#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cvb s THR 2 N 0.00 3.15 -0.19 6.31 2.01 -1.26 -1.00 115.64 124.66 3cvb s THR 2 Ca 0.00 -0.61 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 3cvb s THR 2 Cb 0.00 -2.36 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 3cvb s THR 2 CO 0.00 0.50 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.05 3cvb s PHE 3 N 0.68 3.02 -0.10 4.92 0.08 0.28 -4.98 117.98 121.87 3cvb s PHE 3 Ca -0.05 -0.49 -0.18 0.00 0.12 0.00 0.00 56.93 56.33 3cvb s PHE 3 Cb -0.15 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.20 3cvb s PHE 3 CO 0.02 -0.24 0.47 0.99 -0.10 0.00 0.00 175.22 176.37 3cvb s THR 4 N 0.91 5.16 -0.22 0.64 2.01 -1.26 -0.62 115.64 122.25 3cvb s THR 4 Ca 0.00 0.95 0.01 0.00 0.31 0.00 0.00 61.69 62.96 3cvb s THR 4 Cb -0.14 -3.81 0.03 0.00 0.01 0.00 0.00 72.50 68.59 3cvb s THR 4 CO 0.02 0.36 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.48 3cvb s VAL 5 N 0.39 2.33 0.28 3.82 1.01 0.33 -4.43 120.40 124.14 3cvb s VAL 5 Ca 0.26 -1.17 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 3cvb s VAL 5 Cb -0.15 -2.16 -0.09 0.00 0.00 0.00 0.00 36.38 33.97 3cvb s VAL 5 CO 0.11 0.27 1.05 -0.54 0.00 0.00 0.00 175.10 175.99 3cvb s LYS 6 N 1.24 4.64 -0.39 2.72 1.02 0.28 -0.97 119.74 128.28 3cvb s LYS 6 Ca -0.01 1.67 -0.12 0.00 0.02 0.00 0.00 55.97 57.54 3cvb s LYS 6 Cb -0.16 -3.13 0.03 0.00 -0.52 0.00 0.00 37.83 34.05 3cvb s LYS 6 CO -0.08 0.26 0.24 -1.64 -0.92 0.00 0.00 175.35 173.21 3cvb s MET 7 N -1.51 2.86 0.00 1.68 -1.94 0.14 -0.98 119.30 119.54 3cvb s MET 7 Ca 0.45 -1.08 0.00 0.00 -1.71 0.00 0.00 55.69 53.35 3cvb s MET 7 Cb -0.29 -3.82 0.00 0.00 2.01 0.00 0.00 34.83 32.73 3cvb s MET 7 CO 0.37 -0.73 0.00 0.41 -0.01 0.00 0.00 175.02 175.05 3cvb n GLY 8 N 5.05 0.50 3.78 -0.03 0.00 -0.07 -0.94 105.19 113.48 3cvb n GLY 8 Ca -0.11 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 3cvb n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cvb s ALA 9 N -0.11 2.24 0.44 4.61 0.00 -0.26 -3.96 121.76 124.72 3cvb s ALA 9 Ca 0.00 0.08 0.14 0.00 0.00 0.00 0.00 51.96 52.18 3cvb s ALA 9 Cb 0.00 -3.21 1.04 0.00 0.00 0.00 0.00 23.12 20.95 3cvb s ALA 9 CO 0.00 -1.72 2.00 -0.44 0.00 0.00 0.00 175.76 175.60 3cvb h ASP 10 N -1.09 0.34 0.72 0.00 3.32 -1.96 0.16 116.42 117.92 3cvb h ASP 10 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3cvb h ASP 10 Cb 1.24 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3cvb h ASP 10 CO 0.55 0.22 0.00 -1.54 -1.72 0.00 0.00 179.24 176.74 3cvb n SER 11 N -4.47 0.33 0.00 6.45 3.41 -1.26 -4.88 113.62 113.20 3cvb n SER 11 Ca 0.08 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 3cvb n SER 11 Cb 0.32 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 3cvb n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cvb n GLY 12 N 0.24 0.69 3.66 5.00 0.00 0.57 -5.07 105.19 110.29 3cvb n GLY 12 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3cvb n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cvb n LEU 13 N 0.00 3.82 -4.49 0.99 4.77 -1.26 -4.64 117.00 116.19 3cvb n LEU 13 Ca 0.00 0.99 -0.44 0.00 -0.03 0.00 0.00 56.01 56.53 3cvb n LEU 13 Cb 0.00 -1.45 -0.00 0.00 -2.33 0.00 0.00 43.42 39.64 3cvb n LEU 13 CO 0.00 -1.17 1.53 -0.36 -1.33 0.00 0.00 177.39 176.06 3cvb s PHE 14 N -1.32 3.29 0.02 -1.77 0.08 -1.26 -1.10 117.98 115.92 3cvb s PHE 14 Ca 0.67 -1.96 0.02 0.00 0.12 0.00 0.00 56.93 55.77 3cvb s PHE 14 Cb -0.48 -4.43 -0.01 0.00 -0.57 0.00 0.00 43.02 37.52 3cvb s PHE 14 CO 0.53 -1.51 -0.06 -0.65 -0.10 0.00 0.00 175.22 173.44 3cvb s GLN 15 N 2.33 0.42 0.05 0.44 -0.21 -1.26 -3.69 119.66 117.74 3cvb s GLN 15 Ca 0.45 -0.47 -0.25 0.00 0.02 0.00 0.00 55.36 55.11 3cvb s GLN 15 Cb -0.01 -0.26 -0.05 0.00 1.00 0.00 0.00 33.01 33.69 3cvb s GLN 15 CO 0.02 0.05 0.78 -0.06 -2.12 0.00 0.00 175.29 173.96 3cvb s PHE 16 N -0.83 3.74 -0.20 0.91 0.08 -1.26 -0.89 117.98 119.54 3cvb s PHE 16 Ca -0.06 1.50 -0.02 0.00 0.12 0.00 0.00 56.93 58.47 3cvb s PHE 16 Cb -0.06 -2.84 0.06 0.00 -0.57 0.00 0.00 43.02 39.61 3cvb s PHE 16 CO -0.00 0.27 0.03 -2.00 -0.10 0.00 0.00 175.22 173.41 3cvb s GLU 17 N -0.06 0.74 0.39 0.44 2.12 -0.15 -2.15 118.70 120.03 3cvb s GLU 17 Ca 0.39 -0.47 -0.23 0.00 0.36 0.00 0.00 54.97 55.02 3cvb s GLU 17 Cb -0.21 -2.14 -0.10 0.00 0.26 0.00 0.00 34.13 31.94 3cvb s GLU 17 CO 0.24 -0.63 0.95 -1.25 -0.54 0.00 0.00 175.26 174.02 3cvb s PRO 18 N 1.82 4.37 0.28 4.30 0.04 -1.26 -0.56 135.00 143.98 3cvb s PRO 18 Ca -0.01 1.21 0.10 0.00 0.04 0.00 0.00 61.00 62.33 3cvb s PRO 18 Cb -0.17 -2.43 0.38 0.00 0.04 0.00 0.00 34.50 32.32 3cvb s PRO 18 CO -0.08 0.09 1.63 0.00 0.04 0.00 0.00 177.00 178.68 3cvb h ALA 19 N 2.41 1.01 -3.26 8.56 0.00 -1.76 -3.43 119.26 122.80 3cvb h ALA 19 Ca -0.48 -0.53 -0.67 0.00 0.00 0.00 0.00 54.91 53.23 3cvb h ALA 19 Cb 1.19 -0.09 -0.33 0.00 0.00 0.00 0.00 17.79 18.56 3cvb h ALA 19 CO 0.63 0.72 -0.86 -0.80 0.00 0.00 0.00 179.25 178.94 3cvb s ASN 20 N -6.87 3.23 -0.02 0.00 0.01 -1.26 -0.54 114.94 109.49 3cvb s ASN 20 Ca -0.02 -0.55 0.02 0.00 -0.71 0.00 0.00 52.86 51.60 3cvb s ASN 20 Cb 0.13 -1.46 -0.00 0.00 0.41 0.00 0.00 41.25 40.33 3cvb s ASN 20 CO 0.76 0.11 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.70 3cvb s VAL 21 N 0.62 0.70 -0.18 1.60 1.01 -0.80 -5.00 120.40 118.35 3cvb s VAL 21 Ca -0.11 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.47 3cvb s VAL 21 Cb -0.16 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 3cvb s VAL 21 CO 0.03 0.21 0.01 -0.89 0.00 0.00 0.00 175.10 174.46 3cvb s THR 22 N 0.04 4.21 0.22 3.92 2.01 -1.26 -0.72 115.64 124.06 3cvb s THR 22 Ca -0.00 -0.23 0.10 0.00 0.31 0.00 0.00 61.69 61.86 3cvb s THR 22 Cb -0.06 -2.89 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 3cvb s THR 22 CO 0.00 0.46 -0.18 0.68 -0.69 0.00 0.00 174.62 174.89 3cvb s VAL 23 N 0.61 2.04 0.30 3.82 -7.23 0.34 -4.96 120.40 115.32 3cvb s VAL 23 Ca 0.00 -2.22 0.09 0.00 -1.81 0.00 0.00 61.98 58.05 3cvb s VAL 23 Cb -0.14 -2.10 -0.05 0.00 0.56 0.00 0.00 36.38 34.66 3cvb s VAL 23 CO 0.02 -0.45 0.01 -1.00 -0.31 0.00 0.00 175.10 173.37 3cvb s HIS 24 N -2.58 2.62 0.11 2.82 3.76 -1.26 -1.14 115.29 119.62 3cvb s HIS 24 Ca 0.24 -0.33 -0.35 0.00 -0.15 0.00 0.00 55.06 54.47 3cvb s HIS 24 Cb -0.03 -1.35 -0.15 0.00 1.11 0.00 0.00 32.58 32.16 3cvb s HIS 24 CO 0.10 0.53 1.49 -2.30 -0.85 0.00 0.00 174.74 173.71 3cvb n PRO 25 N -0.94 1.68 -0.07 8.40 -0.02 -1.26 -1.44 135.00 141.34 3cvb n PRO 25 Ca -0.05 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3cvb n PRO 25 Cb 0.60 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 3cvb n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cvb n GLY 26 N 3.07 0.80 3.81 -1.23 0.00 0.96 -4.99 105.19 107.60 3cvb n GLY 26 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 3cvb n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3cvb s ASP 27 N -2.68 5.18 -0.02 1.61 1.01 -0.52 -4.64 116.67 116.61 3cvb s ASP 27 Ca 0.00 1.63 0.08 0.00 0.71 0.00 0.00 52.55 54.97 3cvb s ASP 27 Cb 0.00 -2.47 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 