08 3m79 h ASN 6 Ca 0.16 -0.13 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 3m79 h ASN 6 Cb 0.32 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 3m79 h ASN 6 CO 0.00 0.83 -0.12 0.24 -1.65 0.00 0.00 177.43 176.74 3m79 h MET 7 N 1.01 0.78 -0.60 0.81 2.86 -0.72 -1.14 114.93 117.93 3m79 h MET 7 Ca 0.24 -0.26 -0.10 0.00 -2.06 0.00 0.00 59.70 57.51 3m79 h MET 7 Cb 0.18 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 3m79 h MET 7 CO -0.02 0.86 -0.03 0.93 1.06 0.00 0.00 176.91 179.71 3m79 h GLU 8 N 0.70 1.07 -0.25 1.72 4.39 -0.83 -0.69 114.58 120.69 3m79 h GLU 8 Ca 0.12 -0.35 -0.12 0.00 0.34 0.00 0.00 59.36 59.35 3m79 h GLU 8 Cb 0.60 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 3m79 h GLU 8 CO 0.04 1.06 -0.33 0.00 -1.16 0.00 0.00 179.01 178.62 3m79 h THR 9 N 0.97 1.29 -0.08 1.13 1.03 -1.15 0.93 112.91 117.02 3m79 h THR 9 Ca 0.17 -1.44 0.03 0.00 -0.01 0.00 0.00 66.41 65.16 3m79 h THR 9 Cb 0.59 1.45 -0.03 0.00 -1.07 0.00 0.00 68.15 69.09 3m79 h THR 9 CO 0.04 0.46 -0.10 -0.07 -0.01 0.00 0.00 175.52 175.83 3m79 h LEU 10 N 0.46 -0.32 -0.24 0.00 3.38 -1.05 -1.93 115.31 115.61 3m79 h LEU 10 Ca 0.05 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3m79 h LEU 10 Cb 0.80 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 3m79 h LEU 10 CO 0.07 -0.14 -0.01 -1.13 0.09 0.00 0.00 178.44 177.31 3m79 h ASN 11 N -0.14 0.42 -0.34 -0.43 -1.24 -0.88 -1.56 115.58 111.41 3m79 h ASN 11 Ca 0.07 -0.32 0.04 0.00 0.71 0.00 0.00 56.30 56.80 3m79 h ASN 11 Cb 0.23 -0.11 -0.04 0.00 0.73 0.00 0.00 38.32 39.13 3m79 h ASN 11 CO -0.16 0.64 0.11 0.44 -1.29 0.00 0.00 177.43 177.16 3m79 h ASP 12 N 0.20 0.10 0.81 1.15 3.32 -0.83 -2.66 116.42 118.51 3m79 h ASP 12 Ca 0.07 0.04 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 3m79 h ASP 12 Cb 0.43 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 3m79 h ASP 12 CO 0.01 0.09 -0.68 0.78 -1.72 0.00 0.00 179.24 177.73 3m79 h ASN 13 N 0.25 0.00 -0.68 6.45 4.21 -1.31 -2.25 115.58 122.25 3m79 h ASN 13 Ca 0.16 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.68 3m79 h ASN 13 Cb 0.14 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.31 3m79 h ASN 13 CO -0.17 0.68 0.44 0.25 -1.29 0.00 0.00 177.43 177.34 3m79 h LEU 14 N 0.00 0.74 -0.83 1.61 5.85 -1.15 -1.54 115.31 120.00 3m79 h LEU 14 Ca -0.01 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.61 3m79 h LEU 14 Cb 1.27 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 3m79 h LEU 14 CO 0.09 0.53 -0.09 0.11 -0.34 0.00 0.00 178.44 178.74 3m79 h LYS 15 N 0.88 0.78 -0.57 1.25 1.57 -1.23 -2.17 116.57 117.08 3m79 h LYS 15 Ca 0.26 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 3m79 h LYS 15 Cb -0.05 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 3m79 h LYS 15 CO -0.08 0.85 0.33 0.28 -0.57 0.00 0.00 179.45 180.26 3m79 h VAL 16 N 0.71 1.03 -0.41 0.50 2.07 -1.02 -2.32 116.25 116.81 3m79 h VAL 16 Ca 0.12 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3m79 h VAL 16 Cb 0.57 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3m79 h VAL 16 CO 0.03 0.12 0.24 0.40 0.02 0.00 0.00 177.57 178.38 3m79 h ILE 17 N 0.65 1.14 -0.67 4.57 2.04 -1.00 -1.31 117.51 122.94 3m79 h ILE 17 Ca 0.24 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.78 3m79 h ILE 17 Cb 0.06 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 3m79 h ILE 17 CO -0.12 0.15 0.44 -0.33 0.00 0.00 0.00 178.15 178.29 