#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s0y s MET 3 N 0.00 1.31 -0.04 0.54 -1.94 -1.26 -1.38 119.30 116.54 1s0y s MET 3 Ca 0.00 -0.27 0.07 0.00 -1.71 0.00 0.00 55.69 53.78 1s0y s MET 3 Cb 0.00 -1.18 -0.02 0.00 2.01 0.00 0.00 34.83 35.65 1s0y s MET 3 CO 0.00 -0.04 -0.25 0.42 -0.01 0.00 0.00 175.02 175.14 1s0y s ILE 4 N 0.85 2.12 0.03 2.53 1.09 0.52 -4.98 121.20 123.36 1s0y s ILE 4 Ca -0.12 -1.06 0.06 0.00 -1.10 0.00 0.00 60.65 58.43 1s0y s ILE 4 Cb -0.15 -1.75 -0.02 0.00 -1.06 0.00 0.00 42.46 39.48 1s0y s ILE 4 CO 0.01 0.58 -0.19 -0.94 -0.10 0.00 0.00 174.94 174.30 1s0y s SER 5 N -0.41 2.25 -0.17 3.58 1.04 -1.26 -1.03 113.70 117.70 1s0y s SER 5 Ca 0.04 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.00 1s0y s SER 5 Cb -0.12 -0.20 0.05 0.00 0.10 0.00 0.00 66.02 65.85 1s0y s SER 5 CO 0.01 0.16 -0.02 0.00 0.98 0.00 0.00 173.24 174.37 1s0y s ASP 7 N 1.71 6.25 0.18 0.00 1.01 -1.26 -0.18 116.67 124.38 1s0y s ASP 7 Ca -0.00 0.28 -0.22 0.00 0.71 0.00 0.00 52.55 53.32 1s0y s ASP 7 Cb -0.16 -2.17 0.06 0.00 1.01 0.00 0.00 42.92 41.66 1s0y s ASP 7 CO -0.07 -0.03 0.61 0.00 0.21 0.00 0.00 175.17 175.88 1s0y s MET 8 N 1.33 1.36 0.71 8.23 0.23 -0.65 -4.97 119.30 125.54 1s0y s MET 8 Ca 0.13 -0.59 -0.16 0.00 -1.03 0.00 0.00 55.69 54.03 1s0y s MET 8 Cb -0.14 0.58 0.00 0.00 -1.53 0.00 0.00 34.83 33.74 1s0y s MET 8 CO 0.07 -0.60 0.99 0.54 -2.03 0.00 0.00 175.02 173.99 1s0y n ARG 9 N -0.38 0.57 -1.88 3.16 1.74 -1.26 -3.43 116.66 115.17 1s0y n ARG 9 Ca -0.14 0.25 -0.33 0.00 -0.77 0.00 0.00 57.85 56.86 1s0y n ARG 9 Cb 0.64 -2.23 0.03 0.00 -1.02 0.00 0.00 32.46 29.87 1s0y n ARG 9 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1s0y s TYR 10 N -1.77 2.80 0.00 -1.55 6.14 0.13 -4.34 117.35 118.75 1s0y s TYR 10 Ca 0.74 1.53 0.00 0.00 0.64 0.00 0.00 57.07 59.98 1s0y s TYR 10 Cb -0.35 -3.09 0.00 0.00 0.42 0.00 0.00 41.96 38.94 1s0y s TYR 10 CO 0.49 -1.42 0.00 0.41 0.64 0.00 0.00 175.55 175.67 1s0y n GLY 11 N -0.75 0.90 3.77 8.97 0.00 -1.26 -4.24 105.19 112.57 1s0y n GLY 11 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1s0y n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s0y s ARG 12 N 0.00 3.87 0.87 1.61 3.00 -1.26 -4.96 118.95 122.08 1s0y s ARG 12 Ca 0.00 2.38 -0.13 0.00 0.00 0.00 0.00 55.73 57.98 1s0y s ARG 12 Cb 0.00 -2.76 0.14 0.00 0.00 0.00 0.00 34.95 32.33 1s0y s ARG 12 CO 0.00 -0.66 1.23 0.95 0.00 0.00 0.00 175.30 176.82 1s0y s THR 13 N -1.20 2.04 0.27 0.02 -4.23 -1.26 -4.87 115.64 106.41 1s0y s THR 13 Ca 0.58 -0.07 0.02 0.00 -1.18 0.00 0.00 61.69 61.04 1s0y s THR 13 Cb -0.43 -2.97 0.05 0.00 1.34 0.00 0.00 72.50 70.49 1s0y s THR 13 CO 0.56 0.00 1.69 0.44 -0.54 0.00 0.00 174.62 176.77 1s0y h ASP 14 N -1.28 0.49 -0.24 3.99 3.45 -1.98 -1.04 116.42 119.80 1s0y h ASP 14 Ca -0.44 -0.18 -0.03 0.00 0.43 0.00 0.00 57.03 56.81 1s0y h ASP 14 Cb 1.28 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.90 1s0y h ASP 14 CO 0.49 0.76 0.03 -0.33 -1.57 0.00 0.00 179.24 178.63 1s0y h GLU 15 N 0.41 0.41 -0.27 3.56 4.39 -1.99 -0.04 114.58 121.05 1s0y h GLU 15 Ca 0.05 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1s0y h GLU 15 Cb 0.72 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1s0y h GLU 15 CO 0.06 0.55 0.16 1.96 -1.16 0.00 0.00 179.01 180.58 1s0y h GLN 16 N 0.21 0.37 -0.87 2.33 4.20 -1.89 -1.32 115.11 118.14 1s0y h GLN 16 Ca 0.07 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.80 1s0y h GLN 16 Cb 0.34 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.99 1s0y h GLN 16 CO 0.01 0.30 0.55 0.87 -0.67 0.00 0.00 178.83 179.88 1s0y h LYS 17 N 0.34 1.00 -0.16 1.46 1.57 -1.03 0.43 116.57 120.19 1s0y h LYS 17 Ca 0.10 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 1s0y h LYS 17 Cb 0.02 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1s0y h LYS 17 CO -0.02 0.66 -0.28 0.00 -0.57 0.00 0.00 179.45 179.24 1s0y h ARG 18 N 1.03 0.29 0.00 3.15 3.08 -0.54 -1.79 114.38 119.61 1s0y h ARG 18 Ca 0.36 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 1s0y h ARG 18 Cb 0.09 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1s0y h ARG 18 CO -0.15 0.56 -0.66 0.00 -1.07 0.00 0.00 179.97 178.65 1s0y h ALA 19 N 1.45 0.64 0.06 0.04 0.00 -0.60 -2.83 119.26 118.02 1s0y h ALA 19 Ca 0.04 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1s0y h ALA 19 Cb 0.64 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1s0y h ALA 19 CO 0.05 0.83 -0.03 1.25 0.00 0.00 0.00 179.25 181.34 1s0y h LEU 20 N 0.00 -0.07 -0.84 0.00 6.46 -0.46 -1.30 115.31 119.10 1s0y h LEU 20 Ca -0.01 -0.36 -0.05 0.00 -0.12 0.00 0.00 57.88 57.34 1s0y h LEU 20 Cb 1.42 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 41.34 1s0y h LEU 20 CO 0.09 0.33 0.23 0.77 -0.62 0.00 0.00 178.44 179.24 1s0y h SER 21 N -0.49 1.02 0.05 1.25 4.64 -1.41 -0.25 113.55 118.36 1s0y h SER 21 Ca -0.01 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1s0y h SER 21 Cb 0.43 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1s0y h SER 21 CO 0.01 0.94 -0.03 0.00 -0.87 0.00 0.00 176.83 176.88 1s0y h ALA 22 N 1.20 -0.08 -0.01 5.18 0.00 -1.46 0.31 119.26 124.40 1s0y h ALA 22 Ca 0.23 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1s0y h ALA 22 Cb 0.28 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1s0y h ALA 22 CO -0.01 -0.54 0.00 0.78 0.00 0.00 0.00 179.25 179.48 1s0y h GLY 