3cvb s ASP 27 CO 0.00 -1.58 -0.25 -0.89 0.21 0.00 0.00 175.17 172.67 3cvb s THR 28 N -3.03 2.16 -0.15 -1.27 2.01 -0.17 -0.78 115.64 114.40 3cvb s THR 28 Ca 0.59 -1.11 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 3cvb s THR 28 Cb -0.15 -1.76 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 3cvb s THR 28 CO 0.55 0.56 -0.10 -0.69 -0.69 0.00 0.00 174.62 174.25 3cvb s VAL 29 N -0.65 3.21 -0.20 3.82 1.01 -0.06 -0.55 120.40 126.99 3cvb s VAL 29 Ca 0.10 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.51 3cvb s VAL 29 Cb -0.10 -2.38 0.03 0.00 0.00 0.00 0.00 36.38 33.93 3cvb s VAL 29 CO -0.00 0.50 -0.15 -0.75 0.00 0.00 0.00 175.10 174.70 3cvb s LYS 30 N 0.61 2.50 0.00 2.72 2.20 0.21 -1.06 119.74 126.92 3cvb s LYS 30 Ca -0.06 -0.89 -0.21 0.00 -0.36 0.00 0.00 55.97 54.45 3cvb s LYS 30 Cb -0.15 -2.52 -0.05 0.00 -1.51 0.00 0.00 37.83 33.59 3cvb s LYS 30 CO 0.03 -0.34 0.61 -1.58 -0.36 0.00 0.00 175.35 173.71 3cvb s TRP 31 N 1.31 3.69 -0.05 4.03 0.51 0.76 -0.51 118.94 128.69 3cvb s TRP 31 Ca 0.01 1.23 0.01 0.00 -2.12 0.00 0.00 56.10 55.22 3cvb s TRP 31 Cb -0.15 -2.63 0.02 0.00 -0.81 0.00 0.00 33.47 29.91 3cvb s TRP 31 CO -0.10 0.35 -0.03 0.08 -0.51 0.00 0.00 176.95 176.74 3cvb s VAL 32 N -0.22 0.47 0.13 4.03 1.01 -0.15 -1.17 120.40 124.50 3cvb s VAL 32 Ca 0.32 -0.06 -0.33 0.00 0.00 0.00 0.00 61.98 61.91 3cvb s VAL 32 Cb -0.18 -0.52 -0.12 0.00 0.00 0.00 0.00 36.38 35.55 3cvb s VAL 32 CO 0.18 0.22 1.72 0.59 0.00 0.00 0.00 175.10 177.80 3cvb n ASN 33 N 4.24 3.58 0.01 3.32 3.02 0.06 -0.69 115.26 128.81 3cvb n ASN 33 Ca -0.22 1.04 -0.03 0.00 -0.03 0.00 0.00 54.58 55.34 3cvb n ASN 33 Cb 0.51 -1.48 -0.01 0.00 -0.61 0.00 0.00 39.78 38.18 3cvb n ASN 33 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3cvb n ASN 34 N 4.51 1.23 -3.92 6.41 5.15 -0.12 -2.08 115.26 126.46 3cvb n ASN 34 Ca 0.18 0.18 -0.12 0.00 -0.60 0.00 0.00 54.58 54.21 3cvb n ASN 34 Cb 0.32 -0.41 -0.13 0.00 -0.53 0.00 0.00 39.78 39.03 3cvb n ASN 34 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3cvb s LYS 35 N -2.21 0.16 -1.21 1.20 -0.14 -0.87 -4.87 119.74 111.79 3cvb s LYS 35 Ca -0.07 -0.18 -0.04 0.00 -1.36 0.00 0.00 55.97 54.32 3cvb s LYS 35 Cb 0.01 -0.06 -0.02 0.00 -1.68 0.00 0.00 37.83 36.08 3cvb s LYS 35 CO 0.11 0.01 0.83 1.28 -0.76 0.00 0.00 175.35 176.82 3cvb n LEU 36 N 2.70 -3.81 -4.67 3.17 4.77 -1.26 -4.26 117.00 113.65 3cvb n LEU 36 Ca -0.15 -0.77 -0.29 0.00 -0.03 0.00 0.00 56.01 54.76 3cvb n LEU 36 Cb 0.58 -2.85 0.17 0.00 -2.33 0.00 0.00 43.42 38.99 3cvb n LEU 36 CO 0.25 0.35 0.64 -2.16 -1.33 0.00 0.00 177.39 175.13 3cvb s PRO 37 N -5.51 0.70 0.50 3.23 0.04 -1.26 -4.73 135.00 127.96 3cvb s PRO 37 Ca 0.15 0.81 -0.15 0.00 0.04 0.00 0.00 61.00 61.85 3cvb s PRO 37 Cb -0.03 -1.75 -0.07 0.00 0.04 0.00 0.00 34.50 32.69 3cvb s PRO 37 CO 0.78 -2.62 0.94 -1.25 0.04 0.00 0.00 177.00 174.89 3cvb s PRO 38 N -4.85 3.88 0.21 0.56 0.04 -1.26 -5.02 135.00 128.57 3cvb s PRO 38 Ca 0.65 0.82 0.04 0.00 0.04 0.00 0.00 61.00 62.55 3cvb s PRO 38 Cb -0.20 -2.19 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 3cvb s PRO 38 CO 0.58 -0.24 -0.03 -1.01 0.04 0.00 0.00 177.00 176.34 3cvb s HIS 39 N -2.62 1.52 0.26 0.56 3.76 -1.10 -4.88 115.29 112.80 3cvb s HIS 39 Ca 0.57 -0.86 0.05 0.00 -0.15 0.00 0.00 55.06 54.66 3cvb s HIS 39 Cb -0.10 -0.86 -0.02 0.00 1.11 0.00 0.00 32.58 32.72 3cvb s HIS 39 CO 0.33 0.02 0.24 0.27 -0.85 0.00 0.00 174.74 174.76 3cvb n ASN 40 N -0.38 -0.63 -3.69 1.40 6.94 -1.26 -0.88 