#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 6.66 0.15 0.00 0.01 -1.26 -4.99 113.70 114.28 2h4o s SER 3 Ca 0.00 2.73 -0.25 0.00 1.31 0.00 0.00 55.95 59.75 2h4o s SER 3 Cb 0.00 -2.64 0.06 0.00 0.21 0.00 0.00 66.02 63.65 2h4o s SER 3 CO 0.00 -0.65 0.81 -1.59 0.41 0.00 0.00 173.24 172.22 2h4o s LYS 4 N -1.27 1.26 -0.22 12.44 -2.85 -1.26 -5.14 119.74 122.72 2h4o s LYS 4 Ca 0.54 -0.61 -0.05 0.00 -1.00 0.00 0.00 55.97 54.84 2h4o s LYS 4 Cb -0.42 0.49 -0.02 0.00 -2.06 0.00 0.00 37.83 35.82 2h4o s LYS 4 CO 0.51 -0.57 0.01 0.21 0.10 0.00 0.00 175.35 175.60 2h4o s LYS 5 N -3.50 3.57 -0.00 1.78 2.20 -1.26 -5.11 119.74 117.42 2h4o s LYS 5 Ca 0.08 -0.54 0.04 0.00 -0.36 0.00 0.00 55.97 55.19 2h4o s LYS 5 Cb -0.02 -3.12 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 2h4o s LYS 5 CO -0.03 -0.08 -0.09 0.54 -0.36 0.00 0.00 175.35 175.33 2h4o s VAL 6 N 1.25 3.45 -0.09 4.02 0.11 -1.26 -5.10 120.40 122.78 2h4o s VAL 6 Ca 0.04 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.26 2h4o s VAL 6 Cb -0.15 -2.47 0.03 0.00 -1.53 0.00 0.00 36.38 32.27 2h4o s VAL 6 CO 0.01 0.43 0.00 -2.28 -3.33 0.00 0.00 175.10 169.93 2h4o s HIS 7 N -0.94 0.77 0.00 1.54 5.04 -1.26 -5.15 115.29 115.29 2h4o s HIS 7 Ca 0.16 -0.29 0.02 0.00 -1.54 0.00 0.00 55.06 53.41 2h4o s HIS 7 Cb -0.11 -0.86 -0.01 0.00 0.04 0.00 0.00 32.58 31.65 2h4o s HIS 7 CO 0.06 -0.37 -0.06 -1.14 -2.34 0.00 0.00 174.74 170.88 2h4o s GLN 8 N 1.94 0.50 -0.09 2.88 0.74 -1.26 -5.09 119.66 119.27 2h4o s GLN 8 Ca 0.04 -0.27 0.03 0.00 0.05 0.00 0.00 55.36 55.21 2h4o s GLN 8 Cb -0.13 -0.46 -0.01 0.00 1.10 0.00 0.00 33.01 33.51 2h4o s GLN 8 CO -0.06 0.12 -0.18 0.42 -0.55 0.00 0.00 175.29 175.04 2h4o s ILE 9 N -0.27 2.61 -0.08 -2.34 -1.09 -1.26 -5.12 121.20 113.65 2h4o s ILE 9 Ca 0.01 -0.84 0.04 0.00 -2.23 0.00 0.00 60.65 57.63 2h4o s ILE 9 Cb -0.03 -2.03 -0.01 0.00 -1.58 0.00 0.00 42.46 38.80 2h4o s ILE 9 CO -0.00 0.55 -0.21 0.20 -1.23 0.00 0.00 174.94 174.26 2h4o s ASN 10 N 0.04 3.42 -0.05 3.58 -0.87 -1.26 -5.08 114.94 114.73 2h4o s ASN 10 Ca -0.07 -0.44 -0.02 0.00 -1.57 0.00 0.00 52.86 50.76 2h4o s ASN 10 Cb -0.15 -1.15 0.03 0.00 -0.02 0.00 0.00 41.25 39.97 2h4o s ASN 10 CO 0.05 0.22 0.08 -0.69 -2.57 0.00 0.00 177.10 174.19 2h4o s VAL 11 N -0.01 -0.14 -0.12 1.60 1.01 -1.26 -5.13 120.40 116.35 2h4o s VAL 11 Ca -0.07 0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.33 2h4o s VAL 11 Cb -0.15 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.06 2h4o s VAL 11 CO 0.05 0.16 -0.17 -0.75 0.00 0.00 0.00 175.10 174.39 2h4o s LYS 12 N 2.19 2.43 0.00 2.72 2.20 -1.26 -5.09 