23 N -0.08 0.01 0.92 0.00 0.00 -1.02 -2.19 103.07 100.71 1s0y h GLY 23 Ca -0.00 -0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1s0y h GLY 23 CO 0.01 0.00 0.56 1.41 0.00 0.00 0.00 176.54 178.52 1s0y h LEU 24 N -0.03 0.94 -1.17 3.11 4.07 -0.84 -2.21 115.31 119.18 1s0y h LEU 24 Ca 0.00 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.90 1s0y h LEU 24 Cb 0.03 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 1s0y h LEU 24 CO -0.00 0.66 -0.22 -0.07 -1.08 0.00 0.00 178.44 177.73 1s0y h LEU 25 N 1.10 0.00 -0.04 1.67 4.07 -0.24 -2.06 115.31 119.82 1s0y h LEU 25 Ca 0.33 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.22 1s0y h LEU 25 Cb -0.04 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.70 1s0y h LEU 25 CO -0.10 0.22 -0.24 -0.09 -1.08 0.00 0.00 178.44 177.15 1s0y h ARG 26 N 0.00 0.23 -0.34 1.13 2.43 -0.80 -2.15 114.38 114.87 1s0y h ARG 26 Ca -0.00 -0.20 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 1s0y h ARG 26 Cb 0.72 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1s0y h ARG 26 CO 0.03 0.86 -0.15 -0.39 -1.51 0.00 0.00 179.97 178.81 1s0y h VAL 27 N -0.34 1.25 -0.30 0.20 -1.51 -1.37 0.10 116.25 114.28 1s0y h VAL 27 Ca -0.02 -1.14 -0.08 0.00 -1.23 0.00 0.00 66.70 64.24 1s0y h VAL 27 Cb 0.91 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 1s0y h VAL 27 CO 0.05 0.38 -0.11 0.40 -1.23 0.00 0.00 177.57 177.06 1s0y h ILE 28 N 0.55 1.29 0.20 7.19 5.03 -1.44 -1.90 117.51 128.43 1s0y h ILE 28 Ca 0.09 -1.18 -0.01 0.00 -0.12 0.00 0.00 64.86 63.65 1s0y h ILE 28 Cb 0.57 1.42 0.00 0.00 -3.03 0.00 0.00 36.82 35.79 1s0y h ILE 28 CO 0.04 0.38 -0.09 0.28 -0.68 0.00 0.00 178.15 178.07 1s0y h SER 29 N 0.37 -0.22 -0.07 1.72 0.02 -1.04 0.18 113.55 114.50 1s0y h SER 29 Ca 0.07 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1s0y h SER 29 Cb 0.61 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1s0y h SER 29 CO 0.04 -0.14 0.04 -0.33 -1.14 0.00 0.00 176.83 175.30 1s0y h GLU 30 N -0.28 0.12 0.13 3.45 5.08 -0.98 0.82 114.58 122.92 1s0y h GLU 30 Ca -0.03 -0.01 -0.32 0.00 -1.00 0.00 0.00 59.36 58.01 1s0y h GLU 30 Cb 0.22 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1s0y h GLU 30 CO 0.04 0.10 -1.62 0.00 -1.00 0.00 0.00 179.01 176.54 1s0y h ALA 31 N 1.92 0.29 0.00 3.43 0.00 -1.06 -3.39 119.26 120.45 1s0y h ALA 31 Ca 0.03 -1.16 -0.21 0.00 0.00 0.00 0.00 54.91 53.57 1s0y h ALA 31 Cb 0.02 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1s0y h ALA 31 CO -0.00 1.15 -1.92 2.41 0.00 0.00 0.00 179.25 180.88 1s0y n THR 32 N -3.46 1.03 0.00 0.00 -1.04 0.61 -4.97 114.28 106.45 1s0y n THR 32 Ca -0.19 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.10 