#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4o s SER 3 N 0.00 6.35 0.23 0.00 0.01 -1.26 -4.98 113.70 114.06 2h4o s SER 3 Ca 0.00 2.98 -0.22 0.00 1.31 0.00 0.00 55.95 60.02 2h4o s SER 3 Cb 0.00 -2.66 0.04 0.00 0.21 0.00 0.00 66.02 63.61 2h4o s SER 3 CO 0.00 -0.86 0.85 -1.59 0.41 0.00 0.00 173.24 172.04 2h4o s LYS 4 N -2.10 1.56 -0.21 12.44 -2.85 -1.26 -5.13 119.74 122.20 2h4o s LYS 4 Ca 0.53 -0.89 0.00 0.00 -1.00 0.00 0.00 55.97 54.61 2h4o s LYS 4 Cb -0.45 0.51 0.02 0.00 -2.06 0.00 0.00 37.83 35.85 2h4o s LYS 4 CO 0.61 -0.72 -0.14 0.21 0.10 0.00 0.00 175.35 175.41 2h4o s LYS 5 N -3.39 2.95 -0.06 1.78 2.20 -1.26 -5.11 119.74 116.85 2h4o s LYS 5 Ca 0.13 -0.87 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 2h4o s LYS 5 Cb -0.04 -2.74 -0.03 0.00 -1.51 0.00 0.00 37.83 33.51 2h4o s LYS 5 CO 0.05 -0.28 -0.05 0.54 -0.36 0.00 0.00 175.35 175.26 2h4o s VAL 6 N 1.31 3.88 -0.10 4.02 0.11 -1.26 -5.09 120.40 123.26 2h4o s VAL 6 Ca 0.03 -0.46 -0.02 0.00 -2.93 0.00 0.00 61.98 58.60 2h4o s VAL 6 Cb -0.15 -2.62 0.03 0.00 -1.53 0.00 0.00 36.38 32.12 2h4o s VAL 6 CO -0.09 0.56 0.00 -2.28 -3.33 0.00 0.00 175.10 169.96 2h4o s HIS 7 N -0.87 0.82 0.04 1.54 5.04 -1.26 -5.14 115.29 115.45 2h4o s HIS 7 Ca 0.14 -0.36 0.02 0.00 -1.54 0.00 0.00 55.06 53.32 2h4o s HIS 7 Cb -0.11 -0.89 -0.02 0.00 0.04 0.00 0.00 32.58 31.60 2h4o s HIS 7 CO 0.03 -0.40 -0.08 -1.14 -2.34 0.00 0.00 174.74 170.80 2h4o s GLN 8 N 1.93 0.55 -0.10 2.88 0.74 -1.26 -5.11 119.66 119.28 2h4o s GLN 8 Ca 0.04 -0.71 0.02 0.00 0.05 0.00 0.00 55.36 54.76 2h4o s GLN 8 Cb -0.13 -0.36 0.01 0.00 1.10 0.00 0.00 33.01 33.63 2h4o s GLN 8 CO -0.06 0.07 -0.16 0.42 -0.55 0.00 0.00 175.29 175.01 2h4o s ILE 9 N -1.22 1.54 -0.12 -2.34 -1.09 -1.26 -5.12 121.20 111.58 2h4o s ILE 9 Ca -0.08 -0.68 -0.01 0.00 -2.23 0.00 0.00 60.65 57.66 2h4o s ILE 9 Cb -0.09 -1.39 -0.02 0.00 -1.58 0.00 0.00 42.46 39.38 2h4o s ILE 9 CO 0.00 0.45 -0.10 0.20 -1.23 0.00 0.00 174.94 174.26 2h4o s ASN 10 N 0.86 4.31 -0.04 3.58 -0.87 -1.26 -5.07 114.94 116.46 2h4o s ASN 10 Ca -0.09 -0.22 -0.01 0.00 -1.57 0.00 0.00 52.86 50.96 2h4o s ASN 10 Cb -0.15 -1.54 0.03 0.00 -0.02 0.00 0.00 41.25 39.56 2h4o s ASN 10 CO 0.00 0.21 0.04 -0.69 -2.57 0.00 0.00 177.10 174.09 2h4o s VAL 11 N 0.12 -0.04 -0.11 1.60 1.01 -1.26 -5.13 120.40 116.60 2h4o s VAL 11 Ca -0.04 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2h4o s VAL 11 Cb -0.14 -0.17 0.02 0.00 0.00 0.00 0.00 36.38 36.09 2h4o s VAL 11 CO 0.04 0.16 -0.10 -0.75 0.00 0.00 0.00 175.10 174.45 2h4o s LYS 12 N 1.81 1.76 0.00 2.72 2.20 -1.26 -5.08 119.74 121.89 2h4o s LYS 12 Ca 0.01 -0.37 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 