#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l8r s ASN 2 N 0.00 5.97 0.20 7.83 2.20 -1.26 -4.76 114.94 125.13 3l8r s ASN 2 Ca 0.00 1.47 -0.07 0.00 -0.94 0.00 0.00 52.86 53.33 3l8r s ASN 2 Cb 0.00 -2.47 0.15 0.00 -2.00 0.00 0.00 41.25 36.93 3l8r s ASN 2 CO 0.00 -1.04 1.66 0.00 -2.94 0.00 0.00 177.10 174.78 3l8r h THR 3 N -0.44 1.26 -0.56 0.54 1.03 -1.99 -2.37 112.91 110.39 3l8r h THR 3 Ca -0.44 -1.16 0.01 0.00 -0.01 0.00 0.00 66.41 64.82 3l8r h THR 3 Cb 1.20 0.88 -0.03 0.00 -1.07 0.00 0.00 68.15 69.13 3l8r h THR 3 CO 0.61 0.41 0.35 -0.33 -0.01 0.00 0.00 175.52 176.55 3l8r h GLU 4 N 0.88 0.69 0.00 0.00 3.07 -2.00 -0.74 114.58 116.49 3l8r h GLU 4 Ca 0.15 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 58.89 3l8r h GLU 4 Cb 0.57 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 3l8r h GLU 4 CO 0.03 0.46 -0.37 1.05 -1.40 0.00 0.00 179.01 178.78 3l8r h GLU 5 N 0.71 0.00 -0.27 2.33 4.11 -1.93 -2.58 114.58 116.95 3l8r h GLU 5 Ca 0.21 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.51 3l8r h GLU 5 Cb -0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 3l8r h GLU 5 CO -0.07 0.37 -0.36 -0.07 0.07 0.00 0.00 179.01 178.96 3l8r h LEU 6 N 0.00 0.77 -0.96 3.06 3.38 -1.15 -1.66 115.31 118.75 3l8r h LEU 6 Ca -0.00 -0.50 0.11 0.00 0.09 0.00 0.00 57.88 57.57 3l8r h LEU 6 Cb 1.03 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.48 3l8r h LEU 6 CO 0.05 1.12 0.59 1.56 0.09 0.00 0.00 178.44 181.85 3l8r h GLN 7 N 0.44 0.92 0.03 1.13 4.20 -0.99 -0.83 115.11 120.01 3l8r h GLN 7 Ca 0.03 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3l8r h GLN 7 Cb 0.94 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.51 3l8r h GLN 7 CO 0.08 0.61 -0.01 0.28 -0.67 0.00 0.00 178.83 179.12 3l8r h VAL 8 N 0.95 1.19 -0.40 -0.54 2.07 -1.33 -0.87 116.25 117.32 3l8r h VAL 8 Ca 0.47 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.36 3l8r h VAL 8 Cb 0.44 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 3l8r h VAL 8 CO -0.26 0.17 0.14 0.00 0.02 0.00 0.00 177.57 177.64 3l8r h ALA 9 N 0.63 0.47 -0.66 1.67 0.00 -1.15 0.33 119.26 120.56 3l8r h ALA 9 Ca -0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3l8r h ALA 9 Cb 0.31 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3l8r h ALA 9 CO 0.01 -0.25 0.30 0.00 0.00 0.00 0.00 179.25 179.30 3l8r h ALA 10 N 1.27 0.85 -0.17 0.00 0.00 -1.03 -0.42 119.26 119.75 3l8r h ALA 10 Ca 0.19 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3l8r h ALA 10 Cb 0.18 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3l8r h ALA 10 CO -0.20 0.43 -0.43 0.74 0.00 0.00 0.00 179.25 179.80 3l8r h PHE 11 N 0.92 0.49 0.30 0.00 0.04 -0.37 -0.34 116.94 117.99 3l8r h PHE 11 Ca 0.22 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 3l8r h PHE 11 Cb 0.15 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 3l8r h PHE 11 CO 0.01 0.77 -0.22 1.49 -0.60 0.00 0.00 178.31 179.76 3l8r h GLU 12 N 0.34 -0.50 -0.02 1.51 4.81 0.35 0.10 114.58 121.17 3l8r h GLU 12 Ca 0.03 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 3l8r h GLU 12 Cb 0.89 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.35 3l8r h GLU 12 CO 0.07 -0.33 -0.15 0.82 -0.73 0.00 0.00 179.01 178.70 3l8r h ILE 13 N -0.51 0.63 -0.82 2.32 2.04 -0.94 -1.33 117.51 118.90 3l8r h ILE 13 Ca -0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 3l8r h ILE 13 Cb 0.44 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 3l8r h ILE 13 CO 0.01 0.00 0.54 0.40 0.00 0.00 0.00 178.15 179.09 3l8r h ILE 14 N -0.23 1.18 0.02 -0.67 2.04 -0.93 -1.11 117.51 117.81 3l8r h ILE 14 