1s0y n THR 32 Cb 1.05 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 1s0y n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1s0y n GLY 33 N 1.51 3.34 3.77 3.41 0.00 0.28 -5.04 105.19 112.46 1s0y n GLY 33 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1s0y n GLY 33 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s0y s GLU 34 N -0.79 4.21 0.77 1.61 2.56 -1.24 -4.95 118.70 120.86 1s0y s GLU 34 Ca 0.00 2.34 -0.10 0.00 0.00 0.00 0.00 54.97 57.21 1s0y s GLU 34 Cb 0.00 -2.99 0.07 0.00 2.00 0.00 0.00 34.13 33.21 1s0y s GLU 34 CO 0.00 -0.36 1.12 -1.25 -0.56 0.00 0.00 175.26 174.21 1s0y s PRO 35 N -1.97 2.11 0.50 4.30 0.04 -1.26 -4.14 135.00 134.58 1s0y s PRO 35 Ca 0.51 0.03 0.17 0.00 0.04 0.00 0.00 61.00 61.76 1s0y s PRO 35 Cb -0.42 -2.02 1.22 0.00 0.04 0.00 0.00 34.50 33.32 1s0y s PRO 35 CO 0.56 -1.44 2.06 0.07 0.04 0.00 0.00 177.00 178.30 1s0y h ARG 36 N -0.88 0.13 0.00 4.56 -0.00 -1.95 -1.25 114.38 114.99 1s0y h ARG 36 Ca -0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 59.98 59.52 1s0y h ARG 36 Cb 1.32 -0.03 0.00 0.00 -0.00 0.00 0.00 29.97 31.26 1s0y h ARG 36 CO 0.64 0.09 0.00 1.05 -0.00 0.00 0.00 179.97 181.75 1s0y h GLU 37 N 0.13 0.00 -0.56 0.08 -0.00 -2.01 -2.64 114.58 109.59 1s0y h GLU 37 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.50 1s0y h GLU 37 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.14 1s0y h GLU 37 CO -0.02 0.00 0.00 0.09 -0.00 0.00 0.00 179.01 179.08 1s0y n ASN 38 N -2.98 3.63 -4.28 3.06 3.02 -0.47 -4.94 115.26 112.29 1s0y n ASN 38 Ca -0.01 -2.08 -0.34 0.00 -0.03 0.00 0.00 54.58 52.12 1s0y n ASN 38 Cb 0.21 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 38.84 1s0y n ASN 38 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1s0y s ILE 39 N -1.15 2.92 -0.11 2.41 1.01 -1.00 -1.38 121.20 123.90 1s0y s ILE 39 Ca 0.39 -0.67 -0.02 0.00 0.00 0.00 0.00 60.65 60.35 1s0y s ILE 39 Cb 0.21 -2.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1s0y s ILE 39 CO 0.25 0.49 -0.03 0.12 0.00 0.00 0.00 174.94 175.76 1s0y s PHE 40 N 1.06 3.06 -0.03 3.97 5.36 -0.48 -5.01 117.98 125.92 1s0y s PHE 40 Ca -0.00 -0.01 0.02 0.00 -0.96 0.00 0.00 56.93 55.98 1s0y s PHE 40 Cb -0.15 -1.83 0.01 0.00 -0.34 0.00 0.00 43.02 40.71 1s0y s PHE 40 CO -0.03 0.27 -0.07 0.12 -1.46 0.00 0.00 175.22 174.05 1s0y s PHE 41 N -0.44 0.81 -0.01 10.12 5.36 -1.26 -0.36 117.98 132.21 1s0y s PHE 41 Ca 0.07 -0.20 0.03 0.00 -0.96 0.00 0.00 56.93 55.87 1s0y s PHE 41 Cb -0.12 -0.62 -0.01 0.00 -0.34 0.00 0.00 43.02 41.94 1s0y s PHE 41 CO 0.02 -0.11 -0.11 0.54 -1.46 0.00 0.00 175.22 174.10 1s0y s VAL 42 N 0.36 0.89 -0.08 3.12 0.11 -0.20 -4.99 120.40 