2h4o s LYS 12 Cb -0.12 -1.66 0.00 0.00 -1.51 0.00 0.00 37.83 34.54 2h4o s LYS 12 CO -0.03 -0.17 0.00 0.41 -0.36 0.00 0.00 175.35 175.20 2h4o n GLY 13 N 4.58 -1.28 3.65 5.54 0.00 -1.26 -4.15 105.19 112.27 2h4o n GLY 13 Ca -0.16 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 2h4o n GLY 13 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2h4o s PHE 14 N -2.98 3.34 -0.16 1.61 5.36 0.71 -4.72 117.98 121.14 2h4o s PHE 14 Ca 0.00 1.26 -0.20 0.00 -0.96 0.00 0.00 56.93 57.03 2h4o s PHE 14 Cb 0.00 -3.11 -0.03 0.00 -0.34 0.00 0.00 43.02 39.54 2h4o s PHE 14 CO 0.00 -0.40 0.59 0.12 -1.46 0.00 0.00 175.22 174.08 2h4o s PHE 15 N 2.82 3.44 0.29 10.12 5.36 -1.26 -1.53 117.98 137.22 2h4o s PHE 15 Ca 0.38 0.95 0.05 0.00 -0.96 0.00 0.00 56.93 57.35 2h4o s PHE 15 Cb -0.15 -2.73 -0.06 0.00 -0.34 0.00 0.00 43.02 39.74 2h4o s PHE 15 CO 0.08 -0.04 0.01 0.34 -1.46 0.00 0.00 175.22 174.15 2h4o s ASP 16 N 1.00 2.42 0.00 6.13 -1.08 -0.26 -5.03 116.67 119.85 2h4o s ASP 16 Ca 0.29 -1.29 0.00 0.00 -0.52 0.00 0.00 52.55 51.03 2h4o s ASP 16 Cb -0.16 -0.10 0.00 0.00 -1.46 0.00 0.00 42.92 41.20 2h4o s ASP 16 CO 0.12 -0.50 0.00 0.47 0.52 0.00 0.00 175.17 175.77 2h4o n ASP 18 N -0.61 0.00 -0.01 -0.34 8.00 -1.26 -0.29 116.55 122.05 2h4o n ASP 18 Ca -0.04 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.45 2h4o n ASP 18 Cb 0.65 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.75 2h4o n ASP 18 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2h4o n VAL 19 N 0.00 0.19 0.00 2.53 0.31 -1.26 -5.24 118.33 114.86 2h4o n VAL 19 Ca 0.00 0.45 0.00 0.00 -0.01 0.00 0.00 64.34 64.78 2h4o n VAL 19 Cb 0.00 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 2h4o n VAL 19 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2h4o n GLU 21 N -2.72 0.00 -4.90 5.55 1.02 0.61 -4.94 120.64 115.25 2h4o n GLU 21 Ca -0.02 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.80 2h4o n GLU 21 Cb 0.06 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.34 2h4o n GLU 21 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2h4o s VAL 22 N -1.58 2.83 -0.10 2.62 1.01 0.22 -1.10 120.40 124.30 2h4o s VAL 22 Ca 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 2h4o s VAL 22 Cb 0.00 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.27 2h4o s VAL 22 CO 0.00 0.55 0.01 0.28 0.00 0.00 0.00 175.10 175.94 2h4o s THR 23 N 0.07 0.41 -0.07 3.92 -1.32 -0.59 -0.06 115.64 118.00 2h4o s THR 23 Ca -0.07 -0.03 -0.05 0.00 -1.21 0.00 0.00 61.69 60.34 2h4o s THR 23 Cb -0.15 -0.64 -0.04 0.00 -1.51 0.00 0.00 72.50 70.16 2h4o s THR 23 CO 0.05 0.16 0.15 -1.83 -2.21 0.00 0.00 174.62 170.94 2h4o s GLU 24 N 1.95 3.42 -0.58 7.08 -1.05 -0.93 -0.21 118.70 