#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 2.11 0.24 -5.58 1.11 -1.26 -0.01 116.67 113.28 1b3c s ASP 2 Ca 0.00 -0.42 -0.21 0.00 0.18 0.00 0.00 52.55 52.10 1b3c s ASP 2 Cb 0.00 -0.19 0.06 0.00 1.07 0.00 0.00 42.92 43.86 1b3c s ASP 2 CO 0.00 0.16 0.93 -0.83 1.18 0.00 0.00 175.17 176.60 1b3c s GLY 3 N -0.84 0.10 -0.19 0.21 0.00 -0.88 -5.01 107.32 100.71 1b3c s GLY 3 Ca 0.06 -0.36 -0.05 0.00 0.00 0.00 0.00 44.72 44.37 1b3c s GLY 3 CO 0.01 0.94 -0.00 -0.19 0.00 0.00 0.00 173.10 173.86 1b3c s TYR 4 N -2.58 3.05 0.23 1.90 1.51 -1.26 -1.67 117.35 118.53 1b3c s TYR 4 Ca 0.17 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.53 1b3c s TYR 4 Cb -0.03 -2.07 -0.09 0.00 -0.11 0.00 0.00 41.96 39.66 1b3c s TYR 4 CO 0.07 -0.19 1.02 -0.51 -1.11 0.00 0.00 175.55 174.82 1b3c s LEU 5 N 0.88 4.58 0.00 -1.29 1.43 -1.17 0.13 118.68 123.24 1b3c s LEU 5 Ca 0.01 2.06 -0.03 0.00 -1.03 0.00 0.00 54.13 55.14 1b3c s LEU 5 Cb -0.14 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.56 1b3c s LEU 5 CO 0.02 -0.02 0.62 1.33 0.23 0.00 0.00 176.35 178.53 1b3c n VAL 6 N 1.64 0.00 -2.80 -1.59 0.24 -1.26 -4.56 118.33 110.01 1b3c n VAL 6 Ca -0.01 -0.76 -0.21 0.00 -2.04 0.00 0.00 64.34 61.33 1b3c n VAL 6 Cb 0.46 -1.32 0.06 0.00 -1.47 0.00 0.00 33.84 31.57 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 -4.14 2.28 0.39 7.34 -6.30 0.77 -4.82 118.70 114.21 1b3c s GLU 7 Ca 0.38 -1.19 0.12 0.00 -2.50 0.00 0.00 54.97 51.78 1b3c s GLU 7 Cb -0.02 -2.53 0.92 0.00 0.00 0.00 0.00 34.13 32.50 1b3c s GLU 7 CO 0.26 -0.89 1.89 -0.22 0.02 0.00 0.00 175.26 176.32 1b3c h LYS 8 N 0.03 0.56 0.00 4.30 3.64 -1.97 -0.13 116.57 122.99 1b3c h LYS 8 Ca -0.37 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 58.80 1b3c h LYS 8 Cb 1.28 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 1b3c h LYS 8 CO 0.44 0.37 -0.99 1.79 -2.27 0.00 0.00 179.45 178.79 1b3c h THR 9 N 0.57 1.12 0.00 1.00 1.35 -2.01 -3.47 112.91 111.47 1b3c h THR 9 Ca 0.42 -2.69 0.00 0.00 -0.55 0.00 0.00 66.41 63.59 1b3c h THR 9 Cb 0.79 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 1b3c h THR 9 CO -0.17 0.64 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 1b3c n GLY 10 N 1.34 1.83 3.70 5.82 0.00 -0.06 -4.84 105.19 112.99 1b3c n GLY 10 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.08 -1.10 -2.86 0.00 5.02 -1.26 0.27 118.16 117.16 1b3c n LYS 12 Ca -0.04 -0.56 -0.18 0.00 -2.02 0.00 0.00 58.31 55.50 1b3c n LYS 12 Cb 0.61 -0.45 -0.01 0.00 -0.02 0.00 0.00 35.03 35.16 1b3c n LYS 12 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1b3c n LYS 13 N -2.21 1.85 -1.21 1.97 5.02 -1.26 -4.56 118.16 117.75 1b3c n LYS 13 Ca 0.05 -3.80 -0.37 0.00 -2.02 0.00 0.00 58.31 52.17 1b3c n LYS 13 Cb 0.17 -1.75 0.05 0.00 -0.02 0.00 0.00 35.03 33.49 1b3c n LYS 13 