115.26 116.76 3cvb n ASN 40 Ca -0.06 -2.64 -0.29 0.00 -0.02 0.00 0.00 54.58 51.57 3cvb n ASN 40 Cb 0.63 1.39 -0.16 0.00 -2.36 0.00 0.00 39.78 39.29 3cvb n ASN 40 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3cvb s ILE 41 N -2.98 0.56 -0.21 1.53 1.01 -1.06 -4.03 121.20 116.02 3cvb s ILE 41 Ca 0.29 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 3cvb s ILE 41 Cb 0.01 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.17 3cvb s ILE 41 CO 0.21 -0.53 -0.07 -0.76 0.00 0.00 0.00 174.94 173.79 3cvb s LEU 42 N 1.80 2.78 0.23 2.97 1.43 0.34 -0.31 118.68 127.91 3cvb s LEU 42 Ca 0.06 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 3cvb s LEU 42 Cb -0.17 -1.69 -0.09 0.00 0.03 0.00 0.00 46.19 44.27 3cvb s LEU 42 CO -0.22 0.00 0.98 -0.36 0.23 0.00 0.00 176.35 176.98 3cvb s PHE 43 N 1.34 3.88 -0.38 0.29 0.40 -1.26 -0.69 117.98 121.56 3cvb s PHE 43 Ca 0.04 1.85 -0.28 0.00 -0.60 0.00 0.00 56.93 57.95 3cvb s PHE 43 Cb -0.14 -3.05 0.02 0.00 0.51 0.00 0.00 43.02 40.35 3cvb s PHE 43 CO -0.04 0.21 1.04 0.34 0.70 0.00 0.00 175.22 177.47 3cvb s ASP 44 N -0.92 6.76 0.63 1.36 -1.08 -0.24 -4.81 116.67 118.36 3cvb s ASP 44 Ca 0.43 0.71 0.39 0.00 -0.52 0.00 0.00 52.55 53.56 3cvb s ASP 44 Cb -0.27 -2.52 2.13 0.00 -1.46 0.00 0.00 42.92 40.80 3cvb s ASP 44 CO 0.33 -0.98 2.29 -2.24 0.52 0.00 0.00 175.17 175.09 3cvb h ASP 45 N 8.56 0.00 0.30 -0.34 2.03 -1.89 0.24 116.42 125.32 3cvb h ASP 45 Ca -0.22 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.08 3cvb h ASP 45 Cb 1.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.57 3cvb h ASP 45 CO 1.04 0.01 -0.13 0.29 -1.03 0.00 0.00 179.24 179.43 3cvb n LYS 46 N -3.28 0.80 -2.59 4.15 4.76 -1.26 -2.98 118.16 117.75 3cvb n LYS 46 Ca -0.03 -0.33 -0.09 0.00 -2.87 0.00 0.00 58.31 55.00 3cvb n LYS 46 Cb 0.11 -1.49 0.04 0.00 -1.84 0.00 0.00 35.03 31.84 3cvb n LYS 46 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3cvb n GLN 47 N -0.81 2.19 -4.36 1.97 1.13 0.07 -4.75 117.38 112.81 3cvb n GLN 47 Ca 0.15 -3.69 -0.18 0.00 -1.94 0.00 0.00 57.00 51.33 3cvb n GLN 47 Cb 0.29 -1.75 -0.10 0.00 0.11 0.00 0.00 30.24 28.79 3cvb n GLN 47 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 3cvb s VAL 48 N -4.00 1.35 0.32 5.09 -7.23 -1.17 -1.45 120.40 113.29 3cvb s VAL 48 Ca 0.34 -2.09 -0.28 0.00 -1.81 0.00 0.00 61.98 58.14 3cvb s VAL 48 Cb 0.37 -2.29 -0.13 0.00 0.56 0.00 0.00 36.38 34.89 3cvb s VAL 48 CO -0.02 -0.40 1.24 -2.65 -0.31 0.00 0.00 175.10 172.96 3cvb n PRO 49 N -0.45 1.93 -0.88 4.82 -0.02 -1.25 -0.53 135.00 138.62 3cvb n PRO 49 Ca -0.06 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 3cvb n PRO 49 Cb 0.63 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3cvb n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cvb n GLY 50 N 1.05 0.36 4.21 -1.23 0.00 -1.26 -3.37 105.19 104.95 3cvb n GLY 50 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3cvb n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cvb n ALA 51 N 1.00 -1.87 -2.61 4.61 0.00 0.31 -4.87 120.51 117.08 3cvb n ALA 51 Ca 0.00 -0.31 -0.40 0.00 0.00 0.00 0.00 53.44 52.72 3cvb n ALA 51 Cb 0.13 -1.42 -0.07 0.00 0.00 0.00 0.00 19.45 18.09 3cvb n ALA 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3cvb s SER 52 N -4.18 6.46 0.26 0.00 0.15 -1.16 -4.69 113.70 110.54 3cvb s SER 52 Ca 0.15 0.46 -0.00 0.00 0.70 0.00 0.00 55.95 57.26 3cvb s SER 52 Cb -0.08 -2.30 0.35 0.00 -1.71 0.00 0.00 66.02 62.27 3cvb s SER 52 CO 0.96 -0.37 1.71 0.50 1.20 0.00 0.00 173.24 177.24 3cvb h LYS 53 N 