#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abm s GLU 2 N 0.00 1.67 -0.63 -1.08 2.02 -1.26 -5.09 118.70 114.33 3abm s GLU 2 Ca 0.00 -1.45 -0.27 0.00 0.02 0.00 0.00 54.97 53.27 3abm s GLU 2 Cb 0.00 -1.93 0.03 0.00 0.10 0.00 0.00 34.13 32.33 3abm s GLU 2 CO 0.00 0.41 1.16 1.21 0.02 0.00 0.00 175.26 178.06 3abm s ASN 3 N -2.71 6.32 -0.31 -0.19 3.84 -1.26 -4.87 114.94 115.76 3abm s ASN 3 Ca 0.22 -0.22 0.09 0.00 0.21 0.00 0.00 52.86 53.16 3abm s ASN 3 Cb -0.08 -2.53 0.59 0.00 -0.55 0.00 0.00 41.25 38.68 3abm s ASN 3 CO 0.11 -1.55 1.61 0.54 -2.79 0.00 0.00 177.10 175.02 3abm n ARG 4 N 8.52 2.41 -0.18 0.43 5.12 -1.26 -4.67 116.66 127.03 3abm n ARG 4 Ca 0.05 -3.08 -0.09 0.00 -1.93 0.00 0.00 57.85 52.80 3abm n ARG 4 Cb 0.48 -1.97 0.01 0.00 -1.16 0.00 0.00 32.46 29.83 3abm n ARG 4 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3abm h VAL 5 N 1.40 1.26 -0.89 1.55 2.07 -2.00 -2.79 116.25 116.84 3abm h VAL 5 Ca 0.28 -0.98 0.24 0.00 0.82 0.00 0.00 66.70 67.06 3abm h VAL 5 Cb 2.00 0.87 -0.15 0.00 -1.52 0.00 0.00 31.29 32.50 3abm h VAL 5 CO 0.58 0.35 0.22 0.00 0.02 0.00 0.00 177.57 178.74 3abm h ALA 6 N 0.97 1.28 -0.57 1.67 0.00 -1.99 0.29 119.26 120.91 3abm h ALA 6 Ca 0.16 0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 3abm h ALA 6 Cb 0.43 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3abm h ALA 6 CO 0.01 -0.49 0.06 0.93 0.00 0.00 0.00 179.25 179.76 3abm h GLU 7 N 0.18 0.94 -0.39 0.00 5.08 -1.86 -1.71 114.58 116.82 3abm h GLU 7 Ca 0.56 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.62 3abm h GLU 7 Cb 1.15 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 3abm h GLU 7 CO -0.69 0.90 0.03 0.87 -1.00 0.00 0.00 179.01 179.13 3abm h LYS 8 N 0.88 0.67 -0.79 2.33 1.79 -0.94 -0.70 116.57 119.82 3abm h LYS 8 Ca 0.17 -0.19 0.18 0.00 -2.18 0.00 0.00 60.65 58.63 3abm h LYS 8 Cb 0.44 -0.07 -0.12 0.00 -1.58 0.00 0.00 32.23 30.90 3abm h LYS 8 CO 0.02 0.74 0.19 1.96 -1.08 0.00 0.00 179.45 181.28 3abm h GLN 9 N 0.50 0.25 -0.00 3.15 4.20 -0.21 0.41 115.11 123.41 3abm h GLN 9 Ca 0.12 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 3abm h GLN 9 Cb 0.42 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 3abm h GLN 9 CO 0.01 0.16 -0.00 -0.22 -0.67 0.00 0.00 178.83 178.12 3abm h LYS 10 N 0.26 0.00 -0.51 1.46 3.64 -0.96 -1.50 116.57 118.95 3abm h LYS 10 Ca 0.46 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.91 3abm h LYS 10 Cb 0.82 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.58 3abm h LYS 10 CO -0.56 0.32 0.16 1.25 -2.27 0.00 0.00 179.45 178.35 3abm h LEU 11 N -0.31 0.12 0.00 5.20 5.85 -0.79 -2.64 115.31 122.73 3abm h LEU 11 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 3abm h LEU 11 Cb 0.32 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.42 3abm h LEU 11 CO 0.00 0.09 -0.18 0.49 -0.34 0.00 0.00 178.44 178.51 3abm n PHE 12 N -5.04 0.26 0.27 1.25 3.01 0.11 -3.05 117.46 114.26 