#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hyi n LYS 2 N 0.00 0.00 -4.58 5.56 5.02 -1.26 -4.56 118.16 118.33 1hyi n LYS 2 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 1hyi n LYS 2 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 1hyi n LYS 2 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1hyi s TRP 3 N 0.00 2.38 -1.27 2.13 -0.00 -1.26 -5.03 118.94 115.88 1hyi s TRP 3 Ca 0.00 -0.72 -0.19 0.00 -0.00 0.00 0.00 56.10 55.19 1hyi s TRP 3 Cb 0.00 -1.77 0.03 0.00 -0.00 0.00 0.00 33.47 31.73 1hyi s TRP 3 CO 0.00 0.36 1.80 0.00 -0.00 0.00 0.00 176.95 179.11 1hyi n ALA 4 N -1.07 3.20 -1.38 5.86 0.00 -1.26 -4.75 120.51 121.11 1hyi n ALA 4 Ca -0.07 -3.65 0.00 0.00 0.00 0.00 0.00 53.44 49.72 1hyi n ALA 4 Cb 0.67 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.54 1hyi n ALA 4 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1hyi n GLU 5 N 8.28 0.00 -0.59 0.00 1.02 -1.26 -4.81 120.64 123.28 1hyi n GLU 5 Ca 0.48 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.60 1hyi n GLU 5 Cb 0.46 -0.07 -0.02 0.00 -0.02 0.00 0.00 31.44 31.78 1hyi n GLU 5 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1hyi n ASP 6 N -0.48 -0.33 0.26 1.62 2.03 -1.26 -4.88 116.55 113.51 1hyi n ASP 6 Ca 0.00 -1.07 0.12 0.00 0.52 0.00 0.00 54.79 54.37 1hyi n ASP 6 Cb 0.00 0.10 0.71 0.00 -0.72 0.00 0.00 41.12 41.21 1hyi n ASP 6 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1hyi h ASN 7 N 0.00 0.00 0.00 1.67 -1.24 -1.95 -3.38 115.58 110.69 1hyi h ASN 7 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.82 1hyi h ASN 7 Cb 0.93 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.98 1hyi h ASN 7 CO -0.10 0.12 0.00 1.21 -1.29 0.00 0.00 177.43 177.38 1hyi n GLU 8 N -3.64 2.65 -2.87 6.67 2.13 -1.26 -5.00 120.64 119.32 1hyi n GLU 8 Ca -0.02 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.43 1hyi n GLU 8 Cb 0.24 -0.22 -0.06 0.00 0.27 0.00 0.00 31.44 31.67 1hyi n GLU 8 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1hyi s VAL 9 N 0.00 4.30 -0.00 6.31 0.11 -1.26 -4.95 120.40 124.91 1hyi s VAL 9 Ca 0.00 1.70 0.00 0.00 -2.93 0.00 0.00 61.98 60.75 1hyi s VAL 9 Cb 0.00 -4.00 0.00 0.00 -1.53 0.00 0.00 36.38 30.86 1hyi s VAL 9 CO 0.00 0.20 0.63 0.00 -3.33 0.00 0.00 175.10 172.60 1hyi n GLN 10 N 0.71 0.59 -3.55 1.54 3.00 -1.26 -4.79 117.38 113.63 1hyi n GLN 10 Ca 0.00 -0.74 -0.10 0.00 -0.01 0.00 0.00 57.00 56.15 1hyi n GLN 10 Cb 0.50 -0.61 -0.04 0.00 0.00 0.00 0.00 30.24 30.09 1hyi n GLN 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1hyi