8.10 0.63 -0.48 5.44 3.64 -1.90 -1.26 116.57 130.73 3cvb h LYS 53 Ca -0.28 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 3cvb h LYS 53 Cb 1.13 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 3cvb h LYS 53 CO 0.75 0.77 0.28 1.49 -2.27 0.00 0.00 179.45 180.47 3cvb h GLU 54 N 0.57 0.67 -0.26 1.90 4.81 -1.97 0.13 114.58 120.43 3cvb h GLU 54 Ca 0.09 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 3cvb h GLU 54 Cb 0.62 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 3cvb h GLU 54 CO 0.04 0.51 0.03 1.25 -0.73 0.00 0.00 179.01 180.12 3cvb h LEU 55 N 0.64 0.42 -0.71 1.64 5.85 -1.89 -0.50 115.31 120.77 3cvb h LEU 55 Ca 0.17 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3cvb h LEU 55 Cb 0.03 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3cvb h LEU 55 CO -0.03 0.58 0.45 0.00 -0.34 0.00 0.00 178.44 179.10 3cvb h ALA 56 N 0.85 0.90 -0.62 1.25 0.00 -1.01 -1.48 119.26 119.15 3cvb h ALA 56 Ca 0.08 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3cvb h ALA 56 Cb 0.35 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3cvb h ALA 56 CO 0.01 0.35 0.13 -0.44 0.00 0.00 0.00 179.25 179.30 3cvb h ASP 57 N 0.96 0.92 -0.86 0.00 3.32 -0.63 -2.00 116.42 118.13 3cvb h ASP 57 Ca 0.26 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3cvb h ASP 57 Cb -0.07 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.20 3cvb h ASP 57 CO -0.05 0.90 0.51 0.50 -1.72 0.00 0.00 179.24 179.38 3cvb h LYS 58 N 0.93 1.17 0.00 3.56 3.64 -0.54 -3.09 116.57 122.24 3cvb h LYS 58 Ca 0.19 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3cvb h LYS 58 Cb 0.36 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3cvb h LYS 58 CO 0.00 0.83 -0.38 -0.07 -2.27 0.00 0.00 179.45 177.56 3cvb h LEU 59 N 1.18 0.00-10.08 5.20 3.38 -1.06 -3.47 115.31 110.46 3cvb h LEU 59 Ca 0.31 -0.06 -0.48 0.00 0.09 0.00 0.00 57.88 57.74 3cvb h LEU 59 Cb -0.03 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.76 3cvb h LEU 59 CO -0.06 0.03 0.40 -0.44 0.09 0.00 0.00 178.44 178.46 3cvb s SER 60 N -5.10 6.13 -0.76 -0.43 0.01 -0.77 -4.87 113.70 107.91 3cvb s SER 60 Ca 0.06 2.02 0.01 0.00 1.31 0.00 0.00 55.95 59.34 3cvb s SER 60 Cb 0.10 -2.57 0.19 0.00 0.21 0.00 0.00 66.02 63.95 3cvb s SER 60 CO 0.69 -0.93 0.59 -2.28 0.41 0.00 0.00 173.24 171.72 3cvb s HIS 61 N -1.90 3.66 0.22 2.43 2.46 0.57 -4.97 115.29 117.75 3cvb s HIS 61 Ca 0.69 -3.08 0.21 0.00 0.47 0.00 0.00 55.06 53.35 3cvb s HIS 61 Cb -0.19 -3.04 0.87 0.00 -0.13 0.00 0.00 32.58 30.09 3cvb s HIS 61 CO 0.22 -0.70 1.82 0.66 -2.47 0.00 0.00 174.74 174.28 3cvb h SER 62 N 6.04 0.00 -3.40 9.88 4.64 -1.95 -2.80 113.55 125.96 3cvb h SER 62 Ca 0.10 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.90 3cvb h SER 62 Cb 0.83 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.97 3cvb h SER 62 CO 0.77 0.30 0.73 -1.58 -0.87 0.00 0.00 176.83 176.18 3cvb s GLN 63 N -3.77 4.30 0.32 4.77 -0.44 -1.26 -4.87 119.66 118.71 3cvb s GLN 63 Ca -0.01 2.24 -0.29 0.00 -2.50 0.00 0.00 55.36 54.80 3cvb s GLN 63 Cb 0.11 -3.13 -0.11 0.00 -1.64 0.00 0.00 33.01 28.25 3cvb s GLN 63 CO 0.66 -0.37 1.43 -0.51 0.50 0.00 0.00 175.29 177.00 3cvb s LEU 64 N -0.37 4.37 -0.45 3.68 1.43 -1.26 -4.74 118.68 121.33 3cvb s LEU 64 Ca 0.58 2.84 -0.12 0.00 -1.03 0.00 0.00 54.13 56.39 3cvb s LEU 64 Cb -0.40 -3.65 0.08 0.00 0.03 0.00 0.00 46.19 42.25 3cvb s LEU 64 CO 0.42 -0.73 0.34 -0.04 0.23 0.00 0.00 176.35 176.57 3cvb s MET 65 N -1.39 2.79 0.06 1.70 -1.94 -0.06 -4.94 119.30 115.51 3cvb s MET 65 Ca 0.54 -1.45 0.17 0.00 -1.71 0.00 0.00 55.69 53.24 3cvb s MET 65 Cb -0.43 -3.98 -0.14 0.00 2.01 0.00 0.00 34.83 32.29 3cvb s MET 65 CO 0.53 -1.03 0.80 1.19 -0.01 0.00 0.00 175.02 176.51 3cvb n PHE 66 N 5.06 0.95 -3.05 -0.03 3.01 -1.26 -2.69 117.46 119.45 3cvb n PHE 66 Ca -0.11 0.32 -0.37 0.00 1.01 0.00 0.00 57.45 58.29 3cvb n PHE 66 Cb 0.43 -1.08 -0.06 0.00 -0.01 0.00 0.00 39.48 38.76 3cvb n PHE 66 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 3cvb s SER 67 N -5.74 7.18 0.27 4.37 0.01 -1.26 -4.72 113.70 113.80 3cvb s SER 67 Ca -0.03 1.51 -0.30 0.00 1.31 0.00 0.00 55.95 58.44 3cvb s SER 67 Cb 0.09 -2.45 -0.13 0.00 0.21 0.00 0.00 66.02 63.74 3cvb s SER 67 CO 0.81 0.09 1.43 -2.65 0.41 0.00 0.00 173.24 173.33 3cvb n PRO 68 N 1.00 2.21 -0.88 12.44 -0.02 -1.26 -1.39 135.00 147.10 3cvb n PRO 68 Ca -0.03 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3cvb n PRO 68 Cb 0.50 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3cvb n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cvb n GLY 69 N 1.87 0.32 3.73 -1.23 0.00 -0.88 -4.96 105.19 104.03 3cvb n GLY 69 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3cvb n GLY 69 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cvb n GLU 70 N -1.31 2.37 -4.27 1.61 2.13 -0.48 -4.47 120.64 116.21 3cvb n GLU 70 Ca 0.00 0.83 -0.17 0.00 0.66 0.00 0.00 57.16 58.48 3cvb n GLU 70 Cb 0.16 -2.48 -0.11 0.00 0.27 0.00 0.00 31.44 29.28 3cvb n GLU 70 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3cvb s SER 71 N -0.22 2.11 -0.03 4.31 1.04 -1.26 -0.76 113.70 118.90 3cvb s SER 71 Ca 0.55 -0.92 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 3cvb s SER 71 Cb -0.53 -0.07 0.01 0.00 0.10 0.00 0.00 66.02 65.53 3cvb s SER 71 CO 0.63 -0.20 0.07 -0.47 0.98 0.00 0.00 173.24 174.25 3cvb s TYR 72 N -2.69 -0.07 0.05 5.02 5.04 -0.32 -4.99 117.35 119.39 3cvb s TYR 72 Ca 0.15 0.19 0.01 0.00 -2.44 0.00 0.00 57.07 54.97 3cvb s TYR 72 Cb -0.02 0.02 -0.03 0.00 0.35 0.00 0.00 41.96 42.28 3cvb s TYR 72 CO 0.03 -0.04 -0.05 -1.83 -1.34 0.00 0.00 175.55 172.32 3cvb s GLU 73 N 0.07 0.55 -0.07 4.97 -1.05 -1.26 -0.17 118.70 121.74 3cvb s GLU 73 Ca -0.00 -0.94 0.03 0.00 -0.15 0.00 0.00 54.97 53.91 3cvb s GLU 73 Cb -0.01 -0.05 0.01 0.00 -0.44 0.00 0.00 34.13 33.64 3cvb s GLU 73 CO -0.00 -0.03 -0.16 0.42 0.95 0.00 0.00 175.26 176.44 3cvb s ILE 74 N -2.43 1.39 -0.27 1.83 1.01 -0.22 -4.99 121.20 117.52 3cvb s ILE 74 Ca -0.03 -0.65 -0.10 0.00 0.00 0.00 0.00 60.65 59.87 3cvb s ILE 74 Cb -0.03 -1.23 -0.05 0.00 0.01 0.00 0.00 42.46 41.16 3cvb s ILE 74 CO -0.03 0.41 0.16 -0.89 0.00 0.00 0.00 174.94 174.59 3cvb s THR 75 N 0.44 5.10 -1.24 2.92 2.01 -1.26 -0.88 115.64 122.73 3cvb s THR 75 Ca -0.13 0.10 -0.15 0.00 0.31 0.00 0.00 61.69 61.81 3cvb s THR 75 Cb -0.15 -3.41 0.13 0.00 0.01 0.00 0.00 72.50 69.08 3cvb s THR 75 CO 0.04 0.28 1.54 -0.36 -0.69 0.00 0.00 174.62 175.44 3cvb s PHE 76 N 1.63 3.22 0.24 4.92 0.08 0.04 -4.95 117.98 123.15 3cvb s PHE 76 Ca 0.07 -1.93 0.04 0.00 0.12 0.00 0.00 56.93 55.23 3cvb s PHE 76 Cb -0.15 -4.48 0.04 0.00 -0.57 0.00 0.00 43.02 37.85 3cvb s PHE 76 CO 0.09 -1.55 0.33 -1.13 -0.10 0.00 0.00 175.22 172.85 3cvb n SER 77 N 6.70 0.85 0.16 1.36 3.41 -1.26 -0.03 113.62 124.81 3cvb n SER 77 Ca 0.41 -1.62 0.12 0.00 -0.26 0.00 0.00 58.87 57.52 3cvb n SER 77 Cb 0.44 -0.17 0.57 0.00 -0.26 0.00 0.00 64.21 64.79 3cvb n SER 77 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3cvb h SER 78 N 0.04 0.00 0.00 4.04 4.64 -2.00 -0.98 113.55 119.29 3cvb h SER 78 