3m79 h GLU 18 N 0.54 0.74 -0.21 2.37 4.39 -1.13 -2.57 114.58 118.72 3m79 h GLU 18 Ca 0.15 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.80 3m79 h GLU 18 Cb 0.03 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 3m79 h GLU 18 CO -0.03 0.49 0.00 1.63 -1.16 0.00 0.00 179.01 179.95 3m79 n LYS 19 N -4.46 2.31 -2.19 2.33 5.02 -0.90 -5.01 118.16 115.27 3m79 n LYS 19 Ca 0.09 -1.95 -0.38 0.00 -2.02 0.00 0.00 58.31 54.05 3m79 n LYS 19 Cb 0.15 -1.48 -0.00 0.00 -0.02 0.00 0.00 35.03 33.68 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 -1.75 3.01 -0.17 7.82 0.00 -0.52 -4.97 121.76 125.18 3m79 s ALA 20 Ca 0.34 1.02 0.18 0.00 0.00 0.00 0.00 51.96 53.50 3m79 s ALA 20 Cb 0.21 -3.41 -0.26 0.00 0.00 0.00 0.00 23.12 19.66 3m79 s ALA 20 CO 0.31 -0.74 0.14 -0.25 0.00 0.00 0.00 175.76 175.21 3m79 n ASP 21 N -0.41 0.08 -4.18 0.00 8.00 -1.26 -5.05 116.55 113.74 3m79 n ASP 21 Ca 0.07 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.46 3m79 n ASP 21 Cb 0.47 1.16 -0.10 0.00 -0.02 0.00 0.00 41.12 42.63 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 -5.29 0.71 0.30 -2.24 2.20 -1.26 -5.06 114.94 104.30 3m79 s ASN 22 Ca -0.10 -1.16 0.02 0.00 -0.94 0.00 0.00 52.86 50.68 3m79 s ASN 22 Cb 0.07 0.21 0.48 0.00 -2.00 0.00 0.00 41.25 40.01 3m79 s ASN 22 CO 0.83 -0.64 1.83 0.00 -2.94 0.00 0.00 177.10 176.18 3m79 h ALA 23 N 2.85 1.26 -0.89 3.54 0.00 -1.91 -2.83 119.26 121.29 3m79 h ALA 23 Ca -0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 3m79 h ALA 23 Cb 1.19 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 3m79 h ALA 23 CO 0.62 0.50 0.47 0.00 0.00 0.00 0.00 179.25 180.83 3m79 h ALA 24 N 1.40 1.14 -0.65 0.00 0.00 -1.97 0.15 119.26 119.32 3m79 h ALA 24 Ca 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3m79 h ALA 24 Cb 0.37 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3m79 h ALA 24 CO 0.01 0.66 0.28 1.96 0.00 0.00 0.00 179.25 182.16 3m79 h GLN 25 N 1.25 0.96 -0.26 0.00 4.20 -1.94 -1.91 115.11 117.41 3m79 h GLN 25 Ca 0.31 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.80 3m79 h GLN 25 Cb 0.06 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3m79 h GLN 25 CO -0.05 0.79 -0.07 0.28 -0.67 0.00 0.00 178.83 179.12 3m79 h VAL 26 N 0.91 1.28 -0.10 -0.54 2.07 -1.29 -2.40 116.25 116.18 3m79 h VAL 26 Ca 0.22 -1.08 0.03 0.00 0.82 0.00 0.00 66.70 66.68 3m79 h VAL 26 Cb 0.18 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 3m79 h VAL 26 CO -0.02 0.34 -0.08 0.11 0.02 0.00 0.00 177.57 177.94 3m79 h LYS 27 N 0.26 -0.08 -0.48 1.57 1.57 -0.67 -0.87 116.57 117.86 3m79 h LYS 27 Ca 0.07 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.90 3m79 h LYS 27 Cb 0.54 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.82 3m79 h LYS 27 CO 0.03 -0.06 0.21 0.22 -0.57 0.00 0.00 179.45 179.28 3m79 h ASP 28 N -0.09 0.28 -0.43 0.86 -0.00 -1.36 -1.26 116.42 114.42 3m79 h ASP 28 Ca 0.07 0.04 -0.08 0.00 -0.00 0.00 0.00 57.03 57.06 3m79 h ASP 28 Cb 0.18 -0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 39.49 3m79 h ASP 28 CO -0.16 0.19 -0.03 0.00 -0.00 0.00 0.00 179.24 179.25 3m79 h ALA 29 N 1.28 0.58 -0.50 -0.78 0.00 -1.17 -2.23 119.26 116.43 3m79 h ALA 29 Ca 0.22 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3m79 h ALA 29 Cb 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3m79 h ALA 29 CO -0.18 0.40 0.04 -0.07 0.00 0.00 0.00 179.25 179.44 3m79 h LEU 30 N 0.61 0.77 -0.63 0.00 3.38 -1.02 -1.00 115.31 117.42 3m79 h LEU 30 Ca 0.12 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 3m79 h LEU 30 Cb 0.54 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3m79 h LEU 30 CO 0.03 0.82 0.22 0.74 0.09 0.00 0.00 178.44 180.34 3m79 h THR 31 N 0.77 1.24 -0.41 0.22 2.02 -1.09 -0.65 112.91 115.00 3m79 h THR 31 Ca 0.16 -0.79 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 3m79 h THR 31 Cb 0.41 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3m79 h THR 31 CO 0.01 0.31 0.16 0.11 0.37 0.00 0.00 175.52 176.48 3m79 h LYS 32 N 0.90 0.63 -0.73 6.66 1.57 -1.06 -2.37 116.57 122.16 3m79 h LYS 32 Ca 0.21 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 3m79 h LYS 32 Cb 0.25 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 3m79 h LYS 32 CO -0.01 0.59 0.47 0.52 -0.57 0.00 0.00 179.45 180.45 3m79 h MET 33 N 0.53 0.92 -0.57 3.15 2.86 -1.01 -1.57 114.93 119.22 3m79 h MET 33 Ca 0.14 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.75 3m79 h MET 33 Cb 0.21 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 3m79 h MET 33 CO -0.01 0.61 0.34 0.00 1.06 0.00 0.00 176.91 178.90 3m79 h ALA 34 N 1.29 0.74 -0.41 6.32 0.00 -0.92 0.13 119.26 126.41 3m79 h ALA 34 Ca 0.28 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3m79 h ALA 34 Cb -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3m79 h ALA 34 CO -0.09 0.04 0.17 0.00 0.00 0.00 0.00 179.25 179.38 3m79 h ALA 35 N 1.26 0.53 -0.47 0.00 0.00 -1.16 -1.86 119.26 117.55 3m79 h ALA 35 Ca 0.24 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3m79 h ALA 35 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3m79 h ALA 35 CO -0.12 0.12 0.19 0.00 0.00 0.00 0.00 179.25 179.44 3m79 h ALA 36 N 1.02 0.61 -0.66 0.00 0.00 -0.94 -1.37 119.26 117.92 3m79 h ALA 36 Ca 0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3m79 h ALA 36 Cb 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3m79 h ALA 36 CO -0.01 0.22 0.26 0.00 0.00 0.00 0.00 179.25 179.73 3m79 h ALA 37 N 1.03 0.86 -0.72 0.00 0.00 -0.93 -1.41 119.26 118.10 3m79 h ALA 37 Ca 0.16 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3m79 h ALA 37 Cb 0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3m79 h ALA 37 CO -0.01 0.48 0.29 0.00 0.00 0.00 0.00 179.25 180.01 3m79 h ALA 38 N 1.11 0.93 0.00 0.00 0.00 -1.19 -2.76 119.26 117.35 3m79 h ALA 38 Ca 0.22 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3m79 h ALA 38 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3m79 h ALA 38 CO -0.02 0.54 -0.35 0.22 0.00 0.00 0.00 179.25 179.65 3m79 h ASP 39 N 1.02 0.00 1.45 0.00 3.58 -0.96 -2.83 116.42 118.68 3m79 h ASP 39 Ca 0.24 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.69 3m79 h ASP 39 Cb 0.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.25 3m79 h ASP 39 CO -0.02 0.35 0.00 0.00 -2.88 0.00 0.00 179.24 176.69 3m79 n ALA 40 N -2.37 2.28 -0.26 -0.78 0.00 -0.56 -4.34 120.51 114.49 3m79 n ALA 40 Ca -0.01 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.43 3m79 n ALA 40 Cb 0.43 -1.47 0.11 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.31 -0.32 0.00 2.91 -1.34 -1.94 115.95 114.95 3m79 h TRP 41 Ca 0.00 0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.08 3m79 h TRP 41 Cb 0.72 0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.63 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 -5.46 2.60 -4.79 2.65 3.41 -1.26 -4.83 