s ASN 11 N -0.27 -0.38 0.60 1.08 4.22 -1.26 -2.59 114.94 116.34 1hyi s ASN 11 Ca 0.00 0.27 -0.18 0.00 -2.14 0.00 0.00 52.86 50.82 1hyi s ASN 11 Cb 0.00 0.34 -0.07 0.00 1.28 0.00 0.00 41.25 42.80 1hyi s ASN 11 CO 0.00 -0.45 0.58 0.00 -2.04 0.00 0.00 177.10 175.19 1hyi h MET 13 N 0.16 0.36 0.00 0.00 0.00 0.35 -2.73 114.93 113.06 1hyi h MET 13 Ca -0.46 -0.61 0.00 0.00 0.00 0.00 0.00 59.70 58.63 1hyi h MET 13 Cb 1.39 0.23 0.00 0.00 0.00 0.00 0.00 31.60 33.21 1hyi h MET 13 CO 0.47 1.25 0.00 0.00 0.00 0.00 0.00 176.91 178.63 1hyi n ALA 14 N -2.77 -0.01 -0.32 6.32 0.00 -1.26 -4.08 120.51 118.40 1hyi n ALA 14 Ca -0.21 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.41 1hyi n ALA 14 Cb 1.07 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.95 1hyi n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hyi n GLY 16 N -1.42 0.08 3.68 0.00 0.00 -1.03 -4.99 105.19 101.51 1hyi n GLY 16 Ca 0.23 -0.47 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 1hyi n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hyi s LYS 17 N -4.69 4.26 -0.54 1.61 -2.85 -1.26 -4.78 119.74 111.49 1hyi s LYS 17 Ca 0.06 0.54 -0.26 0.00 -1.00 0.00 0.00 55.97 55.31 1hyi s LYS 17 Cb -0.03 -3.53 -0.07 0.00 -2.06 0.00 0.00 37.83 32.15 1hyi s LYS 17 CO 0.07 -0.09 2.36 0.20 0.10 0.00 0.00 175.35 177.99 1hyi s GLY 18 N 1.01 -0.42 1.00 0.59 0.00 -1.26 -2.68 107.32 105.55 1hyi s GLY 18 Ca 0.28 -0.15 -0.18 0.00 0.00 0.00 0.00 44.72 44.66 1hyi s GLY 18 CO 0.11 4.08 -0.78 0.69 0.00 0.00 0.00 173.10 177.20 1hyi n PHE 19 N 15.95 -4.37 -0.69 1.90 3.72 -1.07 -4.98 117.46 127.93 1hyi n PHE 19 Ca 0.36 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 1hyi n PHE 19 Cb 0.53 -1.46 0.00 0.00 -0.94 0.00 0.00 39.48 37.62 1hyi n PHE 19 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1hyi n SER 20 N 2.99 1.69 -0.01 4.37 7.64 -1.26 -4.98 113.62 124.06 1hyi n SER 20 Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.74 1hyi n SER 20 Cb 0.58 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.64 1hyi n SER 20 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1hyi n VAL 21 N 0.00 1.67 0.09 0.44 0.31 -1.26 -4.12 118.33 115.46 1hyi n VAL 21 Ca 0.00 -0.75 0.04 0.00 -0.01 0.00 0.00 64.34 63.62 1hyi n VAL 21 Cb 0.00 -1.26 -0.01 0.00 -0.91 0.00 0.00 33.84 31.66 1hyi n VAL 21 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1hyi h THR 22 N 0.02 0.45 -2.58 2.52 1.35 -2.00 -3.46 112.91 109.22 1hyi h THR 22 Ca -0.32 -1.76 -0.45 0.00 -0.55 0.00 0.00 66.41 63.32 1hyi h THR 22 