128.38 2h4o s GLU 24 Ca 0.04 -0.23 -0.18 0.00 -0.15 0.00 0.00 54.97 54.45 2h4o s GLU 24 Cb -0.13 -3.13 0.11 0.00 -0.44 0.00 0.00 34.13 30.53 2h4o s GLU 24 CO -0.06 0.73 0.66 -1.14 0.95 0.00 0.00 175.26 176.40 2h4o s GLN 25 N -1.44 3.03 0.15 -4.83 2.00 -1.26 -2.26 119.66 115.06 2h4o s GLN 25 Ca 0.20 -1.39 -0.14 0.00 -2.00 0.00 0.00 55.36 52.04 2h4o s GLN 25 Cb -0.12 -4.27 -0.07 0.00 0.80 0.00 0.00 33.01 29.35 2h4o s GLN 25 CO 0.11 -1.49 0.54 0.99 -0.50 0.00 0.00 175.29 174.94 2h4o s THR 26 N 2.45 4.87 -1.49 -0.34 2.01 0.19 -4.94 115.64 118.39 2h4o s THR 26 Ca 0.10 0.78 0.00 0.00 0.31 0.00 0.00 61.69 62.87 2h4o s THR 26 Cb -0.25 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.54 2h4o s THR 26 CO 0.06 0.21 0.07 1.17 -0.69 0.00 0.00 174.62 175.44 2h4o n LYS 27 N 0.71 0.10 0.00 4.92 4.81 -1.26 -1.27 118.16 126.17 2h4o n LYS 27 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 2h4o n LYS 27 Cb 0.52 -1.03 0.00 0.00 0.02 0.00 0.00 35.03 34.54 2h4o n LYS 27 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2h4o n GLU 28 N -0.01 1.39 -3.40 1.64 0.28 -1.26 -5.15 120.64 114.12 2h4o n GLU 28 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.97 2h4o n GLU 28 Cb 0.01 -0.49 0.02 0.00 1.43 0.00 0.00 31.44 32.41 2h4o n GLU 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2h4o n ALA 29 N -0.38 -2.12 -3.83 -1.84 0.00 -0.40 -5.12 120.51 106.82 2h4o n ALA 29 Ca 0.00 -0.85 -0.30 0.00 0.00 0.00 0.00 53.44 52.29 2h4o n ALA 29 Cb 0.00 0.50 -0.14 0.00 0.00 0.00 0.00 19.45 19.81 2h4o n ALA 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2h4o s GLU 30 N -2.04 1.30 0.37 0.00 2.12 -1.26 0.56 118.70 119.74 2h4o s GLU 30 Ca 0.18 -1.84 -0.21 0.00 0.36 0.00 0.00 54.97 53.46 2h4o s GLU 30 Cb -0.02 -2.62 -0.10 0.00 0.26 0.00 0.00 34.13 31.64 2h4o s GLU 30 CO 0.05 -1.05 0.89 0.71 -0.54 0.00 0.00 175.26 175.31 2h4o s TYR 31 N 0.70 3.42 -0.10 5.30 2.02 -0.96 -4.95 117.35 122.78 2h4o s TYR 31 Ca 0.14 1.55 -0.01 0.00 -0.37 0.00 0.00 57.07 58.38 2h4o s TYR 31 Cb -0.22 -2.78 0.03 0.00 -0.40 0.00 0.00 41.96 38.58 2h4o s TYR 31 CO -0.08 0.03 -0.05 0.99 -1.57 0.00 0.00 175.55 174.86 2h4o s THR 32 N -1.98 0.84 -0.03 -0.71 2.01 -1.26 -2.20 115.64 112.31 2h4o s THR 32 Ca 0.57 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.43 2h4o s THR 32 Cb -0.12 -0.90 -0.03 0.00 0.01 0.00 0.00 72.50 71.47 2h4o s THR 32 CO 0.17 0.34 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.01 2h4o s TYR 33 N 1.78 2.77 -0.45 4.92 2.02 0.91 -5.00 117.35 124.31 2h4o s TYR 33 Ca 0.05 -0.11 -0.18 0.00 -0.37 0.00 0.00 57.07 56.47 2h4o s TYR 33 Cb -0.12 -1.62 0.04 0.00 -0.40 0.00 0.00 41.96 39.85 2h4o s TYR 33 CO -0.07 0.26 0.48 