119.74 122.93 2h4o s LYS 12 Ca 0.05 -0.63 0.00 0.00 -0.36 0.00 0.00 55.97 55.02 2h4o s LYS 12 Cb -0.12 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.16 2h4o s LYS 12 CO -0.04 -0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 2h4o n GLY 13 N 4.21 -1.41 3.65 5.54 0.00 -1.26 -4.12 105.19 111.79 2h4o n GLY 13 Ca -0.19 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.86 3.19 -0.19 1.61 5.36 0.75 -4.69 117.98 121.14 2h4o s PHE 14 Ca 0.00 1.28 -0.19 0.00 -0.96 0.00 0.00 56.93 57.06 2h4o s PHE 14 Cb 0.00 -3.52 -0.03 0.00 -0.34 0.00 0.00 43.02 39.13 2h4o s PHE 14 CO 0.00 -0.75 0.56 0.12 -1.46 0.00 0.00 175.22 173.69 2h4o s PHE 15 N 3.49 3.38 0.32 10.12 5.36 -1.26 -1.78 117.98 137.62 2h4o s PHE 15 Ca 0.46 0.84 0.06 0.00 -0.96 0.00 0.00 56.93 57.32 2h4o s PHE 15 Cb -0.14 -2.71 -0.06 0.00 -0.34 0.00 0.00 43.02 39.76 2h4o s PHE 15 CO 0.12 -0.11 -0.01 0.34 -1.46 0.00 0.00 175.22 174.09 2h4o s ASP 16 N 1.15 2.87 0.00 6.13 -1.08 -0.39 -5.02 116.67 120.32 2h4o s ASP 16 Ca 0.26 -1.28 0.00 0.00 -0.52 0.00 0.00 52.55 51.01 2h4o s ASP 16 Cb -0.16 -0.19 0.00 0.00 -1.46 0.00 0.00 42.92 41.12 2h4o s ASP 16 CO 0.10 -0.44 0.00 0.47 0.52 0.00 0.00 175.17 175.82 2h4o n ASP 18 N -0.69 0.00 0.00 -0.34 8.00 -1.26 -0.42 116.55 121.84 2h4o n ASP 18 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.46 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 0.00 0.00 2.53 0.31 -1.26 -5.23 118.33 114.68 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 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 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 -2.31 0.00 -4.91 5.55 1.02 0.44 -4.93 120.64 115.50 2h4o n GLU 21 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 2h4o n GLU 21 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.27 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 -1.51 2.81 -0.10 2.62 1.01 -0.23 -1.26 120.40 123.75 2h4o s VAL 22 Ca 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 2h4o s VAL 22 Cb 0.00 -2.14 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 0.00 175.10 175.92 2h4o s THR 23 N 0.09 0.51 -0.06 3.92 -1.32 -0.73 -0.24 115.64 117.82 2h4o s THR 23 Ca -0.07 -0.04 -0.03 0.00 -1.21 0.00 0.00 61.69 60.33 2h4o s THR 23 Cb -0.15 -0.69 -0.04 0.00 -1.51 0.00 0.00 72.50 70.11 2h4o s THR 23 CO 0.05 0.22 0.12 -1.83 -2.21 0.00 0.00 174.62 170.96 2h4o s GLU 24 N 1.91 3.28 -0.73 7.08 -1.05 -0.93 -0.18 118.70 128.07 2h4o s GLU 24 Ca 0.04 -0.31 -0.16 0.00 -0.15 0.00 0.00 54.97 54.39 2h4o s GLU 24 Cb -0.13 -3.03 0.16 0.00 -0.44 0.00 0.00 34.13 30.70 2h4o s GLU 24 CO -0.06 0.71 0.75 -1.14 0.95 0.00 0.00 175.26 176.47 2h4o s GLN 25 N -1.44 3.36 1.01 -4.83 2.00 -1.26 -2.32 119.66 116.17 2h4o s GLN 25 Ca 0.20 -1.96 -0.16 0.00 -2.00 0.00 0.00 55.36 51.44 2h4o s GLN 25 Cb -0.12 -4.44 0.21 0.00 0.80 0.00 0.00 33.01 29.46 2h4o s GLN 25 CO 0.10 -1.42 1.24 0.99 -0.50 0.00 0.00 175.29 175.70 2h4o s THR 26 N 1.36 1.90 -2.00 -0.34 2.01 -0.48 -4.92 115.64 113.17 2h4o s THR 26 Ca 0.16 0.00 0.16 0.00 0.31 0.00 0.00 61.69 62.31 2h4o s THR 26 Cb -0.16 -2.84 0.45 0.00 0.01 0.00 0.00 72.50 69.95 2h4o s THR 26 CO -0.03 0.00 1.44 1.17 -0.69 0.00 0.00 174.62 176.51 2h4o n LYS 27 N -3.99 0.75 0.00 4.92 4.81 -1.26 -4.18 118.16 119.20 2h4o n LYS 27 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 2h4o n LYS 27 Cb 0.60 -1.33 0.00 0.00 0.02 0.00 0.00 35.03 34.32 2h4o n LYS 27 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2h4o n GLU 28 N -0.83 0.00 -1.83 1.64 1.02 -1.26 -5.14 120.64 114.24 2h4o n GLU 28 Ca 0.12 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.23 2h4o n GLU 28 Cb 0.05 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.47 2h4o n GLU 28 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2h4o n ALA 29 N -2.17 0.08 -3.74 0.62 0.00 -1.26 -5.11 120.51 108.92 2h4o n ALA 29 Ca 0.00 -0.22 -0.30 0.00 0.00 0.00 0.00 53.44 52.92 2h4o n ALA 29 Cb 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.22 1.22 0.34 0.00 2.12 -1.26 -1.38 118.70 117.52 2h4o s GLU 30 Ca 0.03 -1.86 -0.26 0.00 0.36 0.00 0.00 54.97 53.24 2h4o s GLU 30 Cb -0.00 -2.37 -0.10 0.00 0.26 0.00 0.00 34.13 31.92 2h4o s GLU 30 CO 0.02 -1.11 0.95 0.71 -0.54 0.00 0.00 175.26 175.28 2h4o s TYR 31 N 0.59 3.65 -0.09 5.30 2.02 -0.98 -4.95 117.35 122.88 2h4o s TYR 31 Ca 0.16 1.76 0.00 0.00 -0.37 0.00 0.00 57.07 58.63 2h4o s TYR 31 Cb -0.23 -2.92 0.02 0.00 -0.40 0.00 0.00 41.96 38.43 2h4o s TYR 31 CO -0.05 0.16 -0.08 0.99 -1.57 0.00 0.00 175.55 175.01 2h4o s THR 32 N -1.67 0.97 0.04 -0.71 2.01 -1.26 -2.20 115.64 112.81 2h4o s THR 32 Ca 0.51 -0.29 0.06 0.00 0.31 0.00 0.00 61.69 62.28 2h4o s THR 32 Cb -0.18 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 2h4o s THR 32 CO 0.23 0.34 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.05 2h4o s TYR 33 N 1.38 2.67 -0.38 4.92 2.02 0.67 -4.99 117.35 123.63 2h4o s TYR 33 Ca -0.02 -0.19 -0.13 0.00 -0.37 0.00 0.00 57.07 56.37 2h4o s TYR 33 Cb -0.14 -1.50 0.01 0.00 -0.40 0.00 0.00 41.96 39.94 2h4o s TYR 33 CO -0.04 0.31 0.25 0.16 -1.57 0.00 0.00 175.55 174.66 2h4o s ASP 34 N -1.52 5.95 0.54 2.29 1.47 -1.26 -1.06 116.67 123.08 2h4o s ASP 34 Ca 0.16 -0.82 0.24 0.00 1.18 0.00 0.00 52.55 