Ca 0.06 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 3l8r h ILE 14 Cb 0.31 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 3l8r h ILE 14 CO -0.16 0.20 -0.01 -0.07 0.00 0.00 0.00 178.15 178.11 3l8r h LEU 15 N 1.08 -0.02 -0.78 1.44 4.07 -0.35 0.21 115.31 120.96 3l8r h LEU 15 Ca 0.31 -0.48 -0.07 0.00 0.08 0.00 0.00 57.88 57.72 3l8r h LEU 15 Cb -0.08 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 41.64 3l8r h LEU 15 CO -0.08 0.47 0.12 0.78 -1.08 0.00 0.00 178.44 178.65 3l8r h ASN 16 N -0.52 0.99 0.03 -0.43 -0.26 -1.28 -1.88 115.58 112.23 3l8r h ASN 16 Ca -0.00 -0.22 0.02 0.00 -0.56 0.00 0.00 56.30 55.53 3l8r h ASN 16 Cb 0.50 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.47 3l8r h ASN 16 CO 0.00 0.98 -0.12 0.28 -1.06 0.00 0.00 177.43 177.51 3l8r h SER 17 N 0.98 -0.35 -0.40 5.81 0.02 -1.15 -0.01 113.55 118.44 3l8r h SER 17 Ca 0.20 0.05 0.07 0.00 -0.84 0.00 0.00 61.79 61.27 3l8r h SER 17 Cb 0.40 0.14 -0.09 0.00 0.14 0.00 0.00 62.40 63.00 3l8r h SER 17 CO 0.01 -0.18 -0.39 1.23 -1.14 0.00 0.00 176.83 176.36 3l8r h GLY 18 N -0.22 -0.43 0.74 -3.77 0.00 -0.79 1.62 103.07 100.22 3l8r h GLY 18 Ca 0.04 0.49 0.05 0.00 0.00 0.00 0.00 47.33 47.91 3l8r h GLY 18 CO -0.10 -0.19 0.44 -0.57 0.00 0.00 0.00 176.54 176.11 3l8r h ASN 19 N -0.30 0.68 -0.97 0.19 -0.00 -1.20 0.33 115.58 114.31 3l8r h ASN 19 Ca 0.15 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.47 3l8r h ASN 19 Cb 0.57 -0.12 -0.05 0.00 -0.00 0.00 0.00 38.32 38.72 3l8r h ASN 19 CO -0.56 0.44 0.61 0.00 -0.00 0.00 0.00 177.43 177.92 3l8r h ALA 20 N 1.35 1.25 -0.70 1.57 0.00 0.37 -1.62 119.26 121.48 3l8r h ALA 20 Ca 0.32 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 3l8r h ALA 20 Cb 0.14 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3l8r h ALA 20 CO -0.16 0.67 0.17 -0.09 0.00 0.00 0.00 179.25 179.83 3l8r h ARG 21 N 1.33 1.11 -0.02 0.00 2.43 0.61 -0.09 114.38 119.75 3l8r h ARG 21 Ca 0.35 -0.27 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 3l8r h ARG 21 Cb -0.10 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.29 3l8r h ARG 21 CO -0.07 0.99 -0.65 0.66 -1.51 0.00 0.00 179.97 179.39 3l8r h SER 22 N 1.05 0.11 -0.59 -3.80 4.64 -0.94 -1.68 113.55 112.33 3l8r h SER 22 Ca 0.22 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.38 3l8r h SER 22 Cb 0.37 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 3l8r h SER 22 CO 0.00 0.73 0.03 0.40 -0.87 0.00 0.00 176.83 177.13 3l8r h ILE 23 N 0.07 1.26 -0.72 0.95 2.04 -0.77 0.32 117.51 120.65 3l8r h ILE 23 Ca -0.01 -1.10 -0.06 0.00 1.00 0.00 0.00 64.86 64.70 3l8r h ILE 23 Cb 1.16 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.96 3l8r h ILE 23 CO 0.09 0.40 0.22 0.58 0.00 0.00 0.00 178.15 179.44 3l8r h VAL 24 N 0.96 1.26 -0.54 1.67 2.07 -0.86 -1.76 116.25 119.05 3l8r h VAL 24 Ca 0.18 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.74 3l8r h VAL 24 Cb 0.50 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3l8r h VAL 24 CO 0.02 0.35 0.14 0.45 0.02 0.00 0.00 177.57 178.56 3l8r h HIS 25 N 1.07 0.86 -0.89 1.57 3.86 -0.78 0.37 115.15 121.20 3l8r h HIS 25 Ca 0.23 -0.08 0.11 0.00 -1.16 0.00 0.00 60.37 59.48 3l8r h HIS 25 Cb 0.31 -0.25 -0.08 0.00 1.06 0.00 0.00 27.41 28.45 3l8r h HIS 25 CO 0.03 0.71 0.52 0.93 0.86 0.00 0.00 177.93 180.98 3l8r h GLU 26 N 0.80 0.80 0.54 2.45 5.08 0.14 0.50 114.58 124.90 3l8r h GLU 26 Ca 0.18 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 3l8r h GLU 26 Cb 0.28 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.36 3l8r h GLU 26 CO -0.00 0.53 -0.26 0.00 -1.00 0.00 0.00 