0.16 -1.57 0.00 0.00 175.55 174.80 2h4o s ASP 34 N -0.95 6.20 0.55 2.29 3.84 -1.26 -0.61 116.67 126.73 2h4o s ASP 34 Ca 0.13 -0.80 0.26 0.00 -0.00 0.00 0.00 52.55 52.15 2h4o s ASP 34 Cb -0.11 -2.23 1.47 0.00 -1.38 0.00 0.00 42.92 40.67 2h4o s ASP 34 CO 0.02 -0.66 2.01 0.15 -0.00 0.00 0.00 175.17 176.70 2h4o h PHE 35 N 8.79 0.00 0.46 2.11 3.57 -1.90 -2.43 116.94 127.54 2h4o h PHE 35 Ca -0.27 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.21 2h4o h PHE 35 Cb 1.11 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.85 2h4o h PHE 35 CO 0.65 0.00 -0.22 -0.22 -2.23 0.00 0.00 178.31 176.29 2h4o h LYS 36 N 0.00 -0.60 -0.14 1.11 3.64 -1.92 0.35 116.57 119.02 2h4o h LYS 36 Ca 0.20 0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2h4o h LYS 36 Cb 0.88 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 2h4o h LYS 36 CO -0.00 -0.35 0.07 1.49 -2.27 0.00 0.00 179.45 178.38 2h4o h GLU 37 N -0.72 0.14 0.23 1.90 4.57 -1.87 -0.71 114.58 118.12 2h4o h GLU 37 Ca -0.06 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2h4o h GLU 37 Cb 0.53 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 2h4o h GLU 37 CO 0.10 0.09 -0.38 0.82 -1.18 0.00 0.00 179.01 178.46 2h4o h ILE 38 N 0.15 0.21 -0.98 2.32 2.04 -1.42 -2.46 117.51 117.36 2h4o h ILE 38 Ca 0.06 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.07 2h4o h ILE 38 Cb 0.01 0.21 -0.09 0.00 -0.74 0.00 0.00 36.82 36.22 2h4o h ILE 38 CO -0.04 0.00 0.62 0.25 0.00 0.00 0.00 178.15 178.98 2h4o h LEU 39 N -0.69 0.82 -1.98 1.44 5.85 -0.13 -1.62 115.31 119.00 2h4o h LEU 39 Ca 0.00 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2h4o h LEU 39 Cb 0.67 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 2h4o h LEU 39 CO -0.16 0.38 -0.10 0.77 -0.34 0.00 0.00 178.44 178.99 2h4o h SER 40 N 0.85 0.00 0.35 1.25 4.64 -0.66 -1.16 113.55 118.81 2h4o h SER 40 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2h4o h SER 40 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2h4o h SER 40 CO -0.29 0.10 0.00 1.21 -0.87 0.00 0.00 176.83 176.98 2h4o n GLU 41 N -3.91 0.11 0.00 4.77 2.13 -0.61 -2.14 120.64 120.99 2h4o n GLU 41 Ca -0.02 0.47 0.04 0.00 0.66 0.00 0.00 57.16 58.31 2h4o n GLU 41 Cb 0.20 -1.76 -0.03 0.00 0.27 0.00 0.00 31.44 30.12 2h4o n GLU 41 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2h4o n PHE 42 N -1.97 0.00 -1.68 4.31 3.01 -0.45 -5.01 117.46 115.67 2h4o n PHE 42 Ca 0.01 0.00 -0.46 0.00 1.01 0.00 0.00 57.45 58.01 2h4o n PHE 42 Cb 0.12 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.55 2h4o n PHE 42 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2h4o n ASN 43 N -0.78 3.54 0.00 4.37 5.15 -0.91 -2.46 115.26 124.17 2h4o