119.61 1s0y s VAL 42 Ca -0.05 -0.47 0.00 0.00 -2.93 0.00 0.00 61.98 58.53 1s0y s VAL 42 Cb -0.09 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 33.98 1s0y s VAL 42 CO 0.00 0.25 -0.06 -0.63 -3.33 0.00 0.00 175.10 171.33 1s0y s ILE 43 N -0.21 3.74 -0.15 7.04 1.01 -1.26 -0.20 121.20 131.17 1s0y s ILE 43 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.23 1s0y s ILE 43 Cb -0.05 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.90 1s0y s ILE 43 CO -0.00 0.58 -0.15 -0.13 0.00 0.00 0.00 174.94 175.24 1s0y s ARG 44 N -0.60 2.39 0.18 2.79 0.52 0.75 -4.92 118.95 120.05 1s0y s ARG 44 Ca 0.09 -0.60 0.06 0.00 -0.52 0.00 0.00 55.73 54.76 1s0y s ARG 44 Cb -0.12 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 33.17 1s0y s ARG 44 CO 0.02 -0.21 0.08 -1.21 0.02 0.00 0.00 175.30 174.00 1s0y s GLU 45 N 1.40 2.70 0.04 3.54 2.02 -1.26 -1.63 118.70 125.52 1s0y s GLU 45 Ca 0.04 -0.98 -0.27 0.00 0.02 0.00 0.00 54.97 53.77 1s0y s GLU 45 Cb -0.13 -2.52 0.09 0.00 0.10 0.00 0.00 34.13 31.67 1s0y s GLU 45 CO -0.10 0.47 0.82 0.20 0.02 0.00 0.00 175.26 176.67 1s0y s GLY 46 N -3.10 -0.49 1.00 -1.39 0.00 -1.22 -4.88 107.32 97.24 1s0y s GLY 46 Ca 0.30 0.83 -0.13 0.00 0.00 0.00 0.00 44.72 45.72 1s0y s GLY 46 CO 0.22 0.27 1.12 -1.35 0.00 0.00 0.00 173.10 173.36 1s0y s SER 47 N -2.57 2.70 0.38 1.64 1.04 -1.26 -0.70 113.70 114.92 1s0y s SER 47 Ca 0.04 0.99 0.11 0.00 0.48 0.00 0.00 55.95 57.58 1s0y s SER 47 Cb -0.01 -1.55 0.89 0.00 0.10 0.00 0.00 66.02 65.45 1s0y s SER 47 CO -0.09 -3.06 1.88 1.23 0.98 0.00 0.00 173.24 174.17 1s0y h GLY 48 N -1.85 1.07 2.00 7.32 0.00 -1.75 -1.93 103.07 107.93 1s0y h GLY 48 Ca -0.52 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 46.54 1s0y h GLY 48 CO 0.56 0.07 -0.03 1.19 0.00 0.00 0.00 176.54 178.33 1s0y h ILE 49 N 0.61 0.60 -0.01 2.60 6.09 -1.85 -1.86 117.51 123.68 1s0y h ILE 49 Ca 0.43 -0.11 0.00 0.00 -1.37 0.00 0.00 64.86 63.81 1s0y h ILE 49 Cb 0.79 1.07 0.00 0.00 0.47 0.00 0.00 36.82 39.15 1s0y h ILE 49 CO -0.19 0.03 0.00 0.59 -3.07 0.00 0.00 178.15 175.51 1s0y n ASN 50 N -3.89 0.38 -4.16 2.19 3.02 -0.73 -4.77 115.26 107.30 1s0y n ASN 50 Ca -0.03 -1.21 -0.33 0.00 -0.03 0.00 0.00 54.58 52.98 1s0y n ASN 50 Cb 0.11 -0.01 -0.16 0.00 -0.61 0.00 0.00 39.78 39.11 1s0y n ASN 50 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1s0y s PHE 51 N -1.99 2.71 -0.25 3.10 0.40 -0.73 -5.05 117.98 116.18 1s0y s PHE 51 Ca 0.41 -1.44 -0.02 0.00 -0.60 0.00 0.00 56.93 55.28 1s0y s PHE 51 Cb 0.20 -1.85 0.02 0.00 0.51 0.00 0.00 43.02 41.89 1s0y s PHE 51 CO 0.33 -0.68 -0.05 0.08 0.70 0.00 0.00 175.22 175.60 1s0y s VAL 52 N 0.98 2.99 -0.00 -0.44 1.01 -1.26 -0.63 120.40 