#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mcd s THR 17 N 0.00 0.00 0.87 0.00 -1.32 -1.26 -5.13 115.64 108.80 3mcd s THR 17 Ca 0.00 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.35 3mcd s THR 17 Cb 0.00 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.13 3mcd s THR 17 CO 0.00 0.00 1.22 -1.81 -2.21 0.00 0.00 174.62 171.82 3mcd s ASP 18 N -1.25 3.83 -0.09 8.08 1.01 -1.26 -5.00 116.67 121.99 3mcd s ASP 18 Ca -0.02 0.41 -0.16 0.00 0.71 0.00 0.00 52.55 53.50 3mcd s ASP 18 Cb -0.00 -0.69 0.04 0.00 1.01 0.00 0.00 42.92 43.27 3mcd s ASP 18 CO 0.01 -2.29 0.39 0.00 0.21 0.00 0.00 175.17 173.50 3mcd s ARG 19 N -5.67 0.61 0.16 8.23 1.70 -1.26 -3.76 118.95 118.96 3mcd s ARG 19 Ca 0.68 0.23 0.06 0.00 -0.47 0.00 0.00 55.73 56.22 3mcd s ARG 19 Cb -0.07 0.28 -0.04 0.00 -0.57 0.00 0.00 34.95 34.55 3mcd s ARG 19 CO 0.50 -0.13 0.09 -1.17 -1.08 0.00 0.00 175.30 173.51 3mcd s LEU 20 N -0.55 3.64 -0.14 -1.89 2.96 -0.79 -4.99 118.68 116.92 3mcd s LEU 20 Ca -0.07 -0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 53.58 3mcd s LEU 20 Cb -0.04 -2.27 0.07 0.00 0.50 0.00 0.00 46.19 44.45 3mcd s LEU 20 CO 0.03 0.08 0.30 -0.75 -1.32 0.00 0.00 176.35 174.69 3mcd s LYS 21 N -3.00 0.20 -0.27 1.98 2.20 -1.26 0.20 119.74 119.79 3mcd s LYS 21 Ca 0.30 0.79 -0.06 0.00 -0.36 0.00 0.00 55.97 56.63 3mcd s LYS 21 Cb -0.10 0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.25 3mcd s LYS 21 CO 0.22 -0.26 0.05 -1.17 -0.36 0.00 0.00 175.35 173.83 3mcd s LEU 22 N 2.31 3.53 -0.15 5.43 0.20 -0.26 -5.00 118.68 124.74 3mcd s LEU 22 Ca -0.01 -0.49 -0.00 0.00 0.69 0.00 0.00 54.13 54.32 3mcd s LEU 22 Cb -0.12 -1.87 -0.01 0.00 -0.43 0.00 0.00 46.19 43.77 3mcd s LEU 22 CO -0.10 -0.11 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.09 3mcd s ILE 23 N 1.53 2.86 -0.22 6.68 1.01 -1.26 -1.14 121.20 130.65 3mcd s ILE 23 Ca 0.04 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.91 3mcd s ILE 23 Cb -0.16 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 3mcd s ILE 23 CO 0.02 0.51 0.06 -0.76 0.00 0.00 0.00 174.94 174.77 3mcd s LEU 24 N 0.66 3.51 0.15 2.97 1.43 -0.80 -5.01 118.68 121.59 3mcd s LEU 24 Ca -0.07 -0.13 0.10 0.00 -1.03 0.00 0.00 54.13 53.00 3mcd s LEU 24 Cb -0.16 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 3mcd s LEU 24 CO 0.02 0.03 -0.20 0.00 0.23 0.00 0.00 176.35 176.44 3mcd s ALA 25 N 1.21 2.63 0.04 4.21 0.00 -1.26 -2.17 121.76 126.41 3mcd s ALA 25 Ca 0.04 -1.47 -0.05 0.00 0.00 0.00 0.00 51.96 