n ASN 43 Ca 0.03 0.99 0.00 0.00 -0.60 0.00 0.00 54.58 55.00 2h4o n ASN 43 Cb 0.17 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 37.99 2h4o n ASN 43 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2h4o n GLY 44 N 4.19 1.05 3.15 8.20 0.00 -1.26 -5.08 105.19 115.44 2h4o n GLY 44 Ca 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 2h4o n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h4o s LYS 45 N -0.72 0.79 0.16 1.61 -2.85 -1.03 -5.13 119.74 112.57 2h4o s LYS 45 Ca 0.00 -1.22 -0.30 0.00 -1.00 0.00 0.00 55.97 53.44 2h4o s LYS 45 Cb 0.00 0.26 -0.08 0.00 -2.06 0.00 0.00 37.83 35.95 2h4o s LYS 45 CO 0.00 -0.21 1.32 -0.80 0.10 0.00 0.00 175.35 175.76 2h4o s ASN 46 N -2.95 6.89 -0.04 0.03 0.01 -1.26 -5.02 114.94 112.61 2h4o s ASN 46 Ca 0.12 2.35 -0.10 0.00 -0.71 0.00 0.00 52.86 54.51 2h4o s ASN 46 Cb 0.07 -2.60 0.02 0.00 0.41 0.00 0.00 41.25 39.14 2h4o s ASN 46 CO -0.06 -0.56 0.24 0.68 -1.51 0.00 0.00 177.10 175.89 2h4o s VAL 47 N 0.47 0.05 -0.27 1.60 -7.23 -1.26 -5.13 120.40 108.63 2h4o s VAL 47 Ca 0.59 -0.38 -0.09 0.00 -1.81 0.00 0.00 61.98 60.29 2h4o s VAL 47 Cb -0.36 -0.47 -0.04 0.00 0.56 0.00 0.00 36.38 36.07 2h4o s VAL 47 CO 0.35 -0.21 0.13 -0.44 -0.31 0.00 0.00 175.10 174.63 2h4o s SER 48 N -0.85 5.60 -0.06 4.85 0.01 -1.26 -5.10 113.70 116.89 2h4o s SER 48 Ca -0.09 -0.12 0.02 0.00 1.31 0.00 0.00 55.95 57.06 2h4o s SER 48 Cb -0.05 -2.03 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 2h4o s SER 48 CO 0.02 -0.05 -0.10 -0.63 0.41 0.00 0.00 173.24 172.89 2h4o s ILE 49 N 1.69 3.43 -0.03 1.44 1.01 -1.26 -5.09 121.20 122.39 2h4o s ILE 49 Ca 0.07 -0.58 0.02 0.00 0.00 0.00 0.00 60.65 60.15 2h4o s ILE 49 Cb -0.16 -2.38 0.01 0.00 0.01 0.00 0.00 42.46 39.94 2h4o s ILE 49 CO 0.07 0.59 -0.06 -0.89 0.00 0.00 0.00 174.94 174.65 2h4o s THR 50 N -0.73 0.62 -0.20 2.92 2.01 -1.26 -5.11 115.64 113.89 2h4o s THR 50 Ca 0.11 -0.23 -0.01 0.00 0.31 0.00 0.00 61.69 61.87 2h4o s THR 50 Cb -0.11 -0.59 0.06 0.00 0.01 0.00 0.00 72.50 71.87 2h4o s THR 50 CO 0.01 0.22 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.46 2h4o s VAL 51 N 0.49 0.98 0.03 3.82 1.01 -1.26 -5.07 120.40 120.40 2h4o s VAL 51 Ca -0.07 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.17 2h4o s VAL 51 Cb -0.11 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 2h4o s VAL 51 CO 0.00 -0.11 -0.12 -0.75 0.00 0.00 0.00 175.10 174.13 2h4o s LYS 52 N 1.66 2.31 -0.17 2.72 2.20 -1.26 -5.10 119.74 122.10 2h4o s LYS 52 Ca -0.02 -0.86 -0.04 0.00 -0.36 0.00 0.00 55.97 54.68 2h4o s LYS 52 Cb -0.17 -2.35 0.07 0.00 -1.51 0.00 0.00 37.83 33.87 2h4o s LYS 52 CO -0.07 0.57 0.15 -2.00 -0.36 0.00 0.00 175.35 173.63 2h4o s GLU 53 