53.30 2h4o s ASP 34 Cb -0.11 -2.10 1.44 0.00 -0.34 0.00 0.00 42.92 41.80 2h4o s ASP 34 CO 0.07 -0.38 2.07 0.15 0.68 0.00 0.00 175.17 177.76 2h4o h PHE 35 N 8.53 0.00 0.61 2.11 3.57 -1.91 -2.43 116.94 127.42 2h4o h PHE 35 Ca -0.28 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.19 2h4o h PHE 35 Cb 1.12 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.87 2h4o h PHE 35 CO 0.58 0.00 -0.29 -0.22 -2.23 0.00 0.00 178.31 176.15 2h4o h LYS 36 N 0.00 -0.79 -0.22 1.11 3.64 -1.91 0.40 116.57 118.79 2h4o h LYS 36 Ca 0.14 0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2h4o h LYS 36 Cb 0.60 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 2h4o h LYS 36 CO -0.00 -0.52 0.11 1.49 -2.27 0.00 0.00 179.45 178.26 2h4o h GLU 37 N -0.85 0.23 0.06 1.90 4.57 -1.88 -0.54 114.58 118.08 2h4o h GLU 37 Ca -0.08 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 2h4o h GLU 37 Cb 0.64 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 2h4o h GLU 37 CO 0.14 0.15 -0.24 0.82 -1.18 0.00 0.00 179.01 178.70 2h4o h ILE 38 N 0.24 0.47 -0.84 2.32 2.04 -1.38 -2.60 117.51 117.75 2h4o h ILE 38 Ca 0.09 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.05 2h4o h ILE 38 Cb 0.02 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 36.51 2h4o h ILE 38 CO -0.06 0.00 0.54 0.25 0.00 0.00 0.00 178.15 178.88 2h4o h LEU 39 N -0.40 0.72 -1.71 1.44 5.85 0.07 -1.89 115.31 119.39 2h4o h LEU 39 Ca 0.04 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2h4o h LEU 39 Cb 0.45 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2h4o h LEU 39 CO -0.17 0.43 -0.18 0.77 -0.34 0.00 0.00 178.44 178.95 2h4o h SER 40 N 0.80 0.00 0.21 1.25 4.64 -0.71 -1.95 113.55 117.79 2h4o h SER 40 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2h4o h SER 40 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2h4o h SER 40 CO -0.15 0.18 0.00 -0.08 -0.87 0.00 0.00 176.83 175.90 2h4o h GLU 41 N 0.00 0.00 -0.00 4.77 4.81 -1.22 -2.05 114.58 120.89 2h4o h GLU 41 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2h4o h GLU 41 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2h4o h GLU 41 CO 0.02 0.00 -0.28 1.19 -0.73 0.00 0.00 179.01 179.21 2h4o n PHE 42 N -2.39 0.00 -1.67 0.92 3.01 -0.74 -5.00 117.46 111.59 2h4o n PHE 42 Ca -0.01 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.00 2h4o n PHE 42 Cb 0.09 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.53 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 -0.57 3.83 0.00 4.37 5.15 -0.77 -2.54 115.26 124.74 2h4o n ASN 43 Ca 0.03 0.94 0.00 0.00 -0.60 0.00 0.00 54.58 54.95 2h4o n ASN 43 Cb 