50.48 3mcd s ALA 25 Cb -0.14 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.46 3mcd s ALA 25 CO 0.03 0.52 0.25 0.36 0.00 0.00 0.00 175.76 176.92 3mcd n LYS 26 N 0.57 0.15 -3.75 0.00 2.85 -1.20 -5.07 118.16 111.70 3mcd n LYS 26 Ca -0.15 -0.35 -0.37 0.00 -1.05 0.00 0.00 58.31 56.40 3mcd n LYS 26 Cb 0.54 0.48 -0.06 0.00 -0.65 0.00 0.00 35.03 35.34 3mcd n LYS 26 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3mcd s GLU 27 N -2.01 3.60 0.00 -1.58 2.02 -1.26 -3.66 118.70 115.80 3mcd s GLU 27 Ca 0.06 0.02 0.11 0.00 0.02 0.00 0.00 54.97 55.18 3mcd s GLU 27 Cb -0.01 -3.17 0.65 0.00 0.10 0.00 0.00 34.13 31.70 3mcd s GLU 27 CO 0.01 0.73 1.07 -2.13 0.02 0.00 0.00 175.26 174.96 3mcd n ARG 28 N 1.73 0.37 0.14 1.61 0.63 -1.26 -2.56 116.66 117.32 3mcd n ARG 28 Ca -0.16 0.00 -0.23 0.00 -0.92 0.00 0.00 57.85 56.53 3mcd n ARG 28 Cb 0.54 -1.45 -0.16 0.00 0.45 0.00 0.00 32.46 31.84 3mcd n ARG 28 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 3mcd h THR 29 N 0.00 1.30 -4.23 5.15 2.02 -2.01 -3.48 112.91 111.66 3mcd h THR 29 Ca 0.00 -2.75 -0.49 0.00 0.77 0.00 0.00 66.41 63.93 3mcd h THR 29 Cb 0.00 3.01 0.06 0.00 -1.74 0.00 0.00 68.15 69.48 3mcd h THR 29 CO 0.00 0.83 0.38 -0.76 0.37 0.00 0.00 175.52 176.33 3mcd s LEU 30 N -7.49 3.43 -0.48 2.58 1.43 -1.06 -5.04 118.68 112.05 3mcd s LEU 30 Ca -0.09 1.72 0.03 0.00 -1.03 0.00 0.00 54.13 54.77 3mcd s LEU 30 Cb 0.05 -4.52 0.13 0.00 0.03 0.00 0.00 46.19 41.88 3mcd s LEU 30 CO 0.93 -1.13 0.25 0.21 0.23 0.00 0.00 176.35 176.85 3mcd s ASN 31 N -3.09 3.93 -0.75 2.29 3.84 -1.26 -5.02 114.94 114.89 3mcd s ASN 31 Ca 0.61 -2.81 -0.23 0.00 0.21 0.00 0.00 52.86 50.64 3mcd s ASN 31 Cb -0.14 -1.29 0.06 0.00 -0.55 0.00 0.00 41.25 39.33 3mcd s ASN 31 CO 0.40 -0.25 1.12 -0.76 -2.79 0.00 0.00 177.10 174.82 3mcd s LEU 32 N 0.05 4.04 0.00 3.21 1.43 -1.26 -4.84 118.68 121.32 3mcd s LEU 32 Ca 0.18 -1.01 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 3mcd s LEU 32 Cb -0.25 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.50 3mcd s LEU 32 CO -0.00 -1.52 0.09 -0.81 0.23 0.00 0.00 176.35 174.34 3mcd n PRO 33 N 8.15 0.10 -0.35 1.29 -0.04 -1.26 -0.28 135.00 142.61 3mcd n PRO 33 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 3mcd n PRO 33 Cb 0.47 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 3mcd n PRO 33 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3mcd n TYR 34 N -0.27 0.00 0.00 0.54 0.18 -1.26 -4.99 117.16 111.35 3mcd n TYR 34 