Cb 2.02 2.02 0.03 0.00 -1.73 0.00 0.00 68.15 70.49 1hyi h THR 22 CO 0.08 0.26 -0.11 -0.69 -0.25 0.00 0.00 175.52 174.81 1hyi s VAL 23 N -3.05 3.75 0.26 6.82 1.01 -1.26 -5.11 120.40 122.82 1hyi s VAL 23 Ca 0.00 -0.59 0.11 0.00 0.00 0.00 0.00 61.98 61.51 1hyi s VAL 23 Cb 0.08 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1hyi s VAL 23 CO 0.78 -0.25 -0.20 -0.13 0.00 0.00 0.00 175.10 175.30 1hyi s ARG 24 N -4.55 1.62 -0.31 2.72 1.81 -1.26 -4.30 118.95 114.69 1hyi s ARG 24 Ca 0.50 -1.72 -0.01 0.00 -1.72 0.00 0.00 55.73 52.78 1hyi s ARG 24 Cb -0.10 -1.70 0.06 0.00 -0.45 0.00 0.00 34.95 32.75 1hyi s ARG 24 CO 0.37 0.32 0.00 0.50 -0.68 0.00 0.00 175.30 175.82 1hyi s ARG 25 N -3.43 2.31 0.35 3.54 3.52 -1.26 -3.93 118.95 120.05 1hyi s ARG 25 Ca 0.28 -1.36 0.08 0.00 -0.13 0.00 0.00 55.73 54.60 1hyi s ARG 25 Cb -0.05 -3.17 -0.05 0.00 -1.56 0.00 0.00 34.95 30.12 1hyi s ARG 25 CO 0.14 -0.67 0.08 -1.01 -0.81 0.00 0.00 175.30 173.03 1hyi s HIS 26 N 1.20 2.62 -0.03 5.12 3.76 0.14 -4.96 115.29 123.13 1hyi s HIS 26 Ca -0.04 -0.43 -0.08 0.00 -0.15 0.00 0.00 55.06 54.36 1hyi s HIS 26 Cb -0.20 -1.60 0.01 0.00 1.11 0.00 0.00 32.58 31.90 1hyi s HIS 26 CO -0.02 0.39 0.17 -3.38 -0.85 0.00 0.00 174.74 171.06 1hyi s HIS 27 N -2.49 -0.09 0.06 1.40 -3.43 -1.25 0.26 115.29 109.74 1hyi s HIS 27 Ca 0.37 0.18 -0.31 0.00 -0.80 0.00 0.00 55.06 54.50 1hyi s HIS 27 Cb -0.01 0.02 -0.07 0.00 -1.43 0.00 0.00 32.58 31.09 1hyi s HIS 27 CO 0.21 -0.21 1.41 0.00 -2.00 0.00 0.00 174.74 174.14 1hyi h ARG 29 N 7.41 0.00 0.00 0.00 -0.00 -1.71 0.39 114.38 120.47 1hyi h ARG 29 Ca -0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.08 1hyi h ARG 29 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.16 1hyi h ARG 29 CO 0.88 0.10 0.00 0.94 0.00 0.00 0.00 179.97 181.90 1hyi n GLN 30 N -3.29 0.00 0.25 0.04 7.27 -1.26 -4.29 117.38 116.09 1hyi n GLN 30 Ca -0.00 0.29 0.12 0.00 0.07 0.00 0.00 57.00 57.48 1hyi n GLN 30 Cb 0.33 -0.77 0.59 0.00 2.41 0.00 0.00 30.24 32.79 1hyi n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1hyi n GLY 32 N -0.11 0.48 3.95 0.00 0.00 0.14 -5.00 105.19 104.65 1hyi n GLY 32 Ca -0.00 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 1hyi n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hyi s ASN 33 N -2.95 4.54 -0.32 1.61 0.02 -1.18 -4.24 114.94 112.42 1hyi s ASN 33 Ca 0.03 0.20 -0.05 0.00 -1.02 0.00 0.00 52.86 52.02 1hyi s ASN 33 Cb -0.01 -0.74 0.04 0.00 0.02 0.00 0.00 41.25 40.56 1hyi s ASN 33 CO 0.03 -1.75 0.07 -0.63 0.02 0.00 0.00 177.10 174.84 1hyi s ILE 34 N -3.25 3.51 0.12 0.60 -1.09 -1.26 -0.71 121.20 119.11 1hyi s ILE 34 Ca 0.63 -1.20 0.11 0.00 -2.23 0.00 0.00 60.65 57.95 1hyi s ILE 34 Cb -0.09 -2.