3abm n PHE 12 Ca 0.06 0.08 0.10 0.00 1.01 0.00 0.00 57.45 58.69 3abm n PHE 12 Cb 0.23 -0.56 0.17 0.00 -0.01 0.00 0.00 39.48 39.31 3abm n PHE 12 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3abm n GLN 13 N -1.73 2.23 -1.88 -1.08 6.02 -0.58 -4.99 117.38 115.38 3abm n GLN 13 Ca 0.06 -2.06 -0.42 0.00 -0.01 0.00 0.00 57.00 54.57 3abm n GLN 13 Cb 0.37 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 30.18 3abm n GLN 13 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3abm s GLU 14 N -1.32 4.19 -1.25 -1.09 2.12 -1.01 -4.85 118.70 115.48 3abm s GLU 14 Ca 0.32 2.41 -0.18 0.00 0.36 0.00 0.00 54.97 57.87 3abm s GLU 14 Cb 0.19 -3.35 0.00 0.00 0.26 0.00 0.00 34.13 31.23 3abm s GLU 14 CO 0.26 -0.69 1.92 -3.47 -0.54 0.00 0.00 175.26 172.73 3abm n ASP 15 N 4.73 4.03 -0.06 -1.70 4.64 -1.26 -4.54 116.55 122.39 3abm n ASP 15 Ca 0.15 -2.83 0.01 0.00 -1.38 0.00 0.00 54.79 50.74 3abm n ASP 15 Cb 0.39 -1.65 0.01 0.00 -1.04 0.00 0.00 41.12 38.83 3abm n ASP 15 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3abm n ASN 16 N 8.95 1.88 0.00 1.67 0.23 -1.26 -5.01 115.26 121.72 3abm n ASN 16 Ca 0.49 -1.80 0.00 0.00 -0.53 0.00 0.00 54.58 52.74 3abm n ASN 16 Cb 0.44 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 3abm n ASN 16 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3abm n GLY 17 N -0.30 1.05 3.72 4.83 0.00 -1.26 -4.99 105.19 108.24 3abm n GLY 17 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3abm n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abm s LEU 18 N 0.00 4.40 0.78 0.99 1.43 -1.26 -5.04 118.68 119.99 3abm s LEU 18 Ca 0.00 1.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.98 3abm s LEU 18 Cb 0.00 -3.58 0.06 0.00 0.03 0.00 0.00 46.19 42.69 3abm s LEU 18 CO 0.00 -0.37 1.09 -2.16 0.23 0.00 0.00 176.35 175.13 3abm s PRO 19 N 0.64 2.21 0.48 1.29 0.04 -1.26 -4.75 135.00 133.66 3abm s PRO 19 Ca 0.55 1.06 0.13 0.00 0.04 0.00 0.00 61.00 62.78 3abm s PRO 19 Cb -0.28 -1.90 1.14 0.00 0.04 0.00 0.00 34.50 33.50 3abm s PRO 19 CO 0.31 -1.64 2.11 -0.24 0.04 0.00 0.00 177.00 177.58 3abm h VAL 20 N -1.12 1.02 0.00 -0.36 3.04 -1.97 -0.08 116.25 116.78 3abm h VAL 20 Ca -0.45 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 3abm h VAL 20 Cb 1.24 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 31.34 3abm h VAL 20 CO 0.53 0.03 0.00 0.00 -1.01 0.00 0.00 177.57 177.12 3abm n HIS 21 N -4.51 0.14 0.00 3.17 1.44 -1.26 -2.74 115.22 111.46 3abm n HIS 21 Ca -0.00 0.05 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 3abm n HIS 21 Cb 0.11 -0.58 0.00 0.00 0.12 0.00 0.00 29.99 29.64 3abm n HIS 21 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3abm n LEU 22 N -1.62 1.58 0.07 2.39 4.77 -0.06 -4.80 117.00 119.32 3abm n LEU 22 Ca 0.04 -1.54 0.13 0.00 -0.03 0.00 0.00 56.01 54.61 3abm n LEU 22 Cb 0.20 -0.01 0.44 0.00 -2.33 0.00 0.00 43.42 41.73 3abm n LEU 22 CO 0.16 0.39 0.86 1.17 -1.33 0.00 0.00 