179.01 178.28 3l8r h ALA 27 N 1.50 -0.73 -0.74 3.43 0.00 -0.48 0.72 119.26 122.97 3l8r h ALA 27 Ca 0.44 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 55.33 3l8r h ALA 27 Cb 0.46 0.28 -0.12 0.00 0.00 0.00 0.00 17.79 18.41 3l8r h ALA 27 CO -0.27 -0.80 0.09 0.74 0.00 0.00 0.00 179.25 179.00 3l8r h PHE 28 N -0.94 0.10 -0.32 0.00 0.04 -0.40 0.82 116.94 116.24 3l8r h PHE 28 Ca -0.07 0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.80 3l8r h PHE 28 Cb 0.63 0.07 -0.05 0.00 2.20 0.00 0.00 35.95 38.80 3l8r h PHE 28 CO -0.00 -0.17 0.01 -0.44 -0.60 0.00 0.00 178.31 177.11 3l8r h ASP 29 N 0.17 -0.10 -0.68 2.17 3.32 0.29 -2.57 116.42 119.03 3l8r h ASP 29 Ca 0.41 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.52 3l8r h ASP 29 Cb 0.73 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.36 3l8r h ASP 29 CO -0.59 -0.02 0.38 0.00 -1.72 0.00 0.00 179.24 177.29 3l8r h ALA 30 N 1.27 1.36 -0.46 3.45 0.00 0.92 -1.85 119.26 123.96 3l8r h ALA 30 Ca 0.16 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3l8r h ALA 30 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3l8r h ALA 30 CO -0.25 0.52 0.31 1.98 0.00 0.00 0.00 179.25 181.81 3l8r h MET 31 N 0.97 0.60 0.00 0.00 -1.53 -0.54 -2.36 114.93 112.06 3l8r h MET 31 Ca 0.25 -0.04 -0.20 0.00 -3.44 0.00 0.00 59.70 56.27 3l8r h MET 31 Cb 0.03 -0.14 -0.03 0.00 -0.55 0.00 0.00 31.60 30.91 3l8r h MET 31 CO -0.04 0.40 -0.94 0.00 0.14 0.00 0.00 176.91 176.47 3l8r h ARG 32 N 0.62 0.00 0.00 0.39 3.08 -0.97 -3.00 114.38 114.50 3l8r h ARG 32 Ca 0.17 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 3l8r h ARG 32 Cb -0.06 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 3l8r h ARG 32 CO -0.04 0.94 -0.11 0.93 -1.07 0.00 0.00 179.97 180.62 3l8r h GLU 33 N 0.00 0.00 0.00 0.04 5.08 -1.22 -3.47 114.58 115.01 3l8r h GLU 33 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3l8r h GLU 33 Cb 1.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.92 3l8r h GLU 33 CO 0.12 0.11 0.00 1.63 -1.00 0.00 0.00 179.01 179.87 3l8r n LYS 34 N -3.19 0.00 -2.31 2.33 5.02 -0.96 -5.03 118.16 114.01 3l8r n LYS 34 Ca 0.01 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.96 3l8r n LYS 34 Cb 0.44 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.41 3l8r n LYS 34 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3l8r s ASN 35 N -1.94 5.87 0.09 4.39 3.84 -0.95 -4.76 114.94 121.48 3l8r s ASN 35 Ca 0.00 -1.31 0.21 0.00 0.21 0.00 0.00 52.86 51.97 3l8r s ASN 35 Cb 0.00 -2.57 0.86 0.00 -0.55 0.00 0.00 41.25 38.99 3l8r s ASN 35 CO 0.00 -2.11 1.66 -1.22 -2.79 0.00 0.00 177.10 172.63 3l8r n TYR 36 N 11.36 0.33 0.03 0.43 4.01 -1.26 -2.60 117.16 129.46 3l8r n TYR 36 Ca 0.39 0.12 -0.21 0.00 -0.16 0.00 0.00 57.90 58.04 3l8r n TYR 36 Cb 0.48 -0.69 -0.14 0.00 -0.31 0.00 0.00 39.34 38.68 3l8r n TYR 36 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 3l8r h ILE 37 N 0.00 1.29 0.20 -0.72 2.04 -1.95 -2.66 117.51 115.71 3l8r h ILE 37 Ca 0.00 -2.47 -0.01 0.00 1.00 0.00 0.00 64.86 63.38 3l8r h ILE 37 Cb 0.39 2.96 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 3l8r h ILE 37 CO 0.00 0.70 -0.10 0.25 0.00 0.00 0.00 178.15 179.00 3l8r h LEU 38 N -0.37 -0.23 -0.65 1.44 5.85 -1.93 -1.85 115.31 117.57 3l8r h LEU 38 Ca -0.22 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.39 3l8r h LEU 38 Cb 1.68 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 42.69 3l8r h LEU 38 CO 0.10 0.04 -0.40 0.00 -0.34 0.00 0.00 178.44 177.84 3l8r h ALA 39 N 0.23 -0.40 -0.81 1.25 0.00 -1.64 0.10 119.26 118.00 3l8r h ALA 39 Ca -0.03 0.07 0.18 0.00 0.00 