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 3cvb h SER 78 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3cvb h SER 78 CO 0.16 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.22 3cvb n ASP 79 N -2.31 0.00 -4.27 4.97 5.68 -1.26 -4.58 116.55 114.78 3cvb n ASP 79 Ca 0.00 -1.31 -0.37 0.00 -0.50 0.00 0.00 54.79 52.61 3cvb n ASP 79 Cb 0.14 0.00 -0.13 0.00 -1.14 0.00 0.00 41.12 39.99 3cvb n ASP 79 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 3cvb s PHE 80 N -2.00 3.25 0.72 2.11 0.08 -0.37 -5.12 117.98 116.65 3cvb s PHE 80 Ca 0.24 -1.45 -0.15 0.00 0.12 0.00 0.00 56.93 55.69 3cvb s PHE 80 Cb 0.11 -2.25 0.04 0.00 -0.57 0.00 0.00 43.02 40.34 3cvb s PHE 80 CO 0.19 -0.73 1.21 -1.25 -0.10 0.00 0.00 175.22 174.53 3cvb s PRO 81 N 1.39 2.18 0.56 0.24 0.04 -1.26 -4.85 135.00 133.29 3cvb s PRO 81 Ca -0.02 1.76 -0.21 0.00 0.04 0.00 0.00 61.00 62.57 3cvb s PRO 81 Cb -0.19 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 3cvb s PRO 81 CO 0.02 -1.81 1.30 0.00 0.04 0.00 0.00 177.00 176.56 3cvb s ALA 82 N -1.97 2.72 0.00 8.56 0.00 -1.26 -4.88 121.76 124.94 3cvb s ALA 82 Ca 0.74 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.92 3cvb s ALA 82 Cb -0.29 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.30 3cvb s ALA 82 CO 0.45 -1.28 0.00 0.41 0.00 0.00 0.00 175.76 175.33 3cvb n GLY 83 N 0.68 0.94 3.90 0.00 0.00 -0.44 -4.83 105.19 105.45 3cvb n GLY 83 Ca 0.11 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 3cvb n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cvb s THR 84 N -1.53 5.35 -0.22 2.61 -4.23 -1.26 -0.42 115.64 115.95 3cvb s THR 84 Ca 0.00 -0.28 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 3cvb s THR 84 Cb 0.00 -3.54 0.06 0.00 1.34 0.00 0.00 72.50 70.36 3cvb s THR 84 CO 0.00 0.25 -0.02 -0.31 -0.54 0.00 0.00 174.62 174.00 3cvb s TYR 85 N -1.39 1.88 -0.07 3.99 1.51 0.61 -3.94 117.35 119.93 3cvb s TYR 85 Ca 0.30 -1.41 -0.12 0.00 -1.01 0.00 0.00 57.07 54.82 3cvb s TYR 85 Cb -0.13 -1.37 -0.05 0.00 -0.11 0.00 0.00 41.96 40.30 3cvb s TYR 85 CO 0.22 -0.71 0.31 0.99 -1.11 0.00 0.00 175.55 175.25 3cvb s THR 86 N 1.57 5.22 0.19 -0.71 2.01 -0.53 -0.73 115.64 122.66 3cvb s THR 86 Ca -0.04 0.60 -0.01 0.00 0.31 0.00 0.00 61.69 62.56 3cvb s THR 86 Cb -0.18 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 3cvb s THR 86 CO -0.07 0.55 0.11 -0.72 -0.69 0.00 0.00 174.62 173.80 3cvb s TYR 87 N -0.74 1.13 0.20 4.92 1.13 -0.34 -1.07 117.35 122.57 3cvb s TYR 87 Ca 0.20 -1.32 -0.14 0.00 -1.41 0.00 0.00 57.07 54.39 3cvb s TYR 87 Cb -0.15 -0.58 0.01 0.00 -1.10 0.00 0.00 41.96 40.15 3cvb s TYR 87 CO 0.09 -0.58 0.46 1.52 -2.51 0.00 0.00 175.55 174.53 3cvb s TYR 88 N -4.09 0.10 -0.24 -3.49 1.13 0.13 -1.14 117.35 109.76 3cvb s TYR 88 Ca 0.35 -0.46 -0.12 0.00 -1.41 0.00 0.00 57.07 55.43 3cvb s TYR 88 Cb 0.07 0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 41.13 3cvb s TYR 88 CO 0.10 -0.89 0.23 0.00 -2.51 0.00 0.00 175.55 172.48 3cvb h ALA 90 N 7.70 0.41 -0.99 0.00 0.00 -1.90 0.14 119.26 124.62 3cvb h ALA 90 Ca -0.36 -0.16 0.22 0.00 0.00 0.00 0.00 54.91 54.60 3cvb h ALA 90 Cb 1.17 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.75 3cvb h ALA 90 CO 0.65 0.05 0.62 -1.35 0.00 0.00 0.00 179.25 179.23 3cvb h PRO 91 N 0.34 0.55 -0.09 0.00 0.11 -1.93 -3.01 132.00 127.97 3cvb h PRO 91 Ca 0.10 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3cvb h PRO 91 Cb 0.