177.39 178.64 3abm n LYS 23 N -0.24 0.19 0.10 3.23 4.81 -1.08 -2.67 118.16 122.51 3abm n LYS 23 Ca 0.00 0.15 0.13 0.00 -0.87 0.00 0.00 58.31 57.72 3abm n LYS 23 Cb 0.14 -1.71 0.44 0.00 0.02 0.00 0.00 35.03 33.92 3abm n LYS 23 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3abm n GLY 24 N 1.36 -1.60 0.00 3.14 0.00 -1.26 -4.84 105.19 101.99 3abm n GLY 24 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3abm n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abm n GLY 25 N 1.06 0.62 0.20 -0.02 0.00 -1.09 -4.81 105.19 101.15 3abm n GLY 25 Ca 0.05 -2.22 0.03 0.00 0.00 0.00 0.00 46.02 43.88 3abm n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abm h ALA 26 N 0.00 1.47 -0.86 4.61 0.00 -1.96 -1.86 119.26 120.67 3abm h ALA 26 Ca 0.00 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.67 3abm h ALA 26 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3abm h ALA 26 CO 0.00 0.39 0.56 1.15 0.00 0.00 0.00 179.25 181.35 3abm h THR 27 N 0.05 1.12 -0.73 0.00 2.02 -1.96 -2.42 112.91 110.98 3abm h THR 27 Ca 0.01 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.83 3abm h THR 27 Cb 0.54 -0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 3abm h THR 27 CO 0.04 0.19 0.47 0.44 0.37 0.00 0.00 175.52 177.03 3abm h ASP 28 N 1.05 0.86 -0.29 4.18 3.32 -1.67 -0.74 116.42 123.13 3abm h ASP 28 Ca 0.35 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.24 3abm h ASP 28 Cb 0.07 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 3abm h ASP 28 CO -0.11 0.63 -0.30 0.78 -1.72 0.00 0.00 179.24 178.53 3abm h ASN 29 N 1.00 0.76 0.20 6.45 2.35 -1.46 -0.04 115.58 124.84 3abm h ASN 29 Ca 0.27 -0.48 -0.01 0.00 -0.55 0.00 0.00 56.30 55.53 3abm h ASN 29 Cb -0.09 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.07 3abm h ASN 29 CO -0.06 1.08 -0.10 0.40 -1.65 0.00 0.00 177.43 177.11 3abm h ILE 30 N 0.46 0.86 -0.34 2.81 2.04 -1.32 0.16 117.51 122.17 3abm h ILE 30 Ca 0.04 -0.27 0.06 0.00 1.00 0.00 0.00 64.86 65.70 3abm h ILE 30 Cb 0.87 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.91 3abm h ILE 30 CO 0.07 0.06 -0.03 0.25 0.00 0.00 0.00 178.15 178.50 3abm h LEU 31 N -0.40 -0.20 -0.38 1.44 5.85 -1.12 -0.52 115.31 119.97 3abm h LEU 31 Ca -0.03 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.83 3abm h LEU 31 Cb 0.31 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 3abm h LEU 31 CO 0.04 -0.06 0.12 0.22 -0.34 0.00 0.00 178.44 178.42 3abm h TYR 32 N 0.06 0.21 -0.01 1.25 3.20 -0.89 -0.15 116.97 120.65 3abm h TYR 32 Ca 0.17 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 3abm h TYR 32 Cb 0.24 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3abm h TYR 32 CO -0.27 0.07 -0.54 0.00 -1.64 0.00 0.00 178.16 175.78 3abm h ARG 33 N 0.27 0.02 0.03 1.82 3.08 -0.42 0.95 114.38 120.12 3abm h ARG 33 Ca 0.18 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 3abm h ARG 33 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3abm