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3mcd n TYR 34 Cb 0.01 0.08 0.00 0.00 -0.38 0.00 0.00 39.34 39.05 3mcd n TYR 34 CO 0.00 0.00 0.00 -0.12 -2.08 0.00 0.00 176.86 174.66 3mcd n MET 35 N 0.00 0.00 -2.24 -3.48 1.56 0.62 -2.91 117.12 110.66 3mcd n MET 35 Ca 0.00 0.47 -0.36 0.00 -0.27 0.00 0.00 57.70 57.54 3mcd n MET 35 Cb 0.58 -1.31 -0.04 0.00 2.15 0.00 0.00 33.22 34.60 3mcd n MET 35 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 3mcd s GLU 36 N -2.24 2.91 0.00 2.12 2.12 -1.26 0.93 118.70 123.28 3mcd s GLU 36 Ca 0.00 -0.20 0.00 0.00 0.36 0.00 0.00 54.97 55.13 3mcd s GLU 36 Cb 0.00 -4.77 0.00 0.00 0.26 0.00 0.00 34.13 29.62 3mcd s GLU 36 CO 0.00 -2.73 0.00 -1.91 -0.54 0.00 0.00 175.26 170.08 3mcd n GLU 37 N 9.05 0.00 0.11 4.30 2.13 -1.25 -4.73 120.64 130.25 3mcd n GLU 37 Ca 0.26 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.86 3mcd n GLU 37 Cb 0.50 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.05 3mcd n GLU 37 CO 0.00 0.00 0.00 1.98 -0.41 0.00 0.00 177.13 178.70 3mcd h MET 38 N 0.00 0.43 -0.10 5.31 4.05 0.68 0.78 114.93 126.08 3mcd h MET 38 Ca 0.00 -0.73 0.03 0.00 -0.28 0.00 0.00 59.70 58.72 3mcd h MET 38 Cb 0.00 0.27 -0.00 0.00 -0.80 0.00 0.00 31.60 31.07 3mcd h MET 38 CO 0.00 1.33 0.10 -0.09 0.23 0.00 0.00 176.91 178.49 3mcd h ARG 39 N 0.12 0.00 0.00 0.39 1.12 -0.88 -3.03 114.38 112.10 3mcd h ARG 39 Ca -0.27 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.60 3mcd h ARG 39 Cb 2.11 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 32.07 3mcd h ARG 39 CO 0.22 0.00 0.00 1.63 -3.11 0.00 0.00 179.97 178.71 3mcd n LYS 40 N -4.01 0.00 -0.18 0.20 5.02 -0.82 -4.25 118.16 114.12 3mcd n LYS 40 Ca -0.00 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.47 3mcd n LYS 40 Cb 0.21 -0.12 0.33 0.00 -0.02 0.00 0.00 35.03 35.43 3mcd n LYS 40 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3mcd n GLU 41 N -0.99 -0.03 -0.29 1.97 1.02 0.27 0.20 120.64 122.79 3mcd n GLU 41 Ca 0.00 0.77 -0.01 0.00 -0.02 0.00 0.00 57.16 57.91 3mcd n GLU 41 Cb 0.00 -1.39 0.12 0.00 -0.02 0.00 0.00 31.44 30.15 3mcd n GLU 41 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3mcd h ILE 42 N 0.00 1.06 -0.14 -3.67 2.04 -1.71 -1.69 117.51 113.40 3mcd h ILE 42 Ca 0.48 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 66.01 3mcd h ILE 42 Cb 1.26 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 3mcd h ILE 42 CO -0.43 0.17 0.09 0.40 0.00 0.00 0.00 178.15 178.38 3mcd h ILE 43 N 0.95 1.07 -1.25 -0.67 2.04 