0.00 0.00 54.91 55.13 3l8r h ALA 39 Cb 0.38 1.24 -0.15 0.00 0.00 0.00 0.00 17.79 19.26 3l8r h ALA 39 CO 0.05 -0.67 -0.10 1.49 0.00 0.00 0.00 179.25 180.01 3l8r h GLU 40 N -0.02 0.04 -0.17 0.00 4.81 -1.32 0.20 114.58 118.10 3l8r h GLU 40 Ca 0.10 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3l8r h GLU 40 Cb 0.29 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3l8r h GLU 40 CO -0.62 0.02 0.08 1.96 -0.73 0.00 0.00 179.01 179.72 3l8r h GLN 41 N 0.04 0.25 -0.80 1.92 4.20 -0.41 -2.71 115.11 117.60 3l8r h GLN 41 Ca 0.42 -0.04 0.14 0.00 0.06 0.00 0.00 58.65 59.23 3l8r h GLN 41 Cb 0.71 -0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.36 3l8r h GLN 41 CO -0.78 0.30 0.39 0.87 -0.67 0.00 0.00 178.83 178.94 3l8r h LYS 42 N 0.15 0.55 0.00 1.46 1.79 0.74 0.32 116.57 121.58 3l8r h LYS 42 Ca 0.06 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 3l8r h LYS 42 Cb 0.13 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 3l8r h LYS 42 CO -0.01 0.37 -0.18 -0.07 -1.08 0.00 0.00 179.45 178.48 3l8r h LEU 43 N 0.57 0.00 0.14 2.94 3.38 -0.42 0.49 115.31 122.40 3l8r h LEU 43 Ca 0.43 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.22 3l8r h LEU 43 Cb 0.61 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.38 3l8r h LEU 43 CO -0.36 0.18 -0.84 -0.61 0.09 0.00 0.00 178.44 176.89 3l8r h GLN 44 N 0.00 0.29 -0.84 1.13 4.15 -0.61 -2.16 115.11 117.07 3l8r h GLN 44 Ca -0.00 -0.49 -0.01 0.00 0.77 0.00 0.00 58.65 58.92 3l8r h GLN 44 Cb 0.35 0.18 -0.04 0.00 0.21 0.00 0.00 27.48 28.18 3l8r h GLN 44 CO 0.02 1.23 0.47 0.93 -1.93 0.00 0.00 178.83 179.56 3l8r h GLU 45 N -0.39 1.17 -0.07 1.69 5.08 0.05 -0.88 114.58 121.22 3l8r h GLU 45 Ca -0.15 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.11 3l8r h GLU 45 Cb 1.63 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 30.61 3l8r h GLU 45 CO 0.14 0.85 -0.14 0.00 -1.00 0.00 0.00 179.01 178.86 3l8r h ALA 46 N 1.25 -0.10 -0.11 3.43 0.00 -0.11 -2.25 119.26 121.37 3l8r h ALA 46 Ca 0.30 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.28 3l8r h ALA 46 Cb 0.01 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3l8r h ALA 46 CO -0.05 -0.61 -0.23 -0.97 0.00 0.00 0.00 179.25 177.39 3l8r h ASN 47 N -0.20 -0.70 -0.99 0.00 -1.24 -1.00 -1.09 115.58 110.36 3l8r h ASN 47 Ca 0.07 0.11 0.24 0.00 0.71 0.00 0.00 56.30 57.44 3l8r h ASN 47 Cb 0.30 0.31 -0.13 0.00 0.73 0.00 0.00 38.32 39.53 3l8r h ASN 47 CO -0.19 -0.28 0.56 0.44 -1.29 0.00 0.00 177.43 176.67 3l8r h ASP 48 N -0.30 0.62 0.28 1.15 3.32 -0.82 0.24 116.42 120.90 3l8r h ASP 48 Ca 0.10 0.14 -0.22 0.00 0.02 0.00 0.00 57.03 57.07 3l8r h ASP 48 Cb 0.44 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3l8r h ASP 48 CO -0.29 0.08 -0.90 -0.33 -1.72 0.00 0.00 179.24 176.08 3l8r h GLU 49 N 0.54 0.45 -0.26 3.56 4.39 -0.89 -3.26 114.58 119.11 3l8r h GLU 49 Ca 0.64 -0.45 -0.11 0.00 0.34 0.00 0.00 59.36 59.77 3l8r h GLU 49 Cb 1.22 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 3l8r h GLU 49 CO -0.49 1.11 -0.30 1.25 -1.16 0.00 0.00 179.01 179.41 3l8r h LEU 50 N 0.27 0.55 -1.67 1.33 5.85 0.51 -2.46 115.31 119.68 3l8r h LEU 50 Ca -0.07 -0.21 0.13 0.00 0.84 0.00 0.00 57.88 58.57 3l8r h LEU 50 Cb 1.53 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.37 3l8r h LEU 50 CO 0.16 0.83 0.45 -0.07 -0.34 0.00 0.00 178.44 179.47 3l8r h LEU 51 N 0.46 0.31 -0.06 2.25 4.07 -0.71 0.64 115.31 122.28 3l8r h LEU 51 Ca 0.06 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.95 3l8r h LEU 51 Cb 0.76 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.45 3l8r h LEU 51 CO 0.06 