0.19 -1.45 0.00 0.00 -0.53 0.00 0.00 39.78 37.98 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 4.48 1.20 3.00 8.20 0.00 -1.26 -5.08 105.19 115.73 2h4o n GLY 44 Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.41 0.43 -0.24 1.61 -2.85 -1.05 -5.11 119.74 112.11 2h4o s LYS 45 Ca 0.00 -0.47 -0.41 0.00 -1.00 0.00 0.00 55.97 54.10 2h4o s LYS 45 Cb 0.00 -0.28 -0.16 0.00 -2.06 0.00 0.00 37.83 35.32 2h4o s LYS 45 CO 0.00 0.06 1.65 0.09 0.10 0.00 0.00 175.35 177.25 2h4o n ASN 46 N 2.18 2.05 -4.31 0.03 3.02 -1.26 -4.99 115.26 111.98 2h4o n ASN 46 Ca -0.18 1.10 -0.16 0.00 -0.03 0.00 0.00 54.58 55.31 2h4o n ASN 46 Cb 0.56 -1.11 -0.10 0.00 -0.61 0.00 0.00 39.78 38.52 2h4o n ASN 46 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2h4o s VAL 47 N 2.91 0.61 -0.13 2.41 -7.23 -1.26 -5.14 120.40 112.57 2h4o s VAL 47 Ca 0.97 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 59.16 2h4o s VAL 47 Cb -1.11 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 33.29 2h4o s VAL 47 CO 0.65 -0.09 -0.19 -0.44 -0.31 0.00 0.00 175.10 174.72 2h4o s SER 48 N -3.30 2.81 -0.14 4.85 0.01 -1.26 -5.14 113.70 111.54 2h4o s SER 48 Ca 0.35 -0.53 -0.00 0.00 1.31 0.00 0.00 55.95 57.08 2h4o s SER 48 Cb 0.07 -1.28 -0.01 0.00 0.21 0.00 0.00 66.02 65.01 2h4o s SER 48 CO 0.12 0.04 -0.13 -0.63 0.41 0.00 0.00 173.24 173.06 2h4o s ILE 49 N 0.94 3.05 -0.11 1.44 1.01 -1.26 -5.08 121.20 121.19 2h4o s ILE 49 Ca -0.06 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.96 2h4o s ILE 49 Cb -0.15 -2.29 0.01 0.00 0.01 0.00 0.00 42.46 40.04 2h4o s ILE 49 CO -0.03 0.52 -0.17 -0.89 0.00 0.00 0.00 174.94 174.37 2h4o s THR 50 N 0.47 1.60 -0.16 2.92 2.01 -1.26 -5.11 115.64 116.12 2h4o s THR 50 Ca -0.09 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.19 2h4o s THR 50 Cb -0.16 -1.44 0.03 0.00 0.01 0.00 0.00 72.50 70.94 2h4o s THR 50 CO 0.04 0.46 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 2h4o s VAL 51 N 0.83 1.45 0.07 3.82 1.01 -1.26 -5.07 120.40 121.25 2h4o s VAL 51 Ca -0.09 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.28 2h4o s VAL 51 Cb -0.16 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2h4o s VAL 51 CO 0.01 0.32 -0.24 -0.75 0.00 0.00 0.00 175.10 174.43 2h4o s LYS 52 N 1.51 1.51 -0.12 2.72 2.20 -1.26 -5.11 119.74 121.20 2h4o s LYS 52 Ca 0.03 -1.12 -0.04 0.00 -0.36 0.00 0.00 55.97 54.48 2h4o s LYS 52 Cb -0.14 -1.75 0.05 0.00 -1.51 0.00 0.00 37.83 34.48 2h4o s LYS 52 CO -0.09 0.44 0.13 -2.00 -0.36 0.00 0.00 175.35 173.46 2h4o s GLU 53 N -1.47 0.04 -0.09 4.03 2.12 -1.26 -5.10 118.70 116.96 2h4o s GLU 53 Ca 0.10 0.28 