0.22 -0.91 117.51 118.94 3mcd h ILE 43 Ca 0.35 -0.16 0.37 0.00 1.00 0.00 0.00 64.86 66.41 3mcd h ILE 43 Cb 0.11 0.91 -0.09 0.00 -0.74 0.00 0.00 36.82 37.02 3mcd h ILE 43 CO -0.15 0.06 0.84 0.00 0.00 0.00 0.00 178.15 178.90 3mcd h ALA 44 N 1.02 2.77 0.00 1.87 0.00 -1.12 0.71 119.26 124.52 3mcd h ALA 44 Ca 0.05 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3mcd h ALA 44 Cb 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3mcd h ALA 44 CO -0.01 -1.25 -0.17 0.28 0.00 0.00 0.00 179.25 178.11 3mcd h VAL 45 N 0.16 0.33 0.07 0.00 2.07 -0.75 -3.13 116.25 115.00 3mcd h VAL 45 Ca 0.69 -1.19 -0.37 0.00 0.82 0.00 0.00 66.70 66.64 3mcd h VAL 45 Cb 2.25 1.93 -0.04 0.00 -1.52 0.00 0.00 31.29 33.91 3mcd h VAL 45 CO -0.23 0.16 -2.19 -0.38 0.02 0.00 0.00 177.57 174.95 3mcd n ILE 46 N -3.20 1.65 -0.13 4.57 5.41 0.24 -4.00 119.36 123.90 3mcd n ILE 46 Ca 0.02 -0.64 -0.10 0.00 1.00 0.00 0.00 62.75 63.03 3mcd n ILE 46 Cb 0.50 -1.53 -0.02 0.00 -0.71 0.00 0.00 39.64 37.89 3mcd n ILE 46 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 3mcd h GLN 47 N 0.04 0.63 0.00 0.38 4.15 -1.29 0.41 115.11 119.43 3mcd h GLN 47 Ca -0.48 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 58.75 3mcd h GLN 47 Cb 1.99 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.62 3mcd h GLN 47 CO 0.02 0.72 0.00 0.36 -1.93 0.00 0.00 178.83 178.00 3mcd n LYS 48 N -4.51 0.29 -0.00 1.69 2.85 -1.18 0.97 118.16 118.27 3mcd n LYS 48 Ca -0.01 0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 3mcd n LYS 48 Cb 0.26 -1.50 -0.02 0.00 -0.65 0.00 0.00 35.03 33.12 3mcd n LYS 48 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3mcd n TYR 49 N -1.26 0.00 0.13 5.58 4.02 -1.01 -4.66 117.16 119.97 3mcd n TYR 49 Ca 0.09 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.06 3mcd n TYR 49 Cb 0.14 -0.07 -0.11 0.00 -0.02 0.00 0.00 39.34 39.27 3mcd n TYR 49 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3mcd n THR 50 N -1.76 0.00 -2.13 -0.72 -2.24 0.14 -5.00 114.28 102.57 3mcd n THR 50 Ca -0.02 -0.31 -0.19 0.00 -2.27 0.00 0.00 64.05 61.26 3mcd n THR 50 Cb 0.24 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.75 3mcd n THR 50 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3mcd n LYS 51 N -1.91 -1.49 -2.61 -0.78 4.01 0.27 -4.60 118.16 111.05 3mcd n LYS 51 Ca -0.02 1.01 -0.42 0.00 -0.51 0.00 0.00 58.31 58.38 3mcd n LYS 51 Cb 0.37 -5.52 -0.03 0.00 -0.51 0.00 0.00 35.03 29.34 3mcd n LYS 51 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3mcd