0.17 -0.29 0.50 -1.08 0.00 0.00 178.44 177.80 3l8r h LYS 52 N 0.34 0.29 -0.73 1.13 3.64 -1.52 -0.63 116.57 119.10 3l8r h LYS 52 Ca 0.32 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 3l8r h LYS 52 Cb 0.78 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 3l8r h LYS 52 CO -0.08 0.89 0.39 0.00 -2.27 0.00 0.00 179.45 178.38 3l8r h ALA 53 N 0.41 0.93 -0.44 5.00 0.00 -0.96 -2.61 119.26 121.59 3l8r h ALA 53 Ca -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3l8r h ALA 53 Cb 0.95 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3l8r h ALA 53 CO 0.06 0.45 0.13 1.25 0.00 0.00 0.00 179.25 181.14 3l8r h HIS 54 N 1.00 0.64 -0.04 0.00 -0.00 0.27 -1.73 115.15 115.30 3l8r h HIS 54 Ca 0.26 -0.04 -0.19 0.00 -0.00 0.00 0.00 60.37 60.39 3l8r h HIS 54 Cb 0.05 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 3l8r h HIS 54 CO -0.00 0.54 -0.80 0.37 -0.00 0.00 0.00 177.93 178.04 3l8r h GLN 55 N 0.63 0.34 -0.12 5.26 5.75 -0.93 -0.10 115.11 125.93 3l8r h GLN 55 Ca 0.15 -0.31 -0.00 0.00 -0.15 0.00 0.00 58.65 58.33 3l8r h GLN 55 Cb 0.20 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 3l8r h GLN 55 CO -0.01 0.98 0.07 0.00 -2.65 0.00 0.00 178.83 177.22 3l8r h ALA 56 N 0.92 0.16 -0.86 3.38 0.00 -1.08 0.11 119.26 121.89 3l8r h ALA 56 Ca -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3l8r h ALA 56 Cb 1.40 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 3l8r h ALA 56 CO 0.13 -0.32 0.56 0.37 0.00 0.00 0.00 179.25 180.00 3l8r h GLN 57 N 0.12 1.13 -0.43 0.00 4.15 -1.09 -0.21 115.11 118.79 3l8r h GLN 57 Ca 0.04 -0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.43 3l8r h GLN 57 Cb 0.05 -0.25 -0.04 0.00 0.21 0.00 0.00 27.48 27.45 3l8r h GLN 57 CO -0.01 0.76 0.19 1.15 -1.93 0.00 0.00 178.83 178.99 3l8r h THR 58 N 1.16 0.92 -0.33 2.39 2.02 -0.54 -1.30 112.91 117.24 3l8r h THR 58 Ca 0.31 -0.13 0.05 0.00 0.77 0.00 0.00 66.41 67.41 3l8r h THR 58 Cb -0.12 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 3l8r h THR 58 CO -0.07 0.07 0.05 0.44 0.37 0.00 0.00 175.52 176.39 3l8r h ASP 59 N 0.38 -0.01 -0.90 4.18 3.45 0.94 -0.73 116.42 123.73 3l8r h ASP 59 Ca 0.19 0.06 0.04 0.00 0.43 0.00 0.00 57.03 57.75 3l8r h ASP 59 Cb 0.14 0.08 -0.05 0.00 -0.56 0.00 0.00 39.33 38.94 3l8r h ASP 59 CO -0.16 0.03 0.59 -0.07 -1.57 0.00 0.00 179.24 178.06 3l8r h LEU 60 N 0.17 0.96 -0.53 1.55 3.38 -0.57 -2.01 115.31 118.26 3l8r h LEU 60 Ca 0.16 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 3l8r h LEU 60 Cb 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3l8r h LEU 60 CO -0.21 0.65 -0.32 -0.07 0.09 0.00 0.00 178.44 178.58 3l8r h LEU 61 N 1.11 0.89 -0.03 1.67 3.38 -0.09 -3.30 115.31 118.94 3l8r h LEU 61 Ca 0.36 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3l8r h LEU 61 Cb 0.05 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 3l8r h LEU 61 CO -0.12 1.13 0.01 1.56 0.09 0.00 0.00 178.44 181.11 3l8r h GLN 62 N 0.71 0.04 -6.73 1.13 4.20 -0.76 -3.37 115.11 110.33 3l8r h GLN 62 Ca 0.08 -0.01 -0.53 0.00 0.06 0.00 0.00 58.65 58.25 3l8r h GLN 62 Cb 0.87 -0.01 0.06 0.00 0.30 0.00 0.00 27.48 28.71 3l8r h GLN 62 CO 0.08 0.27 0.86 -2.00 -0.67 0.00 0.00 178.83 177.37 3l8r s GLU 63 N -5.22 4.18 0.00 1.46 2.56 -0.80 -3.40 118.70 117.49 3l8r s GLU 63 Ca -0.14 2.46 0.00 0.00 0.00 0.00 0.00 54.97 57.28 3l8r s GLU 63 Cb 0.04 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 33.09 3l8r s GLU 63 CO 0.67 -0.58 0.00 0.98 -0.56 0.00 0.00 175.26 175.78 3l8r n TYR 64 N 2.77 0.00 0.00 5.30 9.36 -1.25 -4.71 117.16 128.63 3l8r n TYR 64 Ca 0.10 