#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x58 n SER 2 N 0.00 3.61 0.00 1.61 7.64 -1.26 -4.88 113.62 120.34 1x58 n SER 2 Ca 0.00 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1x58 n SER 2 Cb 0.00 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 61.69 1x58 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x58 n SER 3 N 3.94 0.00 0.07 6.43 2.88 -1.26 -4.97 113.62 120.70 1x58 n SER 3 Ca 0.17 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.68 1x58 n SER 3 Cb 0.32 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.77 1x58 n SER 3 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1x58 h GLY 4 N 0.00 -0.21 0.61 0.46 0.00 -2.06 -3.39 103.07 98.48 1x58 h GLY 4 Ca 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 1x58 h GLY 4 CO 0.00 -0.07 -0.29 1.76 0.00 0.00 0.00 176.54 177.93 1x58 h SER 5 N -0.41 -0.69 -0.36 0.19 0.02 -1.98 -3.48 113.55 106.84 1x58 h SER 5 Ca -0.02 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1x58 h SER 5 Cb 0.15 0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1x58 h SER 5 CO 0.03 -0.49 0.00 -0.24 -1.14 0.00 0.00 176.83 174.99 1x58 n SER 6 N -4.24 -3.40 -4.55 3.07 2.88 -1.26 -4.21 113.62 101.91 1x58 n SER 6 Ca -0.10 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.06 1x58 n SER 6 Cb 0.32 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.75 1x58 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x58 s GLY 7 N -3.82 0.55 0.00 0.46 0.00 -1.26 -4.71 107.32 98.54 1x58 s GLY 7 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.50 1x58 s GLY 7 CO 0.00 3.08 0.00 0.54 0.00 0.00 0.00 173.10 176.72 1x58 n ARG 8 N 9.17 2.26 -3.50 2.90 3.00 -1.26 -4.71 116.66 124.51 1x58 n ARG 8 Ca 0.19 0.00 -0.28 0.00 -0.01 0.00 0.00 57.85 57.75 1x58 n ARG 8 Cb 0.50 -0.80 -0.12 0.00 0.00 0.00 0.00 32.46 32.05 1x58 n ARG 8 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1x58 s LYS 9 N -1.26 0.85 0.50 5.56 -0.14 -1.26 -5.05 119.74 118.95 1x58 s LYS 9 Ca 0.00 -1.76 0.00 0.00 -1.36 0.00 0.00 55.97 52.85 1x58 s LYS 9 Cb 0.00 -1.59 0.00 0.00 -1.68 0.00 0.00 37.83 34.56 1x58 s LYS 9 CO 0.00 -1.26 0.00 -3.47 -0.76 0.00 0.00 175.35 169.86 1x58 n ASP 10 N 3.51 -6.80 -1.49 2.83 -0.08 -1.26 -5.09 116.55 108.17 1x58 n ASP 10 Ca 0.17 1.14 0.00 0.00 -1.51 0.00 0.00 54.79 54.60 1x58 n ASP 10 Cb 0.40 -4.41 0.00 0.00 2.34 0.00 0.00 41.12 39.45 1x58 n ASP 10 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1x58 n PHE 11 N -4.10 -4.10 -1.21 -0.67 3.01 -1.26 -4.85 117.46 104.28 1x58 n PHE 11 Ca -0.07 2.20 -0.30 0.00 1.01 0.00 0.00 57.45 60.29 1x58 n PHE 11 Cb 0.60 -3.39 0.12 0.00 -0.01 0.00 0.00 39.48 36.80 1x58 n PHE 11 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1x58 s THR 12 N -4.26 2.88 0.41 4.37 -4.23 -1.26 -4.41 115.64 