h ARG 33 CO -0.20 0.55 -0.02 0.28 -1.07 0.00 0.00 179.97 179.52 3abm h VAL 34 N 0.01 1.10 0.24 2.04 2.07 -0.81 -1.27 116.25 119.64 3abm h VAL 34 Ca -0.00 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 3abm h VAL 34 Cb 0.97 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 3abm h VAL 34 CO 0.07 0.11 -0.12 0.74 0.02 0.00 0.00 177.57 178.40 3abm h THR 35 N -0.23 0.77 -0.51 2.57 2.02 -0.54 -1.09 112.91 115.88 3abm h THR 35 Ca -0.00 -0.02 -0.09 0.00 0.77 0.00 0.00 66.41 67.07 3abm h THR 35 Cb 0.22 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 3abm h THR 35 CO 0.01 0.00 -0.02 -0.03 0.37 0.00 0.00 175.52 175.85 3abm h MET 36 N -0.33 0.88 -0.39 6.66 -1.53 -0.88 -1.25 114.93 118.10 3abm h MET 36 Ca -0.03 -0.26 -0.04 0.00 -3.44 0.00 0.00 59.70 55.93 3abm h MET 36 Cb 0.25 -0.09 -0.02 0.00 -0.55 0.00 0.00 31.60 31.20 3abm h MET 36 CO 0.05 0.89 0.10 1.15 0.14 0.00 0.00 176.91 179.24 3abm h THR 37 N 0.81 1.23 -0.62 -0.77 2.02 -1.13 -0.25 112.91 114.20 3abm h THR 37 Ca 0.15 -0.77 0.03 0.00 0.77 0.00 0.00 66.41 66.60 3abm h THR 37 Cb 0.52 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 3abm h THR 37 CO 0.03 0.27 0.37 -0.07 0.37 0.00 0.00 175.52 176.48 3abm h LEU 38 N 0.48 0.59 0.14 2.58 3.38 -0.93 0.16 115.31 121.70 3abm h LEU 38 Ca 0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3abm h LEU 38 Cb 0.30 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3abm h LEU 38 CO 0.00 0.40 -0.07 0.00 0.09 0.00 0.00 178.44 178.87 3abm h LEU 40 N -0.35 1.00 -0.07 0.00 3.38 -0.97 -0.43 115.31 117.89 3abm h LEU 40 Ca -0.02 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3abm h LEU 40 Cb 0.28 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3abm h LEU 40 CO 0.03 1.22 0.00 1.23 0.09 0.00 0.00 178.44 181.02 3abm h GLY 41 N 0.83 0.12 0.42 0.83 0.00 -0.69 -1.35 103.07 103.22 3abm h GLY 41 Ca 0.08 -0.09 0.11 0.00 0.00 0.00 0.00 47.33 47.44 3abm h GLY 41 CO 0.08 0.08 0.43 -1.33 0.00 0.00 0.00 176.54 175.80 3abm h GLY 42 N -0.16 1.25 0.92 4.60 0.00 -0.81 0.77 103.07 109.65 3abm h GLY 42 Ca 0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 3abm h GLY 42 CO 0.00 0.06 0.11 -0.84 0.00 0.00 0.00 176.54 175.87 3abm h THR 43 N 0.69 1.21 -0.59 4.70 2.02 -0.97 0.34 112.91 120.30 3abm h THR 43 Ca 0.40 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 3abm h THR 43 Cb 0.45 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3abm h THR 43 CO -0.29 0.24 0.30 -0.07 0.37 0.00 0.00 175.52 176.08 3abm h LEU 44 N 0.44 0.76 -1.14 2.58 3.38 -0.61 -1.07 115.31 119.65 3abm h LEU 44 Ca 0.12 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.04 3abm h LEU 44 Cb 0.26 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 3abm h LEU 44 CO -0.00 0.66 0.59 0.22 0.09 0.00 0.00 178.44 180.00 3abm h TYR 45 N 0.81 1.05 -0.34 1.13 3.20 0.11 -1.98 116.97 120.94 3abm h TYR 45 Ca 0.21 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.95 