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.32 3l8r n TYR 64 Cb 0.38 -0.70 0.00 0.00 -0.63 0.00 0.00 39.34 38.39 3l8r n TYR 64 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3l8r n ALA 65 N -0.31 0.00 0.22 2.98 0.00 -1.26 -4.44 120.51 117.71 3l8r n ALA 65 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3l8r n ALA 65 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 3l8r n ALA 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3l8r h SER 66 N 0.00 -0.48 0.00 0.00 4.64 -1.84 -3.49 113.55 112.38 3l8r h SER 66 Ca 0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3l8r h SER 66 Cb 0.00 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3l8r h SER 66 CO 0.00 -0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.42 3l8r n GLY 67 N -0.58 0.16 3.63 -0.77 0.00 -1.26 -5.15 105.19 101.21 3l8r n GLY 67 Ca -0.10 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.43 3l8r n GLY 67 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3l8r n THR 68 N 0.00 0.10 -2.36 2.61 -1.04 -1.26 -4.79 114.28 107.53 3l8r n THR 68 Ca 0.00 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.56 3l8r n THR 68 Cb 0.00 -1.15 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 3l8r n THR 68 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 3l8r s GLU 69 N 0.56 4.38 -0.26 -2.82 -6.30 -1.26 -3.78 118.70 109.23 3l8r s GLU 69 Ca 0.81 1.82 0.01 0.00 -2.50 0.00 0.00 54.97 55.11 3l8r s GLU 69 Cb -0.82 -3.39 0.07 0.00 0.00 0.00 0.00 34.13 29.99 3l8r s GLU 69 CO 0.44 -0.35 -0.02 0.42 0.02 0.00 0.00 175.26 175.76 3l8r s ILE 70 N 1.42 1.56 0.12 -3.70 1.01 -1.26 -2.93 121.20 117.42 3l8r s ILE 70 Ca 0.60 -1.41 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 3l8r s ILE 70 Cb -0.30 -1.91 -0.07 0.00 0.01 0.00 0.00 42.46 40.19 3l8r s ILE 70 CO 0.28 -0.24 1.15 -0.75 0.00 0.00 0.00 174.94 175.38 3l8r s LYS 71 N 1.35 4.51 -0.26 2.79 2.20 -1.26 -4.99 119.74 124.07 3l8r s LYS 71 Ca -0.02 1.75 -0.20 0.00 -0.36 0.00 0.00 55.97 57.14 3l8r s LYS 71 Cb -0.19 -3.31 -0.02 0.00 -1.51 0.00 0.00 37.83 32.80 3l8r s LYS 71 CO -0.09 -0.10 0.61 0.42 -0.36 0.00 0.00 175.35 175.83 3l8r s ILE 72 N 0.42 5.00 0.36 5.43 -1.09 -1.26 -5.07 121.20 124.99 3l8r s ILE 72 Ca 0.54 1.07 0.01 0.00 -2.23 0.00 0.00 60.65 60.04 3l8r s ILE 72 Cb -0.29 -3.92 -0.03 0.00 -1.58 0.00 0.00 42.46 36.64 3l8r s ILE 72 CO 0.32 0.03 0.56 -1.61 -1.23 0.00 0.00 174.94 173.02 3l8r s GLU 73 N 2.48 3.40 0.37 2.79 0.41 -1.26 -5.01 118.70 121.88 3l8r s GLU 73 Ca 0.25 -0.39 0.05 0.00 -0.41 0.00 0.00 54.97 54.48 3l8r s GLU 73 Cb -0.15 -2.65 0.74 0.00 -1.78 0.00 0.00 34.13 30.28 3l8r s GLU 73 CO 0.09 0.08 2.00 0.97 -0.49 0.00 0.00 175.26 177.91 3l8r h ILE 74 N 0.70 1.08 -0.04 -1.63 2.10 -1.99 -1.66 117.51 116.07 3l8r h ILE 74 Ca -0.49 -0.25 -0.08 0.00 1.08 0.00 0.00 64.86 65.12 3l8r h ILE 74 Cb 1.23 0.28 -0.01 0.00 -1.09 0.00 0.00 36.82 37.22 3l8r h ILE 74 CO 0.60 0.13 -0.34 0.16 -1.08 0.00 0.00 178.15 177.62 3l8r h ILE 75 N 0.74 1.26 0.13 2.19 3.07 -1.98 -0.92 117.51 121.99 3l8r h ILE 75 Ca 0.25 -1.25 -0.01 0.00 1.55 0.00 0.00 64.86 65.41 3l8r h ILE 75 Cb 0.08 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 3l8r h ILE 75 CO -0.07 0.36 -0.06 -0.03 -1.05 0.00 0.00 178.15 177.30 3l8r h MET 76 N 0.07 -0.16 -0.90 0.16 4.05 -1.69 0.18 114.93 116.63 3l8r h MET 76 Ca 0.01 0.01 0.17 0.00 -0.28 0.00 0.00 59.70 59.61 3l8r h MET 76 Cb 0.64 0.04 -0.10 0.00 -0.80 0.00 0.00 31.60 31.38 3l8r h MET 76 CO 0.05 0.15 0.48 0.28 0.23 0.00 0.00 176.91 178.10 3l8r h VAL 77 N -0.49 0.69 -0.40 -5.77 2.07 -1.24 0.33 116.25 111.44 3l8r h VAL 77 Ca -0.02 -0.22 -0.11 0.00 0.82 0.00 0.00 66.70 67.18 3l8r h VAL 77 Cb 0.39 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 3l8r h VAL 77 CO 0.03 0.12 -0.17 -0.74 0.02 0.00 0.00 177.57 176.83 3l8r h HIS 78 N 0.63 0.93 -0.36 1.57 6.17 -0.75 0.19 115.15 123.53 3l8r h HIS 78 Ca 0.51 -0.22 -0.03 0.00 0.71 0.00 0.00 60.37 61.34 3l8r h HIS 78 Cb 0.78 -0.22 -0.02 0.00 2.52 0.00 0.00 27.41 30.48 3l8r h HIS 78 CO -0.07 0.97 0.12 0.00 0.71 0.00 0.00 177.93 179.66 3l8r h ALA 79 N 0.82 0.47 -0.79 5.26 0.00 0.72 -1.64 119.26 124.09 3l8r h ALA 79 Ca 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3l8r h ALA 79 Cb 0.71 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3l8r h ALA 79 CO 0.05 0.10 0.40 1.96 0.00 0.00 0.00 179.25 181.77 3l8r h GLN 80 N 0.43 1.13 -0.62 0.00 4.20 -0.00 -0.35 115.11 119.90 3l8r h GLN 80 Ca 0.12 -0.15 0.02 0.00 0.06 0.00 0.00 58.65 58.69 3l8r h GLN 80 Cb 0.24 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 3l8r h GLN 80 CO -0.00 0.86 0.41 -0.44 -0.67 0.00 0.00 178.83 178.98 3l8r h ASP 81 N 1.11 0.67 -0.11 1.46 3.32 -0.30 -1.03 116.42 121.53 3l8r h ASP 81 Ca 0.27 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.18 3l8r h ASP 81 Cb 0.09 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.48 3l8r h ASP 81 CO -0.04 0.47 -0.46 -0.74 -1.72 0.00 0.00 179.24 176.75 3l8r h HIS 82 N 0.78 0.68 0.15 4.55 2.76 -0.31 0.56 115.15 124.31 3l8r h HIS 82 Ca 0.24 -0.29 -0.01 0.00 -2.20 0.00 0.00 60.37 58.11 3l8r h HIS 82 Cb -0.00 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 28.85 3l8r h HIS 82 CO -0.00 1.06 -0.07 1.25 -1.30 0.00 0.00 177.93 178.86 3l8r h LEU 83 N 0.11 -0.17 0.04 0.26 5.85 -0.76 0.43 115.31 121.06 3l8r h LEU 83 Ca -0.03 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 3l8r h LEU 83 Cb 1.10 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.17 3l8r h LEU 83 CO 0.10 0.03 -0.02 0.24 -0.34 0.00 0.00 178.44 178.45 3l8r h MET 84 N -0.37 -0.05 -0.92 1.25 2.86 -1.19 0.19 114.93 116.70 3l8r h MET 84 Ca -0.02 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.74 3l8r h MET 84 Cb 0.29 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.89 3l8r h MET 84 CO 0.03 0.39 0.59 1.79 1.06 0.00 0.00 176.91 180.77 3l8r h THR 85 N -0.49 0.90 -0.62 2.22 1.35 -0.96 -1.78 112.91 113.53 3l8r h THR 85 Ca -0.00 -0.29 -0.05 0.00 -0.55 0.00 0.00 66.41 65.51 3l8r h THR 85 Cb 0.46 -0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.84 3l8r h THR 85 CO 0.01 0.15 0.17 0.74 -0.25 0.00 0.00 175.52 176.34 3l8r h THR 86 N 0.83 1.25 -0.03 6.82 2.02 0.37 -1.51 112.91 122.66 3l8r h THR 86 Ca 0.45 -0.88 0.04 0.00 0.77 0.00 0.00 66.41 66.79 3l8r h THR 86 Cb 0.56 0.64 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 3l8r h THR 86 CO -0.21 0.33 -0.30 0.24 0.37 0.00 0.00 175.52 175.95 3l8r h MET 87 N 0.90 -0.41 -0.76 6.66 2.86 -0.22 -0.86 114.93 123.10 3l8r h MET 87 Ca 0.20 0.03 0.13 0.00 -2.06 0.00 0.00 59.70 58.00 3l8r h MET 87 Cb 0.32 0.09 -0.09 0.00 0.06 0.00 0.00 31.60 31.99 3l8r h MET 87 CO -0.00 -0.28 0.33 1.15 1.06 0.00 0.00 176.91 179.17 3l8r h THR 88 N -0.43 0.71 -0.59 2.22 2.02 -1.14 -0.70 112.91 115.00 3l8r h THR 88 Ca 0.07 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 3l8r h THR 88 Cb 0.53 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 3l8r h THR 88 CO -0.27 0.09 0.21 0.25 0.37 0.00 0.00 175.52 176.17 3l8r h LEU 89 N 0.50 0.84 0.22 2.58 5.85 -0.74 0.12 115.31 124.68 3l8r h LEU 89 Ca 0.41 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3l8r h LEU 89 Cb 0.58 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3l8r h LEU 89 CO -0.37 0.80 -0.11 -0.09 -0.34 0.00 0.00 178.44 178.32 3l8r h ARG 90 N 0.83 -0.30 -0.95 1.25 2.43 -0.33 0.50 114.38 117.80 3l8r h ARG 90 Ca 0.19 0.02 0.19 0.00 -0.81 0.00 0.00 59.98 59.57 3l8r h ARG 90 Cb 0.24 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 29.75 3l8r h ARG 90 CO -0.01 -0.20 0.54 0.93 -1.51 0.00 0.00 179.97 179.72 3l8r h GLU 91 N -0.31 0.65 -0.46 0.20 5.08 -0.72 0.59 114.58 119.61 3l8r h GLU 91 Ca -0.03 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 3l8r h GLU 91 Cb 0.