s SER 52 N -2.32 7.25 -0.02 4.39 0.15 -1.25 -4.47 113.70 117.43 3mcd s SER 52 Ca 0.00 1.74 0.02 0.00 0.70 0.00 0.00 55.95 58.41 3mcd s SER 52 Cb 0.00 -2.57 -0.26 0.00 -1.71 0.00 0.00 66.02 61.49 3mcd s SER 52 CO 0.00 -0.37 0.78 0.77 1.20 0.00 0.00 173.24 175.62 3mcd h SER 53 N 6.91 0.25 -3.56 5.45 4.64 -1.93 -3.46 113.55 121.85 3mcd h SER 53 Ca -0.39 -0.40 -0.62 0.00 -0.47 0.00 0.00 61.79 59.91 3mcd h SER 53 Cb 1.20 -0.08 -0.13 0.00 -0.31 0.00 0.00 62.40 63.08 3mcd h SER 53 CO 0.79 1.35 0.03 -0.62 -0.87 0.00 0.00 176.83 177.51 3mcd s ASP 54 N -6.73 6.46 -0.09 4.97 3.68 -1.25 -5.06 116.67 118.65 3mcd s ASP 54 Ca -0.09 0.51 -0.06 0.00 2.13 0.00 0.00 52.55 55.04 3mcd s ASP 54 Cb 0.07 -2.29 0.03 0.00 -1.45 0.00 0.00 42.92 39.28 3mcd s ASP 54 CO 0.83 -0.33 0.21 -0.63 0.13 0.00 0.00 175.17 175.38 3mcd s ILE 55 N 2.38 -0.02 -0.20 4.11 1.01 -1.26 -2.36 121.20 124.86 3mcd s ILE 55 Ca 0.22 0.07 0.01 0.00 0.00 0.00 0.00 60.65 60.94 3mcd s ILE 55 Cb -0.15 -0.32 0.05 0.00 0.01 0.00 0.00 42.46 42.04 3mcd s ILE 55 CO 0.10 0.03 -0.08 -2.28 0.00 0.00 0.00 174.94 172.70 3mcd s HIS 56 N 0.59 2.29 -0.08 3.97 2.46 -0.88 -4.96 115.29 118.68 3mcd s HIS 56 Ca -0.04 -1.55 0.01 0.00 0.47 0.00 0.00 55.06 53.96 3mcd s HIS 56 Cb -0.05 -1.57 -0.03 0.00 -0.13 0.00 0.00 32.58 30.80 3mcd s HIS 56 CO -0.03 -0.73 -0.10 -0.59 -2.47 0.00 0.00 174.74 170.82 3mcd s PHE 57 N 1.44 2.85 0.15 3.88 -0.12 -1.26 -1.13 117.98 123.80 3mcd s PHE 57 Ca -0.02 -0.13 -0.19 0.00 -0.05 0.00 0.00 56.93 56.54 3mcd s PHE 57 Cb -0.17 -1.72 0.05 0.00 -0.63 0.00 0.00 43.02 40.55 3mcd s PHE 57 CO -0.08 0.20 0.49 -1.59 -0.05 0.00 0.00 175.22 174.19 3mcd s LYS 58 N -0.56 1.20 0.04 1.99 -2.85 -0.87 -4.98 119.74 113.71 3mcd s LYS 58 Ca 0.08 -0.65 -0.00 0.00 -1.00 0.00 0.00 55.97 54.40 3mcd s LYS 58 Cb -0.12 0.52 -0.04 0.00 -2.06 0.00 0.00 37.83 36.13 3mcd s LYS 58 CO 0.02 -0.50 0.18 0.99 0.10 0.00 0.00 175.35 176.14 3mcd s THR 59 N -3.80 5.25 0.05 3.79 2.01 -1.26 -0.88 115.64 120.80 3mcd s THR 59 Ca 0.03 -0.38 -0.01 0.00 0.31 0.00 0.00 61.69 61.64 3mcd s THR 59 Cb 0.00 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 3mcd s THR 59 CO -0.11 0.20 -0.02 0.18 -0.69 0.00 0.00 174.62 174.18 3mcd n LEU 60 N 0.53 0.84 -4.82 4.42 7.99 -1.26 -4.97 117.00 119.73 3mcd n LEU 60 Ca -0.07 0.11 -0.36 0.00 -0.01 0.00 0.00 56.01 55.67 3mcd n LEU 60 Cb 0.52 -0.27 -0.06 0.00 -0.11 0.00 0.00 43.42 43.50 3mcd n LEU 60 CO 0.48 -0.48 0.35 -0.70 -1.51 0.00 0.00 177.39 