113.62 105.93 3m79 n SER 42 Ca 0.11 -1.88 -0.35 0.00 -0.26 0.00 0.00 58.87 56.49 3m79 n SER 42 Cb 0.41 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 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 -1.58 2.92 -0.29 7.33 0.00 -0.73 -5.04 121.76 124.37 3m79 s ALA 43 Ca 0.35 0.67 -0.07 0.00 0.00 0.00 0.00 51.96 52.92 3m79 s ALA 43 Cb 0.20 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 20.04 3m79 s ALA 43 CO 0.28 -0.35 0.07 0.99 0.00 0.00 0.00 175.76 176.75 3m79 s THR 44 N -1.85 3.95 0.49 0.00 2.01 -1.26 -5.02 115.64 113.95 3m79 s THR 44 Ca 0.65 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.79 3m79 s THR 44 Cb -0.19 -3.01 -0.07 0.00 0.01 0.00 0.00 72.50 69.24 3m79 s THR 44 CO 0.23 0.12 1.15 -2.16 -0.69 0.00 0.00 174.62 173.27 3m79 s PRO 45 N 1.51 3.64 0.29 4.92 0.04 -1.26 -4.87 135.00 139.27 3m79 s PRO 45 Ca 0.03 1.70 0.04 0.00 0.04 0.00 0.00 61.00 62.81 3m79 s PRO 45 Cb -0.17 -2.27 0.75 0.00 0.04 0.00 0.00 34.50 32.85 3m79 s PRO 45 CO 0.02 -0.63 1.66 -1.35 0.04 0.00 0.00 177.00 176.74 3m79 h PRO 46 N 1.77 0.24 0.00 0.56 0.11 -1.99 0.06 132.00 132.75 3m79 h PRO 46 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3m79 h PRO 46 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3m79 h PRO 46 CO 0.59 0.16 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 3m79 n LYS 47 N -5.18 0.11 -0.14 1.05 5.02 -1.26 -2.37 118.16 115.39 3m79 n LYS 47 Ca 0.23 0.36 0.06 0.00 -2.02 0.00 0.00 58.31 56.94 3m79 n LYS 47 Cb 0.71 -1.72 0.12 0.00 -0.02 0.00 0.00 35.03 34.12 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 -1.93 2.66 0.17 -0.35 4.77 -0.03 -4.73 117.00 117.56 3m79 n LEU 48 Ca 0.03 -2.53 0.08 0.00 -0.03 0.00 0.00 56.01 53.55 3m79 n LEU 48 Cb 0.20 -0.28 0.58 0.00 -2.33 0.00 0.00 43.42 41.59 3m79 n LEU 48 CO 0.17 0.64 1.10 -0.33 -1.33 0.00 0.00 177.39 177.64 3m79 h GLU 49 N 0.76 0.15 -0.01 3.23 5.08 -1.10 -2.00 114.58 120.69 3m79 h GLU 49 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3m79 h GLU 49 Cb 0.89 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3m79 h GLU 49 CO 0.05 0.10 0.00 -0.40 -1.00 0.00 0.00 179.01 177.75 3m79 n ASP 50 N -4.51 1.18 -4.92 1.42 5.68 -1.26 -4.89 116.55 109.24 3m79 n ASP 50 Ca -0.00 -1.40 -0.29 0.00 -0.50 0.00 0.00 54.79 52.60 3m79 n ASP 50 Cb 0.12 -0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.07 3m79 n ASP 50 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3m79 s LYS 51 N -2.00 3.50 0.51 0.11 -0.14 -0.75 -5.09 119.74 115.88 3m79 s LYS 51 Ca 0.40 -0.37 -0.21 0.00 -1.36 0.00 0.00 55.97 54.43 3m79 s LYS 51 Cb 0.21 -2.93 -0.06 0.00 -1.68 0.00 0.00 37.83 33.37 3m79 s LYS 51 CO 0.34 0.50 1.15 -1.54 -0.76 0.00 0.00 175.35 175.04 3m79 s SER 52 N -2.83 5.91 0.47 2.83 1.04 -1.26 -4.91 113.70 114.95 3m79 s SER 52 Ca 0.37 2.25 0.29 0.00 0.48 0.00 0.00 55.95 59.34 3m79 s SER 52 Cb -0.12 -2.59 1.56 0.00 0.10 0.00 0.00 66.02 64.97 3m79 s SER 52 CO 0.28 -1.09 1.86 1.55 0.98 0.00 0.00 173.24 176.82 3m79 h PRO 53 N 1.60 0.00 -0.20 4.02 0.13 -1.98 -1.15 132.00 134.41 3m79 h PRO 53 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3m79 h PRO 53 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3m79 h PRO 53 CO 0.58 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 174.88 3m79 n ASP 54 N -2.55 2.88 -4.76 1.44 2.03 -1.26 -4.57 116.55 109.75 3m79 n ASP 54 Ca -0.02 -1.85 -0.33 0.00 0.52 0.00 0.00 54.79 53.10 3m79 n