109.14 1x58 s THR 12 Ca 0.00 0.29 0.10 0.00 -1.18 0.00 0.00 61.69 60.89 1x58 s THR 12 Cb 0.00 -2.76 0.30 0.00 1.34 0.00 0.00 72.50 71.37 1x58 s THR 12 CO 0.00 -0.37 2.00 0.50 -0.54 0.00 0.00 174.62 176.21 1x58 h LYS 13 N -1.41 0.53 0.61 3.99 3.11 -1.94 -1.73 116.57 119.73 1x58 h LYS 13 Ca -0.47 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 57.31 1x58 h LYS 13 Cb 1.26 -0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 32.36 1x58 h LYS 13 CO 0.53 0.35 -0.50 0.93 -2.81 0.00 0.00 179.45 177.95 1x58 h GLU 14 N 0.54 -1.04 -0.70 1.90 3.07 -1.98 0.52 114.58 116.88 1x58 h GLU 14 Ca 0.24 0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 59.16 1x58 h GLU 14 Cb 0.26 0.24 -0.03 0.00 -0.84 0.00 0.00 28.75 28.37 1x58 h GLU 14 CO -0.07 -0.70 0.40 0.93 -1.40 0.00 0.00 179.01 178.17 1x58 h GLU 15 N -1.08 0.96 -0.76 2.33 3.07 -1.84 0.45 114.58 117.70 1x58 h GLU 15 Ca -0.08 -0.09 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1x58 h GLU 15 Cb 0.91 -0.20 -0.03 0.00 -0.84 0.00 0.00 28.75 28.59 1x58 h GLU 15 CO -0.01 0.69 0.36 0.28 -1.40 0.00 0.00 179.01 178.94 1x58 h VAL 16 N 0.97 1.24 -0.22 3.13 2.07 -1.27 -0.24 116.25 121.94 1x58 h VAL 16 Ca 0.25 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1x58 h VAL 16 Cb 0.00 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1x58 h VAL 16 CO -0.04 0.29 0.14 -1.13 0.02 0.00 0.00 177.57 176.84 1x58 h ASN 17 N 1.08 0.26 0.17 0.57 -1.24 0.11 -1.46 115.58 115.07 1x58 h ASN 17 Ca 0.26 -0.04 -0.08 0.00 0.71 0.00 0.00 56.30 57.15 1x58 h ASN 17 Cb 0.13 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.10 1x58 h ASN 17 CO -0.03 0.22 -0.30 1.88 -1.29 0.00 0.00 177.43 177.91 1x58 h TYR 18 N 0.28 0.23 0.06 0.67 0.05 -0.96 0.20 116.97 117.50 1x58 h TYR 18 Ca 0.08 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.83 1x58 h TYR 18 Cb 0.01 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 1x58 h TYR 18 CO -0.05 0.49 -0.19 1.25 -1.05 0.00 0.00 178.16 178.61 1x58 h LEU 19 N 0.18 -0.54 -0.33 3.88 7.12 -0.60 0.81 115.31 125.83 1x58 h LEU 19 Ca 0.03 0.07 -0.01 0.00 0.13 0.00 0.00 57.88 58.10 1x58 h LEU 19 Cb 0.62 0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 40.96 1x58 h LEU 19 CO 0.05 -0.26 0.16 -0.26 -0.13 0.00 0.00 178.44 178.00 1x58 h PHE 20 N -0.34 0.47 -0.86 1.25 0.04 -0.78 -1.12 116.94 115.60 1x58 h PHE 20 Ca 0.04 -0.02 0.09 0.00 2.80 0.00 0.00 57.97 60.88 1x58 h PHE 20 Cb 0.38 -0.15 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 1x58 h PHE 20 CO -0.21 0.40 0.51 0.45 -0.60 0.00 0.00 178.31 178.85 1x58 h HIS 21 N 0.40 0.92 0.28 -0.55 3.86 -0.74 -2.03 115.15 117.29 1x58 h HIS 21 Ca 0.11 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 1x58 h HIS 21 Cb 0.10 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.29 