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.77 1hyi s ILE 34 CO 0.45 -0.14 -0.26 -0.36 -1.23 0.00 0.00 174.94 173.39 1hyi s PHE 35 N 1.35 2.25 0.84 3.97 0.08 0.72 0.27 117.98 127.47 1hyi s PHE 35 Ca -0.03 -0.39 -0.13 0.00 0.12 0.00 0.00 56.93 56.51 1hyi s PHE 35 Cb -0.19 -1.24 0.10 0.00 -0.57 0.00 0.00 43.02 41.12 1hyi s PHE 35 CO 0.01 0.30 1.20 0.00 -0.10 0.00 0.00 175.22 176.63 1hyi h ALA 37 N -1.20 1.37 0.05 0.00 0.00 -1.94 -1.16 119.26 116.39 1hyi h ALA 37 Ca -0.46 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.16 1hyi h ALA 37 Cb 1.32 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1hyi h ALA 37 CO 0.61 -0.37 -1.57 0.39 0.00 0.00 0.00 179.25 178.31 1hyi n GLU 38 N -2.46 0.65 -0.15 0.00 1.02 -1.26 -3.38 120.64 115.05 1hyi n GLU 38 Ca -0.01 0.45 -0.11 0.00 -0.02 0.00 0.00 57.16 57.46 1hyi n GLU 38 Cb 0.45 -1.73 -0.01 0.00 -0.02 0.00 0.00 31.44 30.13 1hyi n GLU 38 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1hyi n SER 40 N -4.20 3.40 -1.73 0.00 2.88 -0.57 -3.64 113.62 109.77 1hyi n SER 40 Ca -0.00 -2.65 -0.06 0.00 -1.33 0.00 0.00 58.87 54.83 1hyi n SER 40 Cb 0.42 -0.63 -0.07 0.00 -0.75 0.00 0.00 64.21 63.18 1hyi n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1hyi n ALA 41 N -0.01 5.01 -2.67 -1.46 0.00 -1.01 -4.75 120.51 115.63 1hyi n ALA 41 Ca 0.22 -0.83 -0.09 0.00 0.00 0.00 0.00 53.44 52.74 1hyi n ALA 41 Cb 0.92 -1.55 -0.07 0.00 0.00 0.00 0.00 19.45 18.74 1hyi n ALA 41 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1hyi s LYS 42 N 0.31 0.82 -0.04 0.00 1.02 -1.26 -5.02 119.74 115.56 1hyi s LYS 42 Ca 0.28 -0.85 -0.10 0.00 0.02 0.00 0.00 55.97 55.33 1hyi s LYS 42 Cb 0.14 0.34 0.02 0.00 -0.52 0.00 0.00 37.83 37.80 1hyi s LYS 42 CO -0.00 -0.26 0.23 -0.80 -0.92 0.00 0.00 175.35 173.60 1hyi s ASN 43 N -2.64 -0.15 -0.08 2.83 0.01 -1.26 -3.13 114.94 110.52 1hyi s ASN 43 Ca 0.02 0.16 -0.03 0.00 -0.71 0.00 0.00 52.86 52.29 1hyi s ASN 43 Cb 0.03 0.36 0.04 0.00 0.41 0.00 0.00 41.25 42.09 1hyi s ASN 43 CO -0.09 -0.28 0.17 0.00 -1.51 0.00 0.00 177.10 175.39 1hyi s ALA 44 N -0.78 -0.32 0.49 0.60 0.00 -1.03 -4.96 121.76 115.77 1hyi s ALA 44 Ca -0.09 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 52.42 1hyi s ALA 44 Cb -0.05 -0.56 -0.09 0.00 0.00 0.00 0.00 23.12 22.43 1hyi s ALA 44 CO 0.02 -0.24 0.99 -1.17 0.00 0.00 0.00 175.76 175.36 1hyi s