3abm h TYR 45 Cb 0.09 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 3abm h TYR 45 CO -0.01 0.53 -0.41 0.66 -1.64 0.00 0.00 178.16 177.30 3abm h SER 46 N 1.01 0.91 0.20 -2.11 4.64 0.45 -0.88 113.55 117.77 3abm h SER 46 Ca 0.40 -0.42 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3abm h SER 46 Cb 0.24 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3abm h SER 46 CO -0.16 1.20 -0.15 -0.07 -0.87 0.00 0.00 176.83 176.77 3abm h LEU 47 N 0.69 -0.40 -0.86 5.97 3.38 -0.94 0.11 115.31 123.27 3abm h LEU 47 Ca 0.05 0.03 0.22 0.00 0.09 0.00 0.00 57.88 58.28 3abm h LEU 47 Cb 0.98 0.13 -0.14 0.00 0.09 0.00 0.00 40.66 41.73 3abm h LEU 47 CO 0.09 -0.24 0.21 0.22 0.09 0.00 0.00 178.44 178.81 3abm h TYR 48 N -0.36 0.30 -0.32 1.13 3.20 -1.28 -0.52 116.97 119.11 3abm h TYR 48 Ca -0.01 0.05 -0.10 0.00 3.14 0.00 0.00 58.73 61.82 3abm h TYR 48 Cb 0.32 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 3abm h TYR 48 CO -0.11 -0.21 -0.20 0.00 -1.64 0.00 0.00 178.16 176.00 3abm h LEU 50 N 0.54 0.44 -1.21 0.00 6.46 0.32 -0.68 115.31 121.18 3abm h LEU 50 Ca 0.08 -0.20 0.07 0.00 -0.12 0.00 0.00 57.88 57.71 3abm h LEU 50 Cb 0.64 -0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.40 3abm h LEU 50 CO 0.05 0.52 0.56 1.23 -0.62 0.00 0.00 178.44 180.18 3abm h GLY 51 N 0.32 1.23 0.64 3.75 0.00 -0.90 -0.09 103.07 108.03 3abm h GLY 51 Ca 0.10 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.97 3abm h GLY 51 CO -0.00 0.27 -0.23 -0.25 0.00 0.00 0.00 176.54 176.33 3abm h TRP 52 N 0.95 0.37 0.00 5.60 7.01 -1.09 -3.01 115.95 125.77 3abm h TRP 52 Ca 0.37 -0.15 0.00 0.00 2.11 0.00 0.00 58.89 61.22 3abm h TRP 52 Cb 0.24 -0.06 0.00 0.00 -2.10 0.00 0.00 29.16 27.24 3abm h TRP 52 CO -0.00 0.84 0.00 0.00 -2.79 0.00 0.00 178.44 176.49 3abm h ALA 53 N 0.46 1.00 0.00 2.65 0.00 -0.72 -3.03 119.26 119.62 3abm h ALA 53 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3abm h ALA 53 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3abm h ALA 53 CO 0.05 0.00 -0.04 0.43 0.00 0.00 0.00 179.25 179.69 3abm n SER 54 N -2.86 0.18 -4.25 0.00 7.64 -0.08 -4.81 113.62 109.44 3abm n SER 54 Ca -0.02 0.46 -0.23 0.00 1.01 0.00 0.00 58.87 60.09 3abm n SER 54 Cb 0.08 -0.49 -0.12 0.00 -1.01 0.00 0.00 64.21 62.66 3abm n SER 54 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3abm s PHE 55 N -3.02 1.64 0.62 1.43 0.08 -1.15 -5.10 117.98 112.49 3abm s PHE 55 Ca 0.13 -0.43 -0.19 0.00 0.12 0.00 0.00 56.93 56.56 3abm s PHE 55 Cb 0.18 -0.91 -0.02 0.00 -0.57 0.00 0.00 43.02 41.70 3abm s PHE 55 CO 0.55 0.16 1.31 -1.25 -0.10 0.00 0.00 175.22 175.90 3abm s PRO 56 N -1.84 2.74 0.00 0.24 0.04 -1.26 -5.01 135.00 129.91 3abm s PRO 56 Ca 0.04 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.19 3abm s PRO 56 Cb -0.10 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3abm s PRO 56 CO 0.04 -1.47 0.31 0.72 0.04 0.00 0.00 177.00 176.64