1x58 h HIS 21 CO -0.02 0.40 -0.13 0.78 0.86 0.00 0.00 177.93 179.81 1x58 h GLY 22 N 0.86 -0.39 2.00 2.45 0.00 -0.58 -2.94 103.07 104.46 1x58 h GLY 22 Ca 0.40 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.87 1x58 h GLY 22 CO -0.23 -0.14 -0.07 -2.08 0.00 0.00 0.00 176.54 174.02 1x58 h VAL 23 N -0.73 0.35 -0.21 4.60 2.07 -1.06 0.11 116.25 121.37 1x58 h VAL 23 Ca -0.04 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1x58 h VAL 23 Cb 0.49 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1x58 h VAL 23 CO 0.06 0.07 -0.08 0.50 0.02 0.00 0.00 177.57 178.15 1x58 h LYS 24 N 0.00 0.42 0.05 1.57 3.11 -1.35 -1.70 116.57 118.67 1x58 h LYS 24 Ca -0.00 -0.17 -0.38 0.00 -2.81 0.00 0.00 60.65 57.29 1x58 h LYS 24 Cb 0.29 -0.02 -0.05 0.00 -1.00 0.00 0.00 32.23 31.45 1x58 h LYS 24 CO 0.01 0.69 -2.24 -2.37 -2.81 0.00 0.00 179.45 172.73 1x58 n THR 25 N -4.58 1.62 -0.02 1.00 5.66 -0.58 -4.45 114.28 112.92 1x58 n THR 25 Ca -0.05 -0.57 -0.00 0.00 -3.05 0.00 0.00 64.05 60.38 1x58 n THR 25 Cb 0.31 -1.60 -0.00 0.00 -1.55 0.00 0.00 70.33 67.48 1x58 n THR 25 CO 0.00 0.00 0.00 0.24 -3.05 0.00 0.00 175.07 172.26 1x58 h MET 26 N -0.07 0.00 0.00 1.09 2.86 -1.03 -3.52 114.93 114.27 1x58 h MET 26 Ca -0.51 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1x58 h MET 26 Cb 1.92 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.58 1x58 h MET 26 CO -0.04 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.34 1x58 n GLY 27 N 1.91 -0.28 0.67 8.32 0.00 -0.64 -4.81 105.19 110.37 1x58 n GLY 27 Ca -0.00 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1x58 n GLY 27 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x58 n ASN 28 N 0.00 1.60 -4.55 1.61 4.13 -1.26 -4.12 115.26 112.67 1x58 n ASN 28 Ca 0.00 -1.89 -0.38 0.00 1.68 0.00 0.00 54.58 53.99 1x58 n ASN 28 Cb 0.00 -0.47 -0.03 0.00 -1.54 0.00 0.00 39.78 37.73 1x58 n ASN 28 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 1x58 s HIS 29 N -0.63 2.04 0.17 3.10 3.76 -1.26 -4.79 115.29 117.68 1x58 s HIS 29 Ca 0.00 0.20 -0.04 0.00 -0.15 0.00 0.00 55.06 55.07 1x58 s HIS 29 Cb 0.00 -4.37 0.04 0.00 1.11 0.00 0.00 32.58 29.36 1x58 s HIS 29 CO 0.00 -2.08 1.44 -1.49 -0.85 0.00 0.00 174.74 171.76 1x58 h TRP 30 N 11.80 0.70 0.00 1.40 4.06 -1.89 -2.78 115.95 129.24 1x58 h TRP 30 Ca -0.13 -0.28 0.00 0.00 2.06 0.00 0.00 58.89 60.53 1x58 h TRP 30 Cb 1.07 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1x58 h TRP 30 CO 1.14 1.05 0.00 -1.71 -3.56 0.00 0.00 178.44 175.36 1x58 n ASN 31 N -3.90 0.50 -0.07 -3.49 4.05 -1.26 -1.59 115.26 109.49 1x58 n ASN 31 Ca -0.04 0.64 -0.06 0.00 0.45 0.00 0.00 54.58 55.57 1x58 n ASN 31 Cb 0.68 -0.74 -0.03 0.00 1.23 0.00 0.00 39.78 40.91 1x58 n ASN 31 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1x58 h SER 32 