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3cvb h PRO 91 CO -0.00 0.36 0.00 0.72 -0.21 0.00 0.00 178.00 178.87 3cvb n HIS 92 N -4.68 0.29 -0.25 0.65 8.25 -1.00 -4.71 115.22 113.77 3cvb n HIS 92 Ca 0.23 -0.91 -0.02 0.00 -0.26 0.00 0.00 57.72 56.76 3cvb n HIS 92 Cb 0.70 -0.19 0.09 0.00 1.12 0.00 0.00 29.99 31.72 3cvb n HIS 92 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 3cvb h ARG 93 N 0.60 0.81 0.00 -0.41 2.43 -0.59 -1.42 114.38 115.80 3cvb h ARG 93 Ca 0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3cvb h ARG 93 Cb 1.08 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.45 3cvb h ARG 93 CO 0.07 0.54 -0.04 0.78 -1.51 0.00 0.00 179.97 179.80 3cvb h GLY 94 N 0.84 0.00 -1.00 2.80 0.00 -1.84 -0.65 103.07 103.22 3cvb h GLY 94 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3cvb h GLY 94 CO -0.13 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.41 3cvb n ALA 95 N -2.36 2.53 -0.71 3.60 0.00 -0.59 -4.94 120.51 118.05 3cvb n ALA 95 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3cvb n ALA 95 Cb 0.13 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3cvb n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cvb n GLY 96 N 1.24 0.89 3.56 0.00 0.00 -0.25 -4.98 105.19 105.64 3cvb n GLY 96 Ca 0.17 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 3cvb n GLY 96 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3cvb s MET 97 N -1.62 3.59 0.08 1.61 -2.45 -0.89 -4.90 119.30 114.73 3cvb s MET 97 Ca 0.00 -1.15 0.02 0.00 -1.25 0.00 0.00 55.69 53.31 3cvb s MET 97 Cb 0.00 -5.34 -0.04 0.00 1.25 0.00 0.00 34.83 30.70 3cvb s MET 97 CO 0.00 -2.19 -0.07 0.08 1.05 0.00 0.00 175.02 173.89 3cvb s VAL 98 N 4.89 0.63 0.29 10.11 1.01 -1.26 -1.35 120.40 134.72 3cvb s VAL 98 Ca 0.45 -1.75 -0.09 0.00 0.00 0.00 0.00 61.98 60.59 3cvb s VAL 98 Cb -0.00 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.93 3cvb s VAL 98 CO -0.10 -0.78 0.50 -0.83 0.00 0.00 0.00 175.10 173.89 3cvb s GLY 99 N -2.74 0.87 -0.13 4.51 0.00 -0.29 -4.50 107.32 105.04 3cvb s GLY 99 Ca 0.07 -1.11 -0.06 0.00 0.00 0.00 0.00 44.72 43.62 3cvb s GLY 99 CO -0.04 -0.74 0.30 1.25 0.00 0.00 0.00 173.10 173.87 3cvb s LYS 100 N -3.53 0.26 -0.19 2.90 2.47 0.30 -1.20 119.74 120.75 3cvb s LYS 100 Ca 0.25 0.65 -0.07 0.00 -1.56 0.00 0.00 55.97 55.24 3cvb s LYS 100 Cb -0.01 -0.07 -0.04 0.00 -1.46 0.00 0.00 37.83 36.26 3cvb s LYS 100 CO 0.13 -0.18 0.05 0.42 0.16 0.00 0.00 175.35 175.93 3cvb s ILE 101 N 1.47 4.55 -0.31 5.43 -1.09 0.09 -1.90 121.20 129.45 3cvb s ILE 101 Ca -0.08 -0.11 -0.10 0.00 -2.23 0.00 0.00 60.65 58.13 3cvb s ILE 101 Cb -0.10 -3.06 -0.01 0.00 -1.58 0.00 0.00 42.46 37.71 3cvb s ILE 101 CO -0.10 0.44 0.17 -0.89 -1.23 0.00 0.00 174.94 173.33 3cvb s THR 102 N 0.62 4.74 -0.37 2.92 2.01 0.10 -0.29 115.64 125.37 3cvb s THR 102 Ca 0.02 -0.35 -0.16 0.00 0.31 0.00 0.00 61.69 61.51 3cvb s THR 102 Cb -0.13 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.97 3cvb s THR 102 CO 0.02 0.07 0.41 -0.69 -0.69 0.00 0.00 174.62 173.73 3cvb s VAL 103 N 1.64 5.12 0.57 3.82 1.01 0.44 -0.51 120.40 132.49 3cvb s VAL 103 Ca 0.05 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.83 3cvb s VAL 103 Cb -0.17 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 3cvb s VAL 103 CO 0.07 -0.22 1.02 -1.61 0.00 0.00 0.00 175.10 174.35 3cvb s GLU 104 N 2.11 3.64 0.00 2.72 0.41 -0.29 -1.32 118.70 125.97 3cvb s GLU 104 Ca 0.13 0.99 0.00 0.00 -0.41 0.00 0.00 54.97 55.67 3cvb s GLU 104 Cb -0.17 -2.09 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 3cvb s GLU 104 CO 0.13 -0.53 0.00 0.41 -0.49 0.00 0.00 175.26 174.78