ASP 54 Cb 0.12 -0.12 0.05 0.00 -0.72 0.00 0.00 41.12 40.45 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 -1.40 4.98 0.37 1.67 1.04 -0.44 -4.84 113.70 115.08 3m79 s SER 55 Ca 0.27 2.08 0.11 0.00 0.48 0.00 0.00 55.95 58.89 3m79 s SER 55 Cb 0.17 -2.56 0.88 0.00 0.10 0.00 0.00 66.02 64.61 3m79 s SER 55 CO 0.25 -1.72 1.87 -0.65 0.98 0.00 0.00 173.24 173.96 3m79 h PRO 56 N 0.05 0.60 -0.20 4.02 0.11 -1.95 -1.42 132.00 133.21 3m79 h PRO 56 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3m79 h PRO 56 Cb 1.26 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3m79 h PRO 56 CO 0.53 0.40 0.10 0.93 -0.21 0.00 0.00 178.00 179.76 3m79 h GLU 57 N 0.62 0.28 -0.30 1.05 3.07 -1.92 -1.17 114.58 116.21 3m79 h GLU 57 Ca 0.45 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 59.16 3m79 h GLU 57 Cb 0.82 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.66 3m79 h GLU 57 CO -0.20 0.29 -0.28 0.52 -1.40 0.00 0.00 179.01 177.93 3m79 h MET 58 N 0.20 0.62 -0.52 2.33 2.86 -1.64 0.21 114.93 119.00 3m79 h MET 58 Ca 0.07 -0.26 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 3m79 h MET 58 Cb 0.09 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 3m79 h MET 58 CO -0.01 0.84 0.13 0.45 1.06 0.00 0.00 176.91 179.38 3m79 h HIS 59 N 0.54 0.87 -0.51 -0.22 3.86 -1.24 -1.27 115.15 117.17 3m79 h HIS 59 Ca 0.07 -0.10 -0.11 0.00 -1.16 0.00 0.00 60.37 59.06 3m79 h HIS 59 Cb 0.76 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.97 3m79 h HIS 59 CO 0.03 0.76 -0.13 0.22 0.86 0.00 0.00 177.93 179.68 3m79 h ASP 60 N 0.73 0.98 -0.10 2.45 3.58 -0.89 0.40 116.42 123.57 3m79 h ASP 60 Ca 0.16 -0.33 0.00 0.00 0.42 0.00 0.00 57.03 57.29 3m79 h ASP 60 Cb 0.33 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 3m79 h ASP 60 CO 0.00 1.10 0.06 0.15 -2.88 0.00 0.00 179.24 177.67 3m79 h PHE 61 N 0.86 0.11 -0.37 0.28 3.57 -0.49 -2.45 116.94 118.45 3m79 h PHE 61 Ca 0.13 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.53 3m79 h PHE 61 Cb 0.69 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3m79 h PHE 61 CO 0.04 0.07 -0.18 0.00 -2.23 0.00 0.00 178.31 176.01 3m79 h ARG 62 N 0.12 0.71 -0.78 1.11 3.08 -1.10 -2.87 114.38 114.64 3m79 h ARG 62 Ca 0.04 -0.26 0.11 0.00 0.07 0.00 0.00 59.98 59.94 3m79 h ARG 62 Cb -0.00 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 29.92 3m79 h ARG 62 CO -0.02 0.84 0.41 1.25 -1.07 0.00 0.00 179.97 181.38 3m79 h HIS 63 N 0.63 0.73 -0.50 3.04 2.76 -0.67 -1.73 115.15 119.41 3m79 h HIS 63 Ca 0.10 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 3m79 h HIS 63 Cb 0.66 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.39 3m79 h HIS 63 CO 0.03 0.24 0.33 0.78 -1.30 0.00 0.00 177.93 178.02 3m79 h GLY 64 N 0.65 0.65 1.62 5.26 0.00 -1.21 -0.88 103.07 109.17 3m79 h GLY 64 Ca 0.40 -0.23 -0.12 0.00 0.00 0.00 0.00 47.33 47.38 3m79 h GLY 64 CO -0.30 0.20 -0.40 0.74 0.00 0.00 0.00 176.54 176.78 3m79 h PHE 65 N 0.58 0.50 -0.48 5.60 0.05 -1.34 -1.69 116.94 120.16 3m79 h PHE 65 Ca 0.20 -0.14 0.02 0.00 3.82 0.00 0.00 57.97 61.87 3m79 h PHE 65 Cb 0.08 -0.11 -0.03 0.00 2.00 0.00 0.00 35.95 37.89 3m79 h PHE 65 CO -0.00 0.76 0.29 -1.49 -0.18 0.00 0.00 178.31 177.70 3m79 h TRP 66 N 0.35 0.55 0.01 -0.55 6.55 -0.65 -0.37 115.95 121.83 3m79 h TRP 66 Ca 0.03 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 59.89 3m79 h TRP 66 Cb 0.86 -0.18 0.00 0.00 -0.86 0.00 0.00 29.16 28.99 3m79 