N 0.00 0.00 -0.71 1.20 0.02 -1.91 -3.42 113.55 108.74 1x58 h SER 32 Ca 0.00 -0.13 0.13 0.00 -0.84 0.00 0.00 61.79 60.95 1x58 h SER 32 Cb 0.27 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.72 1x58 h SER 32 CO 0.00 0.78 0.27 0.40 -1.14 0.00 0.00 176.83 177.14 1x58 h ILE 33 N -1.00 0.68 -0.07 3.27 2.04 -1.21 0.19 117.51 121.41 1x58 h ILE 33 Ca -0.04 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1x58 h ILE 33 Cb 0.48 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1x58 h ILE 33 CO -0.03 0.08 0.12 0.25 0.00 0.00 0.00 178.15 178.57 1x58 h LEU 34 N 0.42 0.00 0.00 1.44 7.12 -1.54 -1.50 115.31 121.25 1x58 h LEU 34 Ca 0.38 0.00 -0.19 0.00 0.13 0.00 0.00 57.88 58.20 1x58 h LEU 34 Cb 0.55 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 40.64 1x58 h LEU 34 CO -0.38 0.00 -1.73 0.79 -0.13 0.00 0.00 178.44 176.99 1x58 n TRP 35 N -3.51 0.00 0.25 1.25 8.01 -0.57 -4.48 117.44 118.40 1x58 n TRP 35 Ca -0.01 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.26 1x58 n TRP 35 Cb 0.21 -0.50 0.63 0.00 -2.01 0.00 0.00 31.31 29.63 1x58 n TRP 35 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1x58 h SER 36 N 0.00 0.00 -4.18 -0.99 0.87 -0.29 -3.43 113.55 105.52 1x58 h SER 36 Ca -0.29 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 59.77 1x58 h SER 36 Cb 1.53 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 63.28 1x58 h SER 36 CO -0.02 0.04 -0.80 -0.36 -0.53 0.00 0.00 176.83 175.16 1x58 s PHE 37 N -4.92 1.60 -0.50 2.24 0.40 -0.60 -5.06 117.98 111.14 1x58 s PHE 37 Ca -0.05 -0.45 -0.23 0.00 -0.60 0.00 0.00 56.93 55.60 1x58 s PHE 37 Cb 0.16 -0.87 0.04 0.00 0.51 0.00 0.00 43.02 42.86 1x58 s PHE 37 CO 0.67 0.17 0.85 -1.25 0.70 0.00 0.00 175.22 176.36 1x58 s PRO 38 N -2.03 3.35 0.37 0.24 0.04 -1.26 -4.66 135.00 131.05 1x58 s PRO 38 Ca 0.05 -0.24 0.00 0.00 0.04 0.00 0.00 61.00 60.85 1x58 s PRO 38 Cb -0.09 -4.01 -0.03 0.00 0.04 0.00 0.00 34.50 30.42 1x58 s PRO 38 CO 0.04 -1.31 0.58 -0.06 0.04 0.00 0.00 177.00 176.29 1x58 s PHE 39 N 3.56 3.43 0.51 0.56 0.40 -1.26 -4.97 117.98 120.22 1x58 s PHE 39 Ca 0.29 0.32 -0.22 0.00 -0.60 0.00 0.00 56.93 56.72 1x58 s PHE 39 Cb -0.13 -2.00 -0.06 0.00 0.51 0.00 0.00 43.02 41.34 1x58 s PHE 39 CO 0.20 0.00 1.23 -0.65 0.70 0.00 0.00 175.22 176.71 1x58 s GLN 40 N -4.38 3.41 0.49 0.44 -0.21 -1.26 -4.94 119.66 113.21 1x58 s GLN 40 Ca 0.42 1.93 -0.22 0.00 0.02 0.00 0.00 55.36 57.51 1x58 s GLN 40 Cb -0.10 -2.26 -0.08 0.00 1.00 0.00 0.00 33.01 31.56 1x58 s GLN 40 CO 0.37 -0.88 0.99 1.17 -2.12 0.00 0.00 175.29 174.81 1x58 n LYS 41 N -0.87 1.20 0.00 2.91 3.00 -1.26 -1.95 118.16 121.18 1x58 n LYS 41 Ca 0.09 0.44 0.00 0.00 -0.00 0.00 0.00 58.31 58.84 1x58 n LYS 41 Cb 0.47 -2.09 0.00 0.00 0.00 0.00 0.00 35.03 33.41 1x58 n LYS 