N -1.51 0.10 -0.11 4.03 2.12 -1.26 -5.10 118.70 116.97 2h4o s GLU 53 Ca 0.17 0.12 0.01 0.00 0.36 0.00 0.00 54.97 55.62 2h4o s GLU 53 Cb -0.11 -1.37 -0.02 0.00 0.26 0.00 0.00 34.13 32.89 2h4o s GLU 53 CO 0.07 -0.61 -0.14 -1.83 -0.54 0.00 0.00 175.26 172.21 2h4o s GLU 54 N 2.23 3.19 0.20 4.30 -1.05 -1.26 -5.11 118.70 121.19 2h4o s GLU 54 Ca 0.04 -0.69 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 2h4o s GLU 54 Cb -0.15 -2.57 0.00 0.00 -0.44 0.00 0.00 34.13 30.97 2h4o s GLU 54 CO -0.10 0.30 0.03 0.09 0.95 0.00 0.00 175.26 176.53 2h4o n ASN 55 N 3.26 2.40 -4.95 0.83 3.02 -1.26 -5.15 115.26 113.40 2h4o n ASN 55 Ca -0.18 -1.84 -0.23 0.00 -0.03 0.00 0.00 54.58 52.30 2h4o n ASN 55 Cb 0.53 0.11 0.01 0.00 -0.61 0.00 0.00 39.78 39.82 2h4o n ASN 55 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2h4o s GLU 56 N -2.74 3.03 -0.08 3.52 0.41 -1.26 -5.07 118.70 116.51 2h4o s GLU 56 Ca 0.02 -0.45 -0.18 0.00 -0.41 0.00 0.00 54.97 53.96 2h4o s GLU 56 Cb -0.00 -2.52 -0.05 0.00 -1.78 0.00 0.00 34.13 29.78 2h4o s GLU 56 CO 0.01 -0.33 0.48 -0.51 -0.49 0.00 0.00 175.26 174.42 2h4o s LEU 57 N -4.61 4.33 0.06 1.80 1.43 -1.26 -5.01 118.68 115.42 2h4o s LEU 57 Ca 0.49 0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 54.18 2h4o s LEU 57 Cb -0.10 -2.71 -0.09 0.00 0.03 0.00 0.00 46.19 43.32 2h4o s LEU 57 CO 0.39 0.07 1.94 -2.16 0.23 0.00 0.00 176.35 176.81 2h4o s PRO 58 N 0.22 4.14 0.80 1.29 0.04 -1.26 -4.96 135.00 135.27 2h4o s PRO 58 Ca 0.26 2.61 -0.08 0.00 0.04 0.00 0.00 61.00 63.83 2h4o s PRO 58 Cb -0.16 -4.04 0.13 0.00 0.04 0.00 0.00 34.50 30.48 2h4o s PRO 58 CO 0.12 -0.93 1.12 0.14 0.04 0.00 0.00 177.00 177.48 2h4o s VAL 59 N 4.08 2.13 -0.02 -0.36 -7.23 -1.26 -5.00 120.40 112.74 2h4o s VAL 59 Ca 0.87 -0.29 0.02 0.00 -1.81 0.00 0.00 61.98 60.77 2h4o s VAL 59 Cb -0.43 -2.84 0.03 0.00 0.56 0.00 0.00 36.38 33.70 2h4o s VAL 59 CO 0.40 0.00 0.80 2.29 -0.31 0.00 0.00 175.10 178.28 2h4o n LYS 60 N -3.19 0.82 0.00 4.82 2.85 -1.26 -5.02 118.16 117.18 2h4o n LYS 60 Ca 0.13 -1.08 0.00 0.00 -1.05 0.00 0.00 58.31 56.31 2h4o n LYS 60 Cb 0.60 -0.73 0.00 0.00 -0.65 0.00 0.00 35.03 34.25 2h4o n LYS 60 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2h4o n GLY 61 N -0.28 0.27 3.94 2.58 0.00 -1.26 -5.16 105.19 105.27 2h4o n GLY 61 Ca 0.02 0.65 -0.25 0.00 0.00 0.00 0.00 46.02 46.44 2h4o n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h4o s VAL 62 N 0.00 5.09 0.00 1.61 1.01 -1.26 -5.29 120.40 121.56 2h4o s VAL 62 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 2h4o s VAL 62 Cb 0.00 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2h4o s VAL 62 CO 0.00 -0.55 0.00 -0.62 0.00 0.00 0.00 175.10 173.93