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3l8r h GLU 91 CO 0.04 0.43 -0.19 0.28 -1.00 0.00 0.00 179.01 178.57 3l8r h VAL 92 N 0.67 1.27 -0.09 3.13 2.07 0.07 -2.61 116.25 120.77 3l8r h VAL 92 Ca 0.55 -1.35 0.02 0.00 0.82 0.00 0.00 66.70 66.75 3l8r h VAL 92 Cb 0.89 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 3l8r h VAL 92 CO -0.40 0.46 -0.07 0.00 0.02 0.00 0.00 177.57 177.58 3l8r h ALA 93 N 0.86 0.01 -0.14 1.67 0.00 0.51 0.69 119.26 122.85 3l8r h ALA 93 Ca 0.11 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3l8r h ALA 93 Cb 0.76 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 3l8r h ALA 93 CO 0.06 -0.53 -0.32 0.82 0.00 0.00 0.00 179.25 179.28 3l8r h ILE 94 N -0.08 0.00 -0.87 0.00 2.04 -0.76 0.45 117.51 118.29 3l8r h ILE 94 Ca 0.06 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.12 3l8r h ILE 94 Cb 0.16 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.12 3l8r h ILE 94 CO -0.13 0.00 0.36 -0.33 0.00 0.00 0.00 178.15 178.05 3l8r h GLU 95 N -0.30 0.39 -0.32 2.37 4.39 -1.28 -1.36 114.58 118.46 3l8r h GLU 95 Ca 0.03 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 3l8r h GLU 95 Cb 0.38 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 3l8r h GLU 95 CO -0.29 0.26 -0.32 0.52 -1.16 0.00 0.00 179.01 178.01 3l8r h MET 96 N 0.40 0.79 -0.65 2.33 2.86 0.11 -2.43 114.93 118.34 3l8r h MET 96 Ca 0.53 -0.42 0.12 0.00 -2.06 0.00 0.00 59.70 57.88 3l8r h MET 96 Cb 0.98 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.56 3l8r h MET 96 CO -0.51 1.05 0.18 1.25 1.06 0.00 0.00 176.91 179.93 3l8r h LEU 97 N 0.56 0.08 -1.14 1.22 5.85 0.91 0.65 115.31 123.45 3l8r h LEU 97 Ca 0.05 0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3l8r h LEU 97 Cb 0.90 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 3l8r h LEU 97 CO 0.08 0.04 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.56 3l8r h GLU 98 N 0.32 0.18 0.00 1.25 4.39 -1.20 -2.54 114.58 116.97 3l8r h GLU 98 Ca 0.35 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.97 3l8r h GLU 98 Cb 0.52 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.16 3l8r h GLU 98 CO -0.40 0.49 -0.04 1.25 -1.16 0.00 0.00 179.01 179.15 3l8r h LEU 99 N 0.16 0.00 -0.28 1.33 7.12 -0.79 -3.27 115.31 119.58 3l8r h LEU 99 Ca 0.02 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.96 3l8r h LEU 99 Cb 0.66 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.78 3l8r h LEU 99 CO 0.05 0.02 -0.11 1.88 -0.13 0.00 0.00 178.44 180.14 3l8r h TYR 100 N 0.00 0.66 -0.24 1.25 0.05 -0.48 -3.37 116.97 114.84 3l8r h TYR 100 Ca -0.00 -0.16 -0.04 0.00 0.05 0.00 0.00 58.73 58.58 3l8r h TYR 100 Cb 1.01 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.59 3l8r h TYR 100 CO 0.00 0.80 0.13 0.15 -1.05 0.00 0.00 178.16 178.19 3l8r s LYS 101 N -4.66 1.44 0.00 4.88 1.02 -1.16 -5.11 119.74 116.15 3l8r s LYS 101 Ca -0.13 -0.16 0.00 0.00 0.02 0.00 0.00 55.97 55.70 3l8r s LYS 101 Cb 0.08 -4.93 0.00 0.00 -0.52 0.00 0.00 37.83 32.46 3l8r s LYS 101 CO 0.79 -5.00 0.00 1.63 -0.92 0.00 0.00 175.35 171.85