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1x58 n GLY 42 N 1.22 2.53 3.61 3.14 0.00 -1.26 -5.00 105.19 109.43 1x58 n GLY 42 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1x58 n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x58 s ARG 43 N -0.39 3.39 0.85 1.61 3.00 -0.82 -4.97 118.95 121.61 1x58 s ARG 43 Ca 0.00 1.64 -0.11 0.00 0.00 0.00 0.00 55.73 57.26 1x58 s ARG 43 Cb 0.00 -4.21 0.14 0.00 0.00 0.00 0.00 34.95 30.88 1x58 s ARG 43 CO 0.00 -1.79 1.19 1.03 0.00 0.00 0.00 175.30 175.73 1x58 s ARG 44 N 5.62 1.30 0.35 3.54 0.52 -1.26 -4.99 118.95 124.02 1x58 s ARG 44 Ca 0.84 -0.44 0.03 0.00 -0.52 0.00 0.00 55.73 55.64 1x58 s ARG 44 Cb -0.26 -2.01 0.63 0.00 0.52 0.00 0.00 34.95 33.83 1x58 s ARG 44 CO 0.34 -1.91 1.96 0.00 0.02 0.00 0.00 175.30 175.71 1x58 h ALA 45 N -1.17 1.48 -0.02 2.13 0.00 -1.94 -2.95 119.26 116.79 1x58 h ALA 45 Ca -0.43 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1x58 h ALA 45 Cb 1.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1x58 h ALA 45 CO 0.46 0.42 -0.25 -0.39 0.00 0.00 0.00 179.25 179.50 1x58 h VAL 46 N 0.72 1.19 -0.87 0.00 -1.51 -1.94 -1.81 116.25 112.03 1x58 h VAL 46 Ca 0.18 -0.89 0.02 0.00 -1.23 0.00 0.00 66.70 64.78 1x58 h VAL 46 Cb 0.06 1.45 -0.05 0.00 -2.13 0.00 0.00 31.29 30.62 1x58 h VAL 46 CO -0.03 0.26 0.57 0.44 -1.23 0.00 0.00 177.57 177.58 1x58 h ASP 47 N 0.03 0.97 -0.42 4.19 5.19 -1.89 0.20 116.42 124.70 1x58 h ASP 47 Ca 0.00 -0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.33 1x58 h ASP 47 Cb 0.46 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.71 1x58 h ASP 47 CO 0.03 0.69 0.02 -0.07 -3.12 0.00 0.00 179.24 176.79 1x58 h LEU 48 N 1.15 0.71 -0.08 1.55 3.38 -1.42 0.17 115.31 120.76 1x58 h LEU 48 Ca 0.33 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1x58 h LEU 48 Cb -0.09 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1x58 h LEU 48 CO -0.08 0.83 0.04 0.00 0.09 0.00 0.00 178.44 179.32 1x58 h ALA 49 N 0.90 0.11 0.08 1.53 0.00 -1.31 -0.20 119.26 120.37 1x58 h ALA 49 Ca 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1x58 h ALA 49 Cb 0.46 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1x58 h ALA 49 CO 0.02 -0.34 -0.10 1.25 0.00 0.00 0.00 179.25 180.07 1x58 h HIS 50 N 0.03 -0.27 -0.19 0.00 -0.00 -0.83 -1.38 115.15 112.51 1x58 h HIS 50 Ca 0.03 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.44 1x58 h HIS 50 Cb 0.10 0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 27.58 1x58 h HIS 50 CO -0.04 -0.16 -0.06 -0.22 -0.00 0.00 0.00 177.93 177.45 1x58 h LYS 51 N -0.22 -0.01 0.04 5.26 1.63 -0.48 -1.80 116.57 120.98 1x58 h LYS 51 Ca 0.01 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1x58 h LYS 51 Cb 0.22 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 1x58 h LYS 51 CO -0.04 -0.01 -0.02 -0.92 -3.45 0.00 0.00 179.45 175.00 1x58 h TYR 52 N -0.02 -0.05 -0.58 1.91 3.20 -0.93 0.21 116.97 120.71 1x58 h TYR 52 Ca 0.10 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.08 1x58 h TYR 52 Cb 0.16 0.02 -0.09 0.00 1.54 0.00 0.00 36.73 38.35 1x58 h TYR 52 CO -0.22 0.04 0.04 0.45 -1.64 0.00 0.00 178.16 176.83 1x58 h HIS 53 N -0.14 0.03 -0.44 -3.82 3.86 -1.05 0.13 115.15 113.73 1x58 h HIS 53 Ca -0.01 0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1x58 h HIS 53 Cb 0.12 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 1x58 h HIS 53 CO -0.05 -0.12 -0.07 0.00 0.86 0.00 0.00 177.93 178.56 1x58 h ARG 54 N 0.15 0.75 0.22 2.45 2.47 -0.92 -2.12 114.38 117.38 1x58 h ARG 54 Ca 0.30 -0.23 -0.01 0.00 -1.26 0.00 0.00 59.98 58.79 1x58 h ARG 54 Cb 0.48 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1x58 h ARG 54 CO -0.47 0.81 -0.11 -0.07 0.56 0.00 0.00 179.97 180.70 1x58 h LEU 55 N 0.69 -0.25 -1.11 3.04 3.38 0.82 -2.69 115.31 119.19 1x58 h LEU 55 Ca 0.13 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1x58 h LEU 55 Cb 0.53 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1x58 h LEU 55 CO 0.03 0.07 0.19 0.16 0.09 0.00 0.00 178.44 178.98 1x58 h ILE 56 N -0.59 1.21 -1.82 1.22 3.07 -0.76 -3.41 117.51 116.42 1x58 h ILE 56 Ca -0.03 -0.71 0.08 0.00 1.55 0.00 0.00 64.86 65.76 1x58 h ILE 56 Cb 0.43 0.59 -0.20 0.00 -0.27 0.00 0.00 36.82 37.37 1x58 h ILE 56 CO 0.05 0.27 -0.14 -0.44 -1.05 0.00 0.00 178.15 176.84 1x58 s SER 57 N -6.56 -1.17 1.03 2.16 0.01 -0.80 -5.11 113.70 103.25 1x58 s SER 57 Ca -0.10 1.45 -0.03 0.00 1.31 0.00 0.00 55.95 58.59 1x58 s SER 57 Cb 0.16 2.27 0.04 0.00 0.21 0.00 0.00 66.02 68.71 1x58 s SER 57 CO 0.79 -0.22 0.17 0.61 0.41 0.00 0.00 173.24 175.00 1x58 n GLY 58 N 5.44 -2.23 3.21 3.44 0.00 -1.02 -4.20 105.19 109.84 1x58 n GLY 58 Ca -0.10 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1x58 n GLY 58 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x58 n PRO 59 N -1.89 1.33 -0.32 1.61 -0.04 -1.26 -4.33 135.00 130.11 1x58 n PRO 59 Ca 0.02 -1.84 0.00 0.00 -0.04 0.00 0.00 63.50 61.65 1x58 n PRO 59 Cb 0.09 -3.00 0.00 0.00 -0.04 0.00 0.00 33.50 30.55 1x58 n PRO 59 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x58 n SER 60 N 8.77 0.00 0.03 3.54 7.64 -1.26 -4.91 113.62 127.43 1x58 n SER 60 Ca 0.49 -1.54 0.06 0.00 1.01 0.00 0.00 58.87 58.89 1x58 n SER 60 Cb 0.42 -0.11 0.26 0.00 -1.01 0.00 0.00 64.21 63.77 1x58 n SER 60 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x58 n SER 61 N 0.00 0.15 0.00 6.43 7.64 -1.26 -5.17 113.62 121.41 1x58 n SER 61 Ca 0.00 0.55 0.00 0.00 1.01 0.00 0.00 58.87 60.43 1x58 n SER 61 Cb 0.61 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1x58 n SER 61 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64