#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b3c s ASP 2 N 0.00 0.46 0.18 4.39 1.11 -1.26 -1.52 116.67 120.03 1b3c s ASP 2 Ca 0.00 0.06 -0.19 0.00 0.18 0.00 0.00 52.55 52.60 1b3c s ASP 2 Cb 0.00 -0.09 0.07 0.00 1.07 0.00 0.00 42.92 43.97 1b3c s ASP 2 CO 0.00 -0.18 0.93 0.61 1.18 0.00 0.00 175.17 177.71 1b3c n GLY 3 N 4.61 0.69 3.96 0.21 0.00 -1.04 -5.03 105.19 108.58 1b3c n GLY 3 Ca -0.19 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.48 1b3c n GLY 3 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b3c s TYR 4 N -2.47 3.36 0.00 1.61 1.51 -1.24 -0.81 117.35 119.31 1b3c s TYR 4 Ca 0.20 0.16 0.06 0.00 -1.01 0.00 0.00 57.07 56.48 1b3c s TYR 4 Cb -0.03 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 1b3c s TYR 4 CO 0.05 0.05 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.86 1b3c s LEU 5 N -4.28 2.61 0.00 -1.29 1.43 -1.00 0.47 118.68 116.62 1b3c s LEU 5 Ca 0.41 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1b3c s LEU 5 Cb -0.10 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1b3c s LEU 5 CO 0.34 0.29 0.00 1.33 0.23 0.00 0.00 176.35 178.54 1b3c n VAL 6 N 1.88 0.00 -4.44 -1.59 0.24 -1.26 -4.55 118.33 108.61 1b3c n VAL 6 Ca -0.16 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 61.92 1b3c n VAL 6 Cb 0.52 -1.62 -0.10 0.00 -1.47 0.00 0.00 33.84 31.17 1b3c n VAL 6 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1b3c s GLU 7 N -1.57 1.66 0.40 7.34 2.12 -1.19 -4.85 118.70 122.61 1b3c s GLU 7 Ca 0.00 -1.94 0.19 0.00 0.36 0.00 0.00 54.97 53.58 1b3c s GLU 7 Cb 0.00 -0.68 1.13 0.00 0.26 0.00 0.00 34.13 34.84 1b3c s GLU 7 CO 0.00 -0.28 1.75 1.57 -0.54 0.00 0.00 175.26 177.76 1b3c h LYS 8 N 2.10 0.35 0.00 4.30 2.10 -1.99 1.52 116.57 124.95 1b3c h LYS 8 Ca -0.39 -0.02 -0.03 0.00 -2.00 0.00 0.00 60.65 58.21 1b3c h LYS 8 Cb 1.25 -0.08 -0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1b3c h LYS 8 CO 0.65 0.23 -0.13 1.79 -2.00 0.00 0.00 179.45 179.99 1b3c h THR 9 N 0.36 0.26 0.00 0.07 1.35 -1.99 -3.46 112.91 109.50 1b3c h THR 9 Ca 0.63 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1b3c h THR 9 Cb 1.62 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 69.91 1b3c h THR 9 CO -0.33 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.67 1b3c n GLY 10 N 0.59 0.31 3.76 5.82 0.00 0.52 -4.96 105.19 111.23 1b3c n GLY 10 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1b3c n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3c n LYS 12 N 3.05 -0.48 -3.42 0.00 -0.00 -1.26 -3.15 118.16 112.90 1b3c n LYS 12 Ca -0.17 -0.03 -0.27 0.00 -0.00 0.00 0.00 58.31 57.83 1b3c n LYS 12 Cb 0.53 -0.06 -0.11 0.00 -0.00 0.00 0.00 35.03 35.39 1b3c n LYS 12 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1b3c s LYS 13 N -1.88 0.71 0.82 -1.58 2.47 -1.26 -4.77 119.74 114.24 1b3c s LYS 13 Ca 0.02 -1.67 -0.10 0.00 -1.56 0.00 0.00 55.97 52.65 1b3c s LYS 13 Cb -0.00 -1.32 0.08 0.00 -1.46 0.00 0.00 37.83 35.14 1b3c s LYS 13 CO 0.01 -1.29 1.10 0.99 0.16 0.00 0.00 175.35 176.32 1b3c s THR 14 N 0.62 2.97 0.02 3.43 2.01 -1.26 -4.00 115.64 119.43 1b3c s THR 14 Ca 0.25 0.32 0.01 0.00 0.31 0.00 0.00 61.69 62.58 1b3c s THR 14 Cb -0.10 -2.68 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 1b3c s THR 14 CO -0.09 -0.41 -0.05 0.00 -0.69 0.00 0.00 174.62 173.38 1b3c n TYR 16 N 2.10 0.05 -3.56 0.00 4.01 -1.26 -4.51 117.16 113.99 1b3c n TYR 16 Ca -0.19 -0.03 -0.29 0.00 -0.16 0.00 0.00 57.90 57.23 1b3c n TYR 16 Cb 0.56 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.45 1b3c n TYR 16 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1b3c s LYS 17 N -1.95 0.30 1.22 -0.72 1.02 -1.26 -5.14 119.74 113.22 1b3c s LYS 17 Ca 0.11 -0.68 -0.19 0.00 0.02 0.00 0.00 55.97 55.22 1b3c s LYS 17 Cb 0.05 -1.29 0.29 0.00 -0.52 0.00 0.00 37.83 36.36 1b3c s LYS 17 CO 0.08 -1.03 1.09 -0.51 -0.92 0.00 0.00 175.35 174.06 1b3c s LEU 18 N 1.93 0.54 0.00 3.17 1.43 -1.26 -4.66 118.68 119.84 1b3c s LEU 18 Ca 0.10 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 53.85 1b3c s LEU 18 Cb -0.17 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.69 1b3c s LEU 18 CO -0.32 -4.24 0.00 0.61 0.23 0.00 0.00 176.35 172.63 1b3c n GLY 19 N -0.74 -1.77 3.46 -3.19 0.00 -1.21 -4.67 105.19 97.07 1b3c n GLY 19 Ca 0.13 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1b3c n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b3c n GLU 20 N 0.00 0.23 -2.68 1.61 -0.58 -1.26 -3.80 120.64 114.16 1b3c n GLU 20 Ca 0.00 -0.70 -0.05 0.00 -0.42 0.00 0.00 57.16 55.99 1b3c n GLU 20 Cb 0.00 -2.67 0.05 0.00 -0.57 0.00 0.00 31.44 28.25 1b3c n GLU 20 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1b3c n ASN 21 N 13.57 -1.50 -4.10 1.62 5.15 -1.26 -5.02 115.26 123.72 1b3c n ASN 21 Ca 0.44 -2.09 -0.36 0.00 -0.60 0.00 0.00 54.58 51.97 1b3c n ASN 21 Cb 0.38 1.08 -0.08 0.00 -0.53 0.00 0.00 39.78 40.63 1b3c n ASN 21 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1b3c s ASP 22 N -0.62 5.57 0.61 1.20 2.15 -1.26 -4.27 116.67 120.04 1b3c s ASP 22 Ca 0.13 -3.27 0.27 0.00 0.43 0.00 0.00 52.55 50.11 1b3c s ASP 22 Cb 0.22 -1.88 1.25 0.00 -0.30 0.00 0.00 42.92 42.21 1b3c s ASP 22 CO -0.06 -0.28 1.66 0.15 -0.17 0.00 0.00 175.17 176.47 1b3c h PHE 23 N 6.54 0.00 -0.16 -5.34 3.57 -1.96 1.12 116.94 120.70 1b3c h PHE 23 Ca 0.07 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 1b3c h PHE 23 Cb 0.89 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 1b3c h PHE 23 CO 0.73 0.00 -0.15 0.00 -2.23 0.00 0.00 178.31 176.66 1b3c h ASN 25 N 0.03 1.00 -0.36 0.00 7.08 0.10 0.66 115.58 124.09 1b3c h ASN 25 Ca 0.03 -0.08 0.08 0.00 -3.08 0.00 0.00 56.30 53.24 1b3c h ASN 25 Cb 0.67 -0.25 -0.07 0.00 -2.08 0.00 0.00 38.32 36.59 1b3c h ASN 25 CO 0.04 0.79 -0.13 -0.09 -2.08 0.00 0.00 177.43 175.96 1b3c h ARG 26 N 1.12 -0.05 -0.11 4.14 1.12 -1.19 -1.26 114.38 118.15 1b3c h ARG 26 Ca 0.29 0.00 -0.18 0.00 -1.11 0.00 0.00 59.98 58.98 1b3c h ARG 26 Cb -0.01 