h TRP 66 CO 0.03 0.32 -0.01 0.82 -1.05 0.00 0.00 178.44 178.55 3m79 h ILE 67 N 0.59 1.05 -0.51 1.49 1.08 -1.28 -1.76 117.51 118.16 3m79 h ILE 67 Ca 0.19 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 3m79 h ILE 67 Cb -0.00 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 3m79 h ILE 67 CO -0.08 0.05 0.32 0.25 -0.69 0.00 0.00 178.15 178.00 3m79 h LEU 68 N -0.09 0.60 -0.33 1.44 5.85 -1.15 -1.73 115.31 119.90 3m79 h LEU 68 Ca -0.00 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.70 3m79 h LEU 68 Cb 0.09 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3m79 h LEU 68 CO 0.00 0.45 0.19 0.40 -0.34 0.00 0.00 178.44 179.15 3m79 h ILE 69 N 0.68 1.03 -0.68 4.05 2.04 -1.01 -0.62 117.51 123.01 3m79 h ILE 69 Ca 0.18 -0.13 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3m79 h ILE 69 Cb -0.05 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 3m79 h ILE 69 CO -0.04 0.07 0.39 1.23 0.00 0.00 0.00 178.15 179.81 3m79 h GLY 70 N 0.39 1.00 1.45 5.37 0.00 -1.07 -1.39 103.07 108.81 3m79 h GLY 70 Ca 0.13 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.06 3m79 h GLY 70 CO -0.06 0.19 -0.32 1.46 0.00 0.00 0.00 176.54 177.81 3m79 h GLN 71 N 0.74 0.62 -0.38 4.80 4.20 -1.01 -2.18 115.11 121.90 3m79 h GLN 71 Ca 0.30 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.64 3m79 h GLN 71 Cb 0.14 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 3m79 h GLN 71 CO -0.16 0.86 -0.10 0.82 -0.67 0.00 0.00 178.83 179.58 3m79 h ILE 72 N 0.53 1.28 -0.48 2.54 2.04 -0.88 -1.85 117.51 120.69 3m79 h ILE 72 Ca 0.06 -1.18 0.04 0.00 1.00 0.00 0.00 64.86 64.78 3m79 h ILE 72 Cb 0.81 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 3m79 h ILE 72 CO 0.07 0.39 0.25 -0.74 0.00 0.00 0.00 178.15 178.12 3m79 h HIS 73 N 0.54 0.47 -0.37 1.37 2.76 -1.13 -0.54 115.15 118.25 3m79 h HIS 73 Ca 0.10 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.19 3m79 h HIS 73 Cb 0.62 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.42 3m79 h HIS 73 CO 0.05 0.24 -0.14 0.22 -1.30 0.00 0.00 177.93 177.00 3m79 h ASP 74 N 0.50 0.76 -0.46 3.26 3.58 -1.35 -2.58 116.42 120.14 3m79 h ASP 74 Ca 0.21 -0.39 0.03 0.00 0.42 0.00 0.00 57.03 57.30 3m79 h ASP 74 Cb 0.10 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 3m79 h ASP 74 CO -0.13 0.98 0.30 0.00 -2.88 0.00 0.00 179.24 177.51 3m79 h ALA 75 N 0.81 1.80 -0.26 -0.78 0.00 -1.14 -2.34 119.26 117.35 3m79 h ALA 75 Ca 0.09 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 3m79 h ALA 75 Cb 0.67 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3m79 h ALA 75 CO 0.05 0.15 -0.37 1.25 0.00 0.00 0.00 179.25 180.33 3m79 h LEU 76 N 0.51 0.61 -0.34 0.00 5.85 -0.84 -1.68 115.31 119.41 3m79 h LEU 76 Ca 0.18 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.66 3m79 h LEU 76 Cb 0.11 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3m79 h LEU 76 CO -0.05 0.92 0.20 0.45 -0.34 0.00 0.00 178.44 179.62 3m79 h HIS 77 N 0.48 0.38 -0.72 1.25 3.86 -1.04 0.87 115.15 120.23 3m79 h HIS 77 Ca 0.05 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3m79 h HIS 77 Cb 0.86 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 29.17 3m79 h HIS 77 CO 0.03 0.23 0.44 -0.07 0.86 0.00 0.00 177.93 179.42 3m79 h LEU 78 N 0.41 0.87 -0.73 2.43 3.38 -1.29 -0.96 115.31 119.43 3m79 h LEU 78 Ca 0.13 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3m79 h LEU 78 Cb -0.01 