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1b3c n THR 14 N -0.05 1.06 -3.71 -0.18 -1.04 -1.26 -3.46 114.28 105.64 1b3c n THR 14 Ca 0.23 -0.43 -0.14 0.00 -2.04 0.00 0.00 64.05 61.67 1b3c n THR 14 Cb 0.66 -0.45 -0.14 0.00 -1.82 0.00 0.00 70.33 68.58 1b3c n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b3c n TYR 16 N 4.66 0.07 -3.47 0.00 4.02 -1.26 -3.89 117.16 117.29 1b3c n TYR 16 Ca -0.18 0.03 -0.38 0.00 -0.01 0.00 0.00 57.90 57.36 1b3c n TYR 16 Cb 0.51 -0.54 -0.04 0.00 -0.02 0.00 0.00 39.34 39.25 1b3c n TYR 16 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1b3c n LYS 17 N -1.56 3.06 -0.65 -0.72 3.00 -1.26 -5.06 118.16 114.97 1b3c n LYS 17 Ca 0.04 -4.51 -0.30 0.00 -0.00 0.00 0.00 58.31 53.54 1b3c n LYS 17 Cb 0.18 -2.43 0.26 0.00 0.00 0.00 0.00 35.03 33.04 1b3c n LYS 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1b3c s LEU 18 N -1.71 0.05 0.00 3.14 1.43 -1.25 -4.65 118.68 115.69 1b3c s LEU 18 Ca 0.30 1.02 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 1b3c s LEU 18 Cb -0.03 -2.71 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1b3c s LEU 18 CO -0.07 -4.58 0.00 0.61 0.23 0.00 0.00 176.35 172.54 1b3c n GLY 19 N 0.48 -1.80 3.43 -3.19 0.00 -1.25 -4.71 105.19 98.15 1b3c n GLY 19 Ca 0.09 -1.84 -0.11 0.00 0.00 0.00 0.00 46.02 44.16 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 0.12 -2.50 1.61 1.02 -1.26 -3.76 120.64 115.87 1b3c n GLU 20 Ca 0.00 -1.09 -0.43 0.00 -0.02 0.00 0.00 57.16 55.62 1b3c n GLU 20 Cb 0.00 -3.04 0.00 0.00 -0.02 0.00 0.00 31.44 28.38 1b3c n GLU 20 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1b3c n ASN 21 N 15.32 5.03 -0.30 1.62 2.85 -1.26 -4.83 115.26 133.70 1b3c n ASN 21 Ca 0.33 -3.04 0.16 0.00 -0.11 0.00 0.00 54.58 51.92 1b3c n ASN 21 Cb 0.45 -1.54 0.30 0.00 1.24 0.00 0.00 39.78 40.24 1b3c n ASN 21 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1b3c n ASP 22 N 4.83 -0.02 -0.11 1.20 8.00 -1.26 0.52 116.55 129.71 1b3c n ASP 22 Ca 0.40 1.46 -0.08 0.00 0.71 0.00 0.00 54.79 57.28 1b3c n ASP 22 Cb 0.39 -0.57 -0.02 0.00 -0.02 0.00 0.00 41.12 40.90 1b3c n ASP 22 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1b3c h PHE 23 N 0.00 -0.97 -0.58 1.24 3.57 -1.99 0.98 116.94 119.20 1b3c h PHE 23 Ca 0.57 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 62.07 1b3c h PHE 23 Cb 1.25 0.48 -0.03 0.00 2.79 0.00 0.00 35.95 40.45 1b3c h PHE 23 CO -0.36 -0.40 0.16 0.00 -2.23 0.00 0.00 178.31 175.49 1b3c h ASN 25 N 0.86 0.98 0.49 0.00 -0.73 0.74 -2.51 115.58 115.41 1b3c h ASN 25 Ca 0.19 -0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.31 1b3c h ASN 25 Cb 0.28 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.63 1b3c h ASN 25 CO -0.00 0.71 -0.23 -0.09 -0.37 0.00 0.00 177.43 177.44 1b3c h ARG 26 N 1.16 -0.63 -0.82 6.67 9.65 0.17 0.28 114.38 130.86 