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1b3c h ARG 26 CO -0.05 -0.03 -0.69 0.93 -3.11 0.00 0.00 179.97 177.01 1b3c h GLU 27 N -0.05 0.49 -0.54 0.20 5.08 -0.93 -2.89 114.58 115.93 1b3c h GLU 27 Ca 0.18 -0.37 0.06 0.00 -1.00 0.00 0.00 59.36 58.22 1b3c h GLU 27 Cb 0.32 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.56 1b3c h GLU 27 CO -0.40 1.00 -0.51 0.00 -1.00 0.00 0.00 179.01 178.10 1b3c h LYS 29 N -0.24 0.43 -0.20 0.00 3.64 -1.39 -2.93 116.57 115.89 1b3c h LYS 29 Ca 0.09 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1b3c h LYS 29 Cb 0.48 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1b3c h LYS 29 CO -0.64 0.35 0.02 2.35 -2.27 0.00 0.00 179.45 179.26 1b3c h TRP 30 N 0.40 0.03 -4.37 1.91 2.91 -0.84 -3.43 115.95 112.56 1b3c h TRP 30 Ca 0.11 0.01 -0.47 0.00 1.13 0.00 0.00 58.89 59.67 1b3c h TRP 30 Cb 0.03 0.02 0.09 0.00 -0.51 0.00 0.00 29.16 28.79 1b3c h TRP 30 CO -0.04 -0.00 0.36 0.21 -1.03 0.00 0.00 178.44 177.94 1b3c s LYS 31 N -6.19 2.19 -1.32 2.65 2.36 0.57 -4.95 119.74 115.05 1b3c s LYS 31 Ca -0.13 0.08 -0.06 0.00 -2.55 0.00 0.00 55.97 53.30 1b3c s LYS 31 Cb 0.10 -2.02 0.13 0.00 -1.05 0.00 0.00 37.83 34.98 1b3c s LYS 31 CO 0.69 -1.40 2.30 0.72 1.55 0.00 0.00 175.35 179.21 1b3c n HIS 32 N -3.15 2.64 0.38 4.03 8.25 -1.26 -4.41 115.22 121.69 1b3c n HIS 32 Ca 0.08 -2.82 0.09 0.00 -0.26 0.00 0.00 57.72 54.81 1b3c n HIS 32 Cb 0.60 -1.85 -0.13 0.00 1.12 0.00 0.00 29.99 29.73 1b3c n HIS 32 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1b3c n ILE 33 N 1.99 0.00 -0.46 1.59 2.08 -1.26 -4.97 119.36 118.33 1b3c n ILE 33 Ca 0.59 -0.27 0.00 0.00 0.56 0.00 0.00 62.75 63.63 1b3c n ILE 33 Cb 0.27 0.49 0.00 0.00 -0.75 0.00 0.00 39.64 39.64 1b3c n ILE 33 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1b3c n GLY 34 N 1.44 0.76 3.56 7.39 0.00 -1.25 -3.86 105.19 113.22 1b3c n GLY 34 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1b3c n GLY 34 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b3c s GLY 35 N -1.86 0.79 0.40 -0.02 0.00 -1.22 -3.99 107.32 101.42 1b3c s GLY 35 Ca 0.00 -1.99 0.28 0.00 0.00 0.00 0.00 44.72 43.01 1b3c s GLY 35 CO 0.00 3.06 1.83 1.48 0.00 0.00 0.00 173.10 179.47 1b3c h SER 36 N 10.25 0.00 -1.49 1.64 4.64 -1.85 -3.14 113.55 123.60 1b3c h SER 36 Ca 0.18 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.64 1b3c h SER 36 Cb 1.00 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.85 1b3c h SER 36 CO 1.33 0.00 0.18 -0.47 -0.87 0.00 0.00 176.83 177.00 1b3c s TYR 37 N -3.44 -0.79 0.06 4.77 6.14 -1.26 -4.97 117.35 117.86 1b3c s TYR 37 Ca 0.04 1.41 -0.08 0.00 0.64 0.00 0.00 57.07 59.08 1b3c s TYR 37 Cb 0.09 0.48 -0.01 0.00 0.42 0.00 0.00 41.96 42.94 1b3c s TYR 37 CO 0.50 -0.39 0.15 0.20 0.64 0.00 0.00 175.55 176.65 1b3c s GLY 38 N 2.33 0.13 0.19 8.97 0.00 -1.26 -0.90 107.32 116.77 1b3c s GLY 38 Ca -0.04 -0.57 -0.13 0.00 0.00 0.00 0.00 44.72 43.97 1b3c s GLY 38 CO -0.17 -0.74 0.40 -2.52 0.00 0.00 