LEU 45 N 1.40 3.75 0.04 0.00 0.20 -1.26 -2.68 118.68 120.12 1hyi s LEU 45 Ca -0.07 1.69 -0.01 0.00 0.69 0.00 0.00 54.13 56.42 1hyi s LEU 45 Cb -0.11 -4.53 -0.03 0.00 -0.43 0.00 0.00 46.19 41.08 1hyi s LEU 45 CO -0.07 -0.60 -0.02 0.28 -0.29 0.00 0.00 176.35 175.66 1hyi s THR 46 N -2.37 0.18 -0.57 3.68 -1.32 -1.19 -4.83 115.64 109.22 1hyi s THR 46 Ca 0.62 -1.50 0.21 0.00 -1.21 0.00 0.00 61.69 59.80 1hyi s THR 46 Cb -0.11 -1.12 0.21 0.00 -1.51 0.00 0.00 72.50 69.97 1hyi s THR 46 CO 0.24 -0.83 1.63 -0.81 -2.21 0.00 0.00 174.62 172.65 1hyi n PRO 47 N 0.57 0.14 0.04 7.08 -0.04 -1.26 -0.29 135.00 141.24 1hyi n PRO 47 Ca -0.17 0.41 -0.10 0.00 -0.04 0.00 0.00 63.50 63.60 1hyi n PRO 47 Cb 0.59 -1.79 -0.13 0.00 -0.04 0.00 0.00 33.50 32.13 1hyi n PRO 47 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1hyi h SER 48 N 0.00 0.09 -0.00 3.54 0.02 -1.96 -3.36 113.55 111.89 1hyi h SER 48 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1hyi h SER 48 Cb 0.29 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1hyi h SER 48 CO 0.00 1.10 -0.43 -1.20 -1.14 0.00 0.00 176.83 175.16 1hyi n SER 49 N -3.29 0.55 -1.12 3.07 7.64 -1.04 -4.97 113.62 114.47 1hyi n SER 49 Ca -0.08 -0.78 -0.14 0.00 1.01 0.00 0.00 58.87 58.89 1hyi n SER 49 Cb 0.99 0.93 -0.06 0.00 -1.01 0.00 0.00 64.21 65.07 1hyi n SER 49 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1hyi n LYS 50 N -1.11 -1.58 -3.76 1.43 5.02 0.60 -4.89 118.16 113.87 1hyi n LYS 50 Ca 0.02 0.93 -0.09 0.00 -2.02 0.00 0.00 58.31 57.14 1hyi n LYS 50 Cb 0.16 -5.26 -0.04 0.00 -0.02 0.00 0.00 35.03 29.87 1hyi n LYS 50 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1hyi s LYS 51 N -3.09 1.41 -0.46 1.97 -2.85 -1.25 -4.95 119.74 110.52 1hyi s LYS 51 Ca 0.00 -0.90 -0.28 0.00 -1.00 0.00 0.00 55.97 53.79 1hyi s LYS 51 Cb 0.00 0.52 0.01 0.00 -2.06 0.00 0.00 37.83 36.30 1hyi s LYS 51 CO 0.00 -0.60 1.47 -1.25 0.10 0.00 0.00 175.35 175.07 1hyi s PRO 52 N -3.89 3.42 0.49 1.78 0.04 -1.26 -3.17 135.00 132.41 1hyi s PRO 52 Ca 0.10 0.81 0.02 0.00 0.04 0.00 0.00 61.00 61.97 1hyi s PRO 52 Cb -0.01 -4.09 0.01 0.00 0.04 0.00 0.00 34.50 30.45 1hyi s PRO 52 CO -0.02 -1.77 0.70 0.14 0.04 0.00 0.00 177.00 176.09 1hyi s VAL 53 N 5.95 3.30 -0.05 -0.36 -7.23 -1.09 -4.84 120.40 116.09 1hyi s VAL 53 Ca 0.60 -0.65 -0.19 0.00 -1.81 0.00 0.00 61.98 59.93 1hyi s VAL 53 Cb -0.13 -3.21 -0.05 0.00 0.56 0.00 0.00 36.38 33.54 1hyi s VAL 53 CO 0.30 -0.14 0.54 -0.60 -0.31 0.00 0.00 175.10 174.89 1hyi s ARG 54 N -4.61 4.29 -0.01 4.82 3.52 -1.26 -2.45 