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3m79 h LEU 78 CO -0.06 0.68 0.21 0.00 0.09 0.00 0.00 178.44 179.36 3m79 h ALA 79 N 1.23 0.95 -0.16 1.53 0.00 -1.08 -1.55 119.26 120.19 3m79 h ALA 79 Ca 0.26 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3m79 h ALA 79 Cb -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3m79 h ALA 79 CO -0.05 0.65 -0.03 -0.91 0.00 0.00 0.00 179.25 178.91 3m79 h ASN 80 N 1.08 0.20 0.28 0.00 2.35 -0.16 -0.67 115.58 118.67 3m79 h ASN 80 Ca 0.23 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3m79 h ASN 80 Cb 0.32 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.64 3m79 h ASN 80 CO -0.00 0.27 0.00 -0.62 -1.65 0.00 0.00 177.43 175.43 3m79 n GLU 81 N -4.38 0.61 -0.92 0.81 1.02 -0.43 -4.89 120.64 112.47 3m79 n GLU 81 Ca -0.01 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3m79 n GLU 81 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 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 0.91 0.55 3.22 0.62 0.00 -0.26 -4.97 105.19 105.26 3m79 n GLY 82 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.90 3.28 0.17 1.61 5.02 -0.61 -4.84 118.16 119.88 3m79 n LYS 83 Ca 0.00 -3.38 -0.16 0.00 -2.02 0.00 0.00 58.31 52.76 3m79 n LYS 83 Cb 0.00 -3.19 -0.09 0.00 -0.02 0.00 0.00 35.03 31.73 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 4.58 0.09 -0.60 -0.18 2.07 -1.88 -0.15 116.25 120.17 3m79 h VAL 84 Ca 0.42 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.00 3m79 h VAL 84 Cb 0.77 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 3m79 h VAL 84 CO 1.52 0.00 0.31 0.11 0.02 0.00 0.00 177.57 179.52 3m79 h LYS 85 N -0.77 0.55 -0.52 1.57 1.57 -1.97 0.40 116.57 117.40 3m79 h LYS 85 Ca -0.01 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 3m79 h LYS 85 Cb 0.75 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3m79 h LYS 85 CO -0.20 0.37 -0.01 0.93 -0.57 0.00 0.00 179.45 179.97 3m79 h GLU 86 N 0.57 0.89 -0.53 3.15 3.07 -1.90 -0.17 114.58 119.66 3m79 h GLU 86 Ca 0.28 -0.26 -0.10 0.00 -0.50 0.00 0.00 59.36 58.78 3m79 h GLU 86 Cb 0.21 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 3m79 h GLU 86 CO -0.20 0.89 -0.08 0.00 -1.40 0.00 0.00 179.01 178.22 3m79 h ALA 87 N 1.17 0.72 -0.74 3.43 0.00 -0.44 -0.71 119.26 122.69 3m79 h ALA 87 Ca 0.15 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 3m79 h ALA 87 Cb 0.50 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3m79 h ALA 87 CO 0.02 0.60 0.22 1.96 0.00 0.00 0.00 179.25 182.05 3m79 h GLN 88 N 0.85 1.16 -0.60 0.00 4.20 -0.62 0.25 115.11 120.35 3m79 h GLN 88 Ca 0.14 -0.26 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 3m79 h GLN 88 Cb 0.63 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3m79 h GLN 88 CO 0.04 0.99 0.09 0.00 -0.67 0.00 0.00 178.83 179.29 3m79 h ALA 89 N 1.11 0.79 -0.82 3.87 0.00 -0.90 -0.78 119.26 122.55 3m79 h ALA 89 Ca 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3m79 h ALA 89 Cb 0.33 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3m79 h ALA 89 CO -0.00 0.55 0.41 0.00 0.00 0.00 0.00 179.25 180.20 3m79 h ALA 90 N 1.01 1.05 -0.69 0.00 0.00 -0.75 -1.55 119.26 118.34 3m79 h ALA 90 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3m79 h ALA 90 Cb 0.43 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3m79 h ALA 90 CO 0.01 0.61 0.21 0.00 0.00 0.00 0.00 179.25 180.07 3m79 h ALA 91 N 1.21 1.07 -0.86 0.00 0.00 -0.71 -2.48 119.26 117.49 