0.00 173.10 170.07 1b3c s TYR 39 N -3.32 0.20 -0.37 1.90 1.13 0.27 -4.51 117.35 112.65 1b3c s TYR 39 Ca 0.01 -0.55 -0.29 0.00 -1.41 0.00 0.00 57.07 54.83 1b3c s TYR 39 Cb 0.03 0.15 -0.00 0.00 -1.10 0.00 0.00 41.96 41.04 1b3c s TYR 39 CO -0.08 -0.84 1.51 0.00 -2.51 0.00 0.00 175.55 173.64 1b3c s TYR 41 N 5.69 1.98 -1.69 0.00 5.04 -0.62 -3.34 117.35 124.42 1b3c s TYR 41 Ca 0.66 -0.40 -0.18 0.00 -2.44 0.00 0.00 57.07 54.71 1b3c s TYR 41 Cb -0.17 -1.08 0.15 0.00 0.35 0.00 0.00 41.96 41.21 1b3c s TYR 41 CO 0.32 0.25 0.77 0.41 -1.34 0.00 0.00 175.55 175.96 1b3c n GLY 42 N 1.04 -0.44 3.54 8.97 0.00 -1.26 -0.94 105.19 116.11 1b3c n GLY 42 Ca -0.19 0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1b3c n GLY 42 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b3c n PHE 43 N -4.39 -2.10 -3.77 1.61 3.72 -1.26 -4.96 117.46 106.30 1b3c n PHE 43 Ca 0.06 0.70 -0.01 0.00 -0.05 0.00 0.00 57.45 58.15 1b3c n PHE 43 Cb 0.50 -3.98 0.01 0.00 -0.94 0.00 0.00 39.48 35.08 1b3c n PHE 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b3c n GLY 44 N -1.49 0.75 3.65 1.37 0.00 -0.11 -4.20 105.19 105.16 1b3c n GLY 44 Ca -0.15 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 1b3c n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3c s TYR 46 N 0.76 1.48 -0.05 0.00 5.04 -0.92 -2.39 117.35 121.28 1b3c s TYR 46 Ca 0.06 -0.70 0.05 0.00 -2.44 0.00 0.00 57.07 54.04 1b3c s TYR 46 Cb -0.13 -1.20 -0.02 0.00 0.35 0.00 0.00 41.96 40.97 1b3c s TYR 46 CO 0.02 -0.46 -0.21 0.00 -1.34 0.00 0.00 175.55 173.56 1b3c n GLU 48 N 2.68 3.15 0.00 0.00 2.13 -0.08 -2.50 120.64 126.02 1b3c n GLU 48 Ca -0.17 -4.48 0.00 0.00 0.66 0.00 0.00 57.16 53.17 1b3c n GLU 48 Cb 0.52 -2.48 0.00 0.00 0.27 0.00 0.00 31.44 29.75 1b3c n GLU 48 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b3c n GLY 49 N 2.37 0.00 3.64 8.31 0.00 -0.58 -4.00 105.19 114.93 1b3c n GLY 49 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1b3c n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b3c s LEU 50 N 0.00 4.03 1.16 0.99 2.01 -1.26 -3.44 118.68 122.18 1b3c s LEU 50 Ca 0.00 1.06 -0.17 0.00 0.01 0.00 0.00 54.13 55.02 1b3c s LEU 50 Cb 0.00 -3.40 0.20 0.00 0.01 0.00 0.00 46.19 43.00 1b3c s LEU 50 CO 0.00 -0.73 0.37 -2.65 1.01 0.00 0.00 176.35 174.36 1b3c n PRO 51 N 6.48 -2.53 -0.04 1.29 -0.02 -1.25 -4.78 135.00 134.15 1b3c n PRO 51 Ca 0.10 -0.73 -0.03 0.00 -2.02 0.00 0.00 63.50 60.81 1b3c n PRO 51 Cb 0.47 -1.73 0.20 0.00 -0.02 0.00 0.00 33.50 32.42 1b3c n PRO 51 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1b3c h ASP 52 N -2.63 0.61 -0.21 2.55 3.58 -1.98 -2.36 116.42 115.98 1b3c h ASP 52 Ca -0.44 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 56.85 1b3c h ASP 52 Cb 1.18 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.07 1b3c h ASP 52 CO 0.31 0.74 0.00 -1.54 -2.88 0.00 0.00 179.24 175.87 1b3c n SER 53 N -4.19 1.97 -4.79 2.28 3.41 -1.26 -4.84 113.62 106.20 1b3c n SER 53 Ca 0.01 -2.16 -0.36 0.00 -0.26 0.00 0.00 58.87 56.09 1b3c n SER 53 Cb 0.33 -0.38 -0.07 0.00 -0.26 0.00 0.00 64.21 63.83 1b3c n SER 53 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1b3c s THR 54 N -1.62 5.39 0.14 6.66 2.01 -0.89 -5.07 115.64 122.25 1b3c s THR 54 Ca 0.17 0.33 -0.25 0.00 0.31 0.00 0.00 61.69 62.25 1b3c s THR 54 Cb 0.11 -3.50 -0.07 0.00 0.01 0.00 0.00 72.50 69.05 1b3c s THR 54 CO 0.08 0.50 0.76 -1.58 -0.69 0.00 0.00 174.62 173.69 1b3c s GLN 55 N -0.22 4.53 -0.04 4.92 2.00 -1.26 -4.85 119.66 124.74 1b3c s GLN 55 Ca 0.14 1.12 0.05 0.00 -2.00 0.00 0.00 55.36 54.66 1b3c s GLN 55 Cb -0.12 -3.28 -0.00 0.00 0.80 0.00 0.00 33.01 30.40 1b3c s GLN 55 CO 0.03 0.53 -0.18 0.95 -0.50 0.00 0.00 175.29 176.11 1b3c s THR 56 N -0.95 1.50 0.47 -0.34 -4.23 -1.26 -4.75 115.64 106.07 1b3c s THR 56 Ca 0.36 -0.76 -0.24 0.00 -1.18 0.00 0.00 61.69 59.87 1b3c s THR 56 Cb -0.22 -1.28 -0.08 0.00 1.34 0.00 0.00 72.50 72.26 1b3c s THR 56 CO 0.25 0.43 1.26 1.87 -0.54 0.00 0.00 174.62 177.89 1b3c n TRP 57 N 3.08 2.04 -1.60 3.99 -0.00 0.18 -4.12 117.44 121.00 1b3c n TRP 57 Ca -0.18 0.47 -0.29 0.00 -0.00 0.00 0.00 57.50 57.50 1b3c n TRP 57 Cb 0.53 -2.35 0.17 0.00 -0.00 0.00 0.00 31.31 29.66 1b3c n TRP 57 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 1b3c s PRO 58 N -2.43 0.59 0.67 5.87 0.04 -1.26 -3.65 135.00 134.83 1b3c s PRO 58 Ca 0.65 -0.02 -0.06 0.00 0.04 0.00 0.00 61.00 61.62 1b3c s PRO 58 Cb -0.47 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.31 1b3c s PRO 58 CO 0.55 -2.51 0.97 -0.51 0.04 0.00 0.00 177.00 175.54 1b3c s LEU 59 N -6.13 2.94 0.00 -3.56 1.43 -1.26 -5.07 118.68 107.04 1b3c s LEU 59 Ca 0.68 0.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 1b3c s LEU 59 Cb -0.10 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 42.93 1b3c s LEU 59 CO 0.53 -1.45 0.00 -2.65 0.23 0.00 0.00 176.35 173.02 1b3c n PRO 60 N -2.81 1.29 -0.36 1.29 -0.02 -1.26 -4.57 135.00 128.56 1b3c n PRO 60 Ca 0.07 0.00 0.28 0.00 -2.02 0.00 0.00 63.50 61.84 1b3c n PRO 60 Cb 0.60 0.00 0.54 0.00 -0.02 0.00 0.00 33.50 34.62 1b3c n PRO 60 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1b3c h ASN 61 N -0.44 0.41 -2.45 2.55 -1.24 -2.05 -3.24 115.58 109.12 1b3c h ASN 61 Ca 0.00 0.18 -0.57 0.00 0.71 0.00 0.00 56.30 56.62 1b3c h ASN 61 Cb 0.00 0.14 -0.10 0.00 0.73 0.00 0.00 38.32 39.09 1b3c h ASN 61 CO 0.00 -0.18 0.91 -1.59 -1.29 0.00 0.00 177.43 175.28 1b3c s LYS 62 N -5.53 3.17 0.00 6.67 -2.85 -1.26 -4.99 119.74 114.95 1b3c s LYS 62 Ca -0.09 -0.41 0.00 0.00 -1.00 0.00 0.00 55.97 54.47 1b3c s LYS 62 Cb 0.30 -4.19 0.00 0.00 -2.06 0.00 0.00 37.83 31.88 1b3c s LYS 62 CO 0.80 -2.05 0.00 -2.37 0.10 0.00 0.00 175.35 171.83 1b3c n THR 63 N 6.25 0.00 1.26 3.79 5.66 -1.23 -4.62 114.28 125.39 1b3c n THR 63 Ca 0.01 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.11 1b3c n THR 63 Cb 0.48 -1.14 0.60 0.00 -1.55 0.00 0.00 70.33 68.72 1b3c n THR 63 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02