175.53 3mcd s GLU 67 N -2.05 4.20 -0.28 3.23 2.12 -1.24 -4.75 118.70 119.92 3mcd s GLU 67 Ca -0.02 0.77 -0.00 0.00 0.36 0.00 0.00 54.97 56.08 3mcd s GLU 67 Cb 0.01 -2.97 0.14 0.00 0.26 0.00 0.00 34.13 31.56 3mcd s GLU 67 CO 0.03 0.46 0.33 0.99 -0.54 0.00 0.00 175.26 176.54 3mcd s THR 68 N -1.42 -0.49 0.41 -1.70 2.01 -1.26 -3.26 115.64 109.93 3mcd s THR 68 Ca 0.39 -0.37 -0.25 0.00 0.31 0.00 0.00 61.69 61.76 3mcd s THR 68 Cb -0.17 -0.96 -0.08 0.00 0.01 0.00 0.00 72.50 71.30 3mcd s THR 68 CO 0.21 -0.37 1.20 -0.63 -0.69 0.00 0.00 174.62 174.34 3mcd s ILE 69 N 2.43 3.00 -0.15 1.82 -1.09 -0.92 -4.55 121.20 121.74 3mcd s ILE 69 Ca 0.10 0.84 -0.04 0.00 -2.23 0.00 0.00 60.65 59.32 3mcd s ILE 69 Cb -0.14 -3.47 0.05 0.00 -1.58 0.00 0.00 42.46 37.32 3mcd s ILE 69 CO -0.30 0.08 0.06 -1.61 -1.23 0.00 0.00 174.94 171.94 3mcd s GLU 70 N -2.33 0.29 -0.30 2.79 2.02 -0.06 -1.90 118.70 119.21 3mcd s GLU 70 Ca 0.58 -0.10 -0.03 0.00 0.02 0.00 0.00 54.97 55.44 3mcd s GLU 70 Cb -0.32 -1.65 0.05 0.00 0.10 0.00 0.00 34.13 32.30 3mcd s GLU 70 CO 0.41 -0.57 0.01 0.08 0.02 0.00 0.00 175.26 175.21 3mcd s VAL 71 N 2.04 3.11 -0.29 2.63 1.01 -0.29 -2.04 120.40 126.57 3mcd s VAL 71 Ca 0.02 -1.31 -0.10 0.00 0.00 0.00 0.00 61.98 60.59 3mcd s VAL 71 Cb -0.15 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 3mcd s VAL 71 CO -0.07 -0.09 0.17 -1.61 0.00 0.00 0.00 175.10 173.49 3mcd s GLU 72 N 1.28 3.76 0.21 2.72 2.02 -0.28 -1.11 118.70 127.31 3mcd s GLU 72 Ca -0.04 -0.44 -0.01 0.00 0.02 0.00 0.00 54.97 54.50 3mcd s GLU 72 Cb -0.19 -3.60 -0.04 0.00 0.10 0.00 0.00 34.13 30.39 3mcd s GLU 72 CO -0.01 -0.24 0.41 0.42 0.02 0.00 0.00 175.26 175.86 3mcd s ILE 73 N 1.71 5.19 -0.05 -1.63 -1.09 0.13 -2.07 121.20 123.38 3mcd s ILE 73 Ca 0.06 -0.35 -0.02 0.00 -2.23 0.00 0.00 60.65 58.11 3mcd s ILE 73 Cb -0.16 -3.74 0.04 0.00 -1.58 0.00 0.00 42.46 37.01 3mcd s ILE 73 CO 0.09 -0.20 0.09 -0.63 -1.23 0.00 0.00 174.94 173.06 3mcd s ILE 74 N -1.90 -0.15 0.61 2.92 1.01 -1.00 -1.88 121.20 120.81 3mcd s ILE 74 Ca 0.39 0.36 -0.08 0.00 0.00 0.00 0.00 60.65 61.33 3mcd s ILE 74 Cb -0.11 -0.19 -0.00 0.00 0.01 0.00 0.00 42.46 42.17 3mcd s ILE 74 CO 0.29 0.15 0.94 -0.76 0.00 0.00 0.00 174.94 175.57 3mcd s LEU 75 N 2.01 3.21 0.00 2.97 1.02 -1.25 -3.90 118.68 122.74 3mcd s LEU 75 Ca 0.02 0.91 0.09 0.00 0.02 0.00 0.00 54.13 55.17 3mcd s LEU 75 Cb -0.12 -3.76 0.07 0.00 0.02 0.00 0.00 46.19 42.40 3mcd s LEU 75 CO -0.04 -1.05 0.80 -0.81 0.02 0.00 0.00 176.35 175.27