3m79 h ALA 91 Ca 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3m79 h ALA 91 Cb 0.10 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 3m79 h ALA 91 CO -0.04 0.63 0.55 1.49 0.00 0.00 0.00 179.25 181.88 3m79 h GLU 92 N 1.02 1.14 0.00 0.00 4.57 -0.75 -2.24 114.58 118.32 3m79 h GLU 92 Ca 0.22 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 3m79 h GLU 92 Cb 0.30 -0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 28.64 3m79 h GLU 92 CO -0.01 0.78 -0.07 1.96 -1.18 0.00 0.00 179.01 180.49 3m79 h GLN 93 N 1.17 0.00 -0.17 1.92 4.20 -0.91 -2.18 115.11 119.14 3m79 h GLN 93 Ca 0.31 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.02 3m79 h GLN 93 Cb -0.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3m79 h GLN 93 CO -0.06 0.07 0.10 -0.07 -0.67 0.00 0.00 178.83 178.19 3m79 h LEU 94 N 0.00 0.20 -1.71 1.46 3.38 -0.97 -2.89 115.31 114.79 3m79 h LEU 94 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3m79 h LEU 94 Cb 0.28 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3m79 h LEU 94 CO 0.01 0.16 0.18 0.11 0.09 0.00 0.00 178.44 178.99 3m79 h LYS 95 N 0.24 0.37 -0.94 1.13 1.57 -1.46 -0.15 116.57 117.32 3m79 h LYS 95 Ca 0.06 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.92 3m79 h LYS 95 Cb -0.00 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.16 3m79 h LYS 95 CO -0.01 0.25 0.60 0.00 -0.57 0.00 0.00 179.45 179.72 3m79 h THR 97 N 0.96 1.44 -0.17 0.00 2.02 -1.21 -2.00 112.91 113.95 3m79 h THR 97 Ca 0.44 -1.95 0.04 0.00 0.77 0.00 0.00 66.41 65.72 3m79 h THR 97 Cb 0.41 2.53 -0.07 0.00 -1.74 0.00 0.00 68.15 69.28 3m79 h THR 97 CO -0.20 0.56 -0.46 0.00 0.37 0.00 0.00 175.52 175.79 3m79 h ASN 99 N -0.50 0.94 -0.58 0.00 -0.26 -0.80 -1.96 115.58 112.42 3m79 h ASN 99 Ca 0.07 -0.09 -0.09 0.00 -0.56 0.00 0.00 56.30 55.64 3m79 h ASN 99 Cb 0.64 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.64 3m79 h ASN 99 CO -0.44 0.78 0.02 0.00 -1.06 0.00 0.00 177.43 176.73 3m79 h ALA 100 N 1.37 0.78 -0.22 -0.83 0.00 -1.19 -1.24 119.26 117.94 3m79 h ALA 100 Ca 0.26 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3m79 h ALA 100 Cb 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3m79 h ALA 100 CO -0.04 0.60 -0.27 0.00 0.00 0.00 0.00 179.25 179.54 3m79 h HIS 102 N 0.25 0.66 -0.99 0.00 -0.00 -1.28 0.10 115.15 113.90 3m79 h HIS 102 Ca 0.03 0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.56 3m79 h HIS 102 Cb 0.83 -0.21 -0.09 0.00 -0.00 0.00 0.00 27.41 27.95 3m79 h HIS 102 CO 0.08 0.34 0.62 0.37 -0.00 0.00 0.00 177.93 179.34 3m79 h GLN 103 N 0.68 0.88 0.17 2.45 4.15 -1.26 -0.66 115.11 121.51 3m79 h GLN 103 Ca 0.27 -0.05 -0.35 0.00 0.77 0.00 0.00 58.65 59.29 3m79 h GLN 103 Cb 0.12 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.62 3m79 h GLN 103 CO -0.15 0.58 -1.80 0.87 -1.93 0.00 0.00 178.83 176.40 3m79 h LYS 104 N 0.91 0.35 0.00 1.69 1.57 -1.38 -3.44 116.57 116.27 3m79 h LYS 104 Ca 0.50 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3m79 h LYS 104 Cb 0.60 0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.13 3m79 h LYS 104 CO -0.27 1.29 0.00 0.66 -0.57 0.00 0.00 179.45 180.55 3m79 n TYR 105 N -3.59 0.00 1.60 -1.35 0.53 0.30 -5.12 117.16 109.53 3m79 n TYR 105 Ca -0.27 0.00 0.14 0.00 -1.02 0.00 0.00 57.90 56.76 3m79 n TYR 105 Cb 1.06 0.00 0.61 0.00 -1.03 0.00 0.00 39.34 39.97 3m79 n TYR 105 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71