118.95 123.24 1hyi s ARG 54 Ca 0.53 0.61 -0.22 0.00 -0.13 0.00 0.00 55.73 56.51 1hyi s ARG 54 Cb -0.10 -3.37 0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1hyi s ARG 54 CO 0.37 0.31 0.49 0.14 -0.81 0.00 0.00 175.30 175.81 1hyi s VAL 55 N 0.06 0.03 0.97 7.11 -7.23 -1.18 -1.87 120.40 118.29 1hyi s VAL 55 Ca 0.29 -0.26 -0.12 0.00 -1.81 0.00 0.00 61.98 60.07 1hyi s VAL 55 Cb -0.17 -0.86 0.17 0.00 0.56 0.00 0.00 36.38 36.09 1hyi s VAL 55 CO 0.14 -0.14 1.09 0.00 -0.31 0.00 0.00 175.10 175.88 1hyi h ASP 57 N -1.80 -1.35 -0.03 0.00 3.32 -1.93 0.35 116.42 114.98 1hyi h ASP 57 Ca -0.53 0.21 0.01 0.00 0.02 0.00 0.00 57.03 56.73 1hyi h ASP 57 Cb 1.32 0.59 -0.01 0.00 0.22 0.00 0.00 39.33 41.45 1hyi h ASP 57 CO 0.57 -0.36 -0.11 0.00 -1.72 0.00 0.00 179.24 177.61 1hyi h ALA 58 N 0.46 -0.51 -0.51 3.45 0.00 -1.93 -2.19 119.26 118.04 1hyi h ALA 58 Ca 0.14 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.13 1hyi h ALA 58 Cb 0.58 0.68 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 1hyi h ALA 58 CO -0.55 -0.55 0.04 0.00 0.00 0.00 0.00 179.25 178.19 1hyi h PHE 60 N 0.16 0.26 -0.20 0.00 3.57 0.29 1.30 116.94 122.33 1hyi h PHE 60 Ca 0.26 0.06 -0.13 0.00 3.53 0.00 0.00 57.97 61.68 1hyi h PHE 60 Cb 0.38 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1hyi h PHE 60 CO -0.28 -0.40 -0.44 -0.91 -2.23 0.00 0.00 178.31 174.05 1hyi h ASN 61 N 0.05 0.52 0.16 0.41 2.35 -0.60 -2.57 115.58 115.89 1hyi h ASN 61 Ca 0.66 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 1hyi h ASN 61 Cb 1.48 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.70 1hyi h ASN 61 CO -0.83 0.89 0.00 -0.78 -1.65 0.00 0.00 177.43 175.06 1hyi h ASP 62 N 0.40 0.00 0.05 5.81 3.58 0.20 -1.70 116.42 124.75 1hyi h ASP 62 Ca 0.03 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.13 1hyi h ASP 62 Cb 0.93 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.94 1hyi h ASP 62 CO 0.08 0.00 -1.95 0.18 -2.88 0.00 0.00 179.24 174.67 1hyi n LEU 63 N -2.81 2.39 -1.11 2.28 4.77 -0.85 -4.13 117.00 117.53 1hyi n LEU 63 Ca -0.02 0.23 -0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1hyi n LEU 63 Cb 0.10 -1.00 0.13 0.00 -2.33 0.00 0.00 43.42 40.31 1hyi n LEU 63 CO 0.18 0.67 0.55 0.00 -1.33 0.00 0.00 177.39 177.46 1hyi n GLN 64 N -3.81 2.22 0.00 3.23 10.64 -1.06 -5.01 117.38 123.58 1hyi n GLN 64 Ca -0.38 -1.15 0.12 0.00 -1.83 0.00 0.00 57.00 53.76 1hyi n GLN 64 Cb 0.91 -1.70 0.10 0.00 -0.86 0.00 0.00 30.24 28.69 1hyi n GLN 64 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64