123.04 1s0y s VAL 52 Ca -0.03 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.07 1s0y s VAL 52 Cb -0.15 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.72 1s0y s VAL 52 CO -0.06 0.22 -0.18 -1.61 0.00 0.00 0.00 175.10 173.48 1s0y s GLU 53 N 1.35 1.41 -1.56 2.72 2.02 -0.37 -4.74 118.70 119.53 1s0y s GLU 53 Ca 0.01 -0.69 -0.12 0.00 0.02 0.00 0.00 54.97 54.19 1s0y s GLU 53 Cb -0.16 -1.39 0.09 0.00 0.10 0.00 0.00 34.13 32.77 1s0y s GLU 53 CO -0.04 0.38 0.77 0.72 0.02 0.00 0.00 175.26 177.10 1s0y n HIS 54 N 2.49 -1.91 -3.48 1.61 8.25 -1.26 -1.24 115.22 119.68 1s0y n HIS 54 Ca -0.15 0.83 -0.24 0.00 -0.26 0.00 0.00 57.72 57.89 1s0y n HIS 54 Cb 0.54 -3.53 0.07 0.00 1.12 0.00 0.00 29.99 28.18 1s0y n HIS 54 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s0y n GLY 55 N -1.63 -0.54 3.47 -1.41 0.00 -1.26 -5.00 105.19 98.82 1s0y n GLY 55 Ca -0.04 0.23 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 1s0y n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s0y s GLU 56 N -6.19 0.61 0.33 1.61 0.41 -0.38 -5.15 118.70 109.95 1s0y s GLU 56 Ca 0.53 0.94 -0.29 0.00 -0.41 0.00 0.00 54.97 55.74 1s0y s GLU 56 Cb -0.23 0.17 -0.10 0.00 -1.78 0.00 0.00 34.13 32.18 1s0y s GLU 56 CO 0.65 -0.13 1.29 -1.01 -0.49 0.00 0.00 175.26 175.58 1s0y s HIS 57 N 1.06 3.07 0.28 1.61 3.76 -1.26 -1.24 115.29 122.57 1s0y s HIS 57 Ca -0.06 1.43 -0.19 0.00 -0.15 0.00 0.00 55.06 56.09 1s0y s HIS 57 Cb -0.06 -3.66 -0.09 0.00 1.11 0.00 0.00 32.58 29.89 1s0y s HIS 57 CO -0.10 -1.79 0.77 -0.51 -0.85 0.00 0.00 174.74 172.26 1s0y s LEU 58 N -1.80 4.22 0.79 0.89 1.43 0.19 -4.92 118.68 119.47 1s0y s LEU 58 Ca 0.49 1.44 -0.11 0.00 -1.03 0.00 0.00 54.13 54.92 1s0y s LEU 58 Cb -0.39 -3.87 0.06 0.00 0.03 0.00 0.00 46.19 42.02 1s0y s LEU 58 CO 0.52 -0.09 1.09 -2.16 0.23 0.00 0.00 176.35 175.94 1s0y s PRO 59 N -2.42 2.17 0.50 1.29 0.04 -1.26 -3.09 135.00 132.23 1s0y s PRO 59 Ca 0.49 0.69 -0.23 0.00 0.04 0.00 0.00 61.00 61.99 1s0y s PRO 59 Cb -0.14 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 1s0y s PRO 59 CO 0.19 -1.58 1.40 -0.51 0.04 0.00 0.00 177.00 176.55 1s0y s ASP 60 N -3.87 5.53 0.49 6.66 -0.00 -1.26 -4.33 116.67 119.89 1s0y s ASP 60 Ca 0.60 2.86 -0.22 0.00 -0.00 0.00 0.00 52.55 55.80 1s0y s ASP 60 Cb -0.14 -2.65 -0.07 0.00 -0.00 0.00 0.00 42.92 40.06 1s0y s ASP 60 CO 0.54 -1.40 1.14 -0.47 -0.00 0.00 0.00 175.17 174.99 1s0y s TYR 61 N -1.25 2.82 0.00 4.23 5.04 -1.26 -4.92 117.35 122.02 1s0y s TYR 61 Ca 0.67 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.84 1s0y s TYR 61 Cb -0.42 -3.32 0.00 0.00 0.35 0.00 0.00 41.96 38.56 1s0y s TYR 61 CO 0.52 -1.46 0.00 0.28 -1.34 0.00 0.00 175.55 173.55