0.04 0.00 0.36 0.00 0.00 54.97 55.75 2h4o s GLU 53 Cb -0.10 -0.92 -0.01 0.00 0.26 0.00 0.00 34.13 33.36 2h4o s GLU 53 CO 0.03 -0.47 -0.21 -1.83 -0.54 0.00 0.00 175.26 172.24 2h4o s GLU 54 N 2.23 2.92 0.18 4.30 -1.05 -1.26 -5.12 118.70 120.89 2h4o s GLU 54 Ca 0.04 -0.82 0.00 0.00 -0.15 0.00 0.00 54.97 54.04 2h4o s GLU 54 Cb -0.14 -2.35 -0.00 0.00 -0.44 0.00 0.00 34.13 31.21 2h4o s GLU 54 CO -0.07 0.30 0.00 0.09 0.95 0.00 0.00 175.26 176.53 2h4o n ASN 55 N 3.22 2.50 -4.93 0.83 3.02 -1.26 -5.15 115.26 113.49 2h4o n ASN 55 Ca -0.18 -1.78 -0.25 0.00 -0.03 0.00 0.00 54.58 52.34 2h4o n ASN 55 Cb 0.53 0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.81 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 -2.64 3.49 -0.06 3.52 0.41 -1.26 -5.07 118.70 117.09 2h4o s GLU 56 Ca 0.00 -0.21 -0.21 0.00 -0.41 0.00 0.00 54.97 54.14 2h4o s GLU 56 Cb 0.00 -2.59 -0.04 0.00 -1.78 0.00 0.00 34.13 29.72 2h4o s GLU 56 CO 0.00 0.06 0.61 -0.51 -0.49 0.00 0.00 175.26 174.92 2h4o s LEU 57 N -4.42 4.34 0.02 1.80 1.43 -1.26 -5.00 118.68 115.59 2h4o s LEU 57 Ca 0.42 1.08 -0.30 0.00 -1.03 0.00 0.00 54.13 54.30 2h4o s LEU 57 Cb -0.10 -2.93 -0.09 0.00 0.03 0.00 0.00 46.19 43.10 2h4o s LEU 57 CO 0.38 -0.01 1.97 -0.81 0.23 0.00 0.00 176.35 178.11 2h4o n PRO 58 N 3.41 2.79 -1.86 1.29 -0.04 -1.26 -4.96 135.00 134.36 2h4o n PRO 58 Ca -0.05 1.02 -0.25 0.00 -0.04 0.00 0.00 63.50 64.18 2h4o n PRO 58 Cb 0.51 -2.98 0.16 0.00 -0.04 0.00 0.00 33.50 31.16 2h4o n PRO 58 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2h4o n VAL 59 N 5.56 0.00 -0.89 0.52 0.24 -1.26 -5.01 118.33 117.49 2h4o n VAL 59 Ca 0.21 -1.01 0.00 0.00 -2.04 0.00 0.00 64.34 61.50 2h4o n VAL 59 Cb 0.40 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.36 2h4o n VAL 59 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2h4o n LYS 60 N -3.30 0.00 -2.99 7.34 2.85 -1.26 -5.02 118.16 115.77 2h4o n LYS 60 Ca 0.15 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.41 2h4o n LYS 60 Cb 0.52 -0.29 -0.00 0.00 -0.65 0.00 0.00 35.03 34.61 2h4o n LYS 60 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2h4o s GLY 61 N 0.00 -1.39 0.33 2.58 0.00 -1.26 -5.14 107.32 102.43 2h4o s GLY 61 Ca 0.00 0.45 -0.19 0.00 0.00 0.00 0.00 44.72 44.98 2h4o s GLY 61 CO 0.00 3.89 0.82 0.14 0.00 0.00 0.00 173.10 177.95 2h4o s VAL 62 N 1.69 4.50 0.00 1.40 1.01 -1.26 -5.30 120.40 122.44 2h4o s VAL 62 Ca 0.18 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.47 2h4o s VAL 62 Cb -0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2h4o s VAL 62 CO -0.09 -0.07 0.00 -0.62 0.00 0.00 0.00 175.10 174.32