1b3c h ARG 26 Ca 0.31 0.04 0.20 0.00 -1.10 0.00 0.00 59.98 59.44 1b3c h ARG 26 Cb -0.13 0.14 -0.13 0.00 -1.39 0.00 0.00 29.97 28.46 1b3c h ARG 26 CO -0.07 -0.42 0.17 0.93 2.80 0.00 0.00 179.97 183.38 1b3c h GLU 27 N -0.65 0.20 -0.44 0.20 4.39 -1.13 0.67 114.58 117.82 1b3c h GLU 27 Ca -0.07 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 1b3c h GLU 27 Cb 0.50 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1b3c h GLU 27 CO 0.11 0.13 -0.20 0.00 -1.16 0.00 0.00 179.01 177.89 1b3c n LYS 29 N -4.12 3.04 0.00 0.00 4.81 0.23 -4.47 118.16 117.65 1b3c n LYS 29 Ca 0.00 -2.27 0.00 0.00 -0.87 0.00 0.00 58.31 55.17 1b3c n LYS 29 Cb 0.43 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.16 1b3c n LYS 29 CO 0.00 0.00 0.00 1.87 1.17 0.00 0.00 177.40 180.44 1b3c n TRP 30 N 1.87 0.00 0.00 5.64 -0.00 -1.05 -4.87 117.44 119.04 1b3c n TRP 30 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 58.05 1b3c n TRP 30 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.83 1b3c n TRP 30 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 177.69 178.05 1b3c n LYS 31 N 0.00 0.00 -1.16 5.87 2.85 -1.26 -4.87 118.16 119.58 1b3c n LYS 31 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 1b3c n LYS 31 Cb 0.00 0.00 0.09 0.00 -0.65 0.00 0.00 35.03 34.47 1b3c n LYS 31 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 1b3c n HIS 32 N -0.04 2.73 -0.05 5.58 -0.00 -1.26 -4.26 115.22 117.93 1b3c n HIS 32 Ca 0.00 -2.44 -0.06 0.00 0.46 0.00 0.00 57.72 55.68 1b3c n HIS 32 Cb 0.00 -1.19 -0.06 0.00 -0.12 0.00 0.00 29.99 28.63 1b3c n HIS 32 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 1b3c n ILE 33 N -0.66 0.60 0.00 3.57 -0.00 -1.26 -5.10 119.36 116.51 1b3c n ILE 33 Ca 0.53 -0.28 0.00 0.00 -0.00 0.00 0.00 62.75 63.00 1b3c n ILE 33 Cb 0.88 -0.84 0.00 0.00 -0.00 0.00 0.00 39.64 39.68 1b3c n ILE 33 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1b3c n GLY 34 N 2.80 0.46 3.37 7.39 0.00 -1.26 -4.85 105.19 113.11 1b3c n GLY 34 Ca -0.17 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 1.39 -0.18 -0.02 0.00 -1.26 -4.59 107.32 102.66 1b3c s GLY 35 Ca 0.00 -1.05 -0.15 0.00 0.00 0.00 0.00 44.72 43.52 1b3c s GLY 35 CO 0.00 -0.81 -0.01 -1.14 0.00 0.00 0.00 173.10 171.14 1b3c n SER 36 N 2.48 1.84 -3.52 1.64 3.41 -1.17 -4.91 113.62 113.39 1b3c n SER 36 Ca -0.17 0.52 -0.14 0.00 -0.26 0.00 0.00 58.87 58.83 1b3c n SER 36 Cb 0.52 -0.91 -0.04 0.00 -0.26 0.00 0.00 64.21 63.51 1b3c n SER 36 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1b3c s TYR 37 N -2.32 -0.51 -0.05 7.33 5.04 -1.24 -5.03 117.35 120.57 1b3c s TYR 37 Ca -0.22 0.57 -0.29 0.00 -2.44 0.00 0.00 57.07 54.69 1b3c s TYR 37 Cb 0.04 0.42 0.11 0.00 0.35 0.00 0.00 41.96 42.88 1b3c s TYR 37 CO 0.40 -0.70 0.89 0.20 -1.34 0.00 0.00 175.55 175.00 1b3c s GLY 38 N -2.04 -0.42 0.01 8.97 0.00 -1.26 -1.43 107.32 111.15 1b3c s GLY 38 Ca -0.05 1.36 -0.01 0.00 0.00 0.00 0.00 44.72 46.03 1b3c s GLY 38 CO -0.03 0.62 0.03 1.58 0.00 0.00 0.00 173.10 175.30 1b3c n TYR 39 N 0.19 -1.02 -3.20 1.90 4.11 0.31 -3.96 117.16 115.49 1b3c n TYR 39 Ca -0.11 -0.06 -0.39 0.00 -0.00 0.00 0.00 57.90 57.34 1b3c n TYR 39 Cb 0.60 0.03 -0.06 0.00 -0.00 0.00 0.00 39.34 39.92 1b3c n TYR 39 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1b3c s TYR 41 N -0.07 -0.65 -0.85 0.00 5.04 -0.64 -3.90 117.35 116.30 1b3c s TYR 41 Ca 0.31 1.31 -0.06 0.00 -2.44 0.00 0.00 57.07 56.20 1b3c s TYR 41 Cb -0.18 0.20 0.01 0.00 0.35 0.00 0.00 41.96 42.34 1b3c s TYR 41 CO 0.17 -0.41 0.74 0.41 -1.34 0.00 0.00 175.55 175.12 1b3c n GLY 42 N 5.08 0.02 3.18 8.97 0.00 -1.26 -3.77 105.19 117.40 1b3c n GLY 42 Ca -0.12 -0.09 -0.07 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 -4.06 -2.88 0.00 1.61 3.72 -1.26 -5.00 117.46 109.59 1b3c n PHE 43 Ca 0.00 1.12 0.00 0.00 -0.05 0.00 0.00 57.45 58.52 1b3c n PHE 43 Cb 0.54 -3.80 0.00 0.00 -0.94 0.00 0.00 39.48 35.28 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 -1.51 2.33 3.63 1.37 0.00 -1.25 -4.08 105.19 105.69 1b3c n GLY 44 Ca -0.04 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 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 3.88 3.17 -0.04 0.00 5.04 0.15 -3.04 117.35 126.51 1b3c s TYR 46 Ca 0.48 0.19 -0.05 0.00 -2.44 0.00 0.00 57.07 55.26 1b3c s TYR 46 Cb -0.13 -1.78 0.01 0.00 0.35 0.00 0.00 41.96 40.42 1b3c s TYR 46 CO 0.19 0.48 0.13 0.00 -1.34 0.00 0.00 175.55 175.01 1b3c s GLU 48 N -0.10 2.25 0.00 0.00 2.02 -0.52 -2.06 118.70 120.29 1b3c s GLU 48 Ca -0.02 -0.92 0.00 0.00 0.02 0.00 0.00 54.97 54.05 1b3c s GLU 48 Cb -0.02 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.87 1b3c s GLU 48 CO 0.00 0.54 0.00 0.41 0.02 0.00 0.00 175.26 176.24 1b3c n GLY 49 N 1.17 1.77 3.56 -1.39 0.00 0.98 -3.05 105.19 108.24 1b3c n GLY 49 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 4.29 1.14 0.99 1.43 -1.25 -4.58 118.68 120.70 1b3c s LEU 50 Ca 0.00 0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 53.02 1b3c s LEU 50 Cb 0.00 -2.72 0.19 0.00 0.03 0.00 0.00 46.19 43.69 1b3c s LEU 50 CO 0.00 -0.56 0.48 -2.65 0.23 0.00 0.00 176.35 173.85 1b3c n PRO 51 N 5.95 -1.96 0.27 1.29 -0.02 -1.26 -4.36 135.00 134.91 1b3c n PRO 51 Ca -0.02 -0.55 0.17 0.00 -2.02 0.00 0.00 63.50 61.08 1b3c n PRO 51 Cb 0.49 -1.92 0.65 0.00 -0.02 0.00 0.00 33.50 32.69 1b3c n PRO 51 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1b3c h ASP 52 N -2.34 0.00 1.18 2.55 5.19 -2.02 -2.71 116.42 118.27 1b3c h ASP 52 Ca -0.57 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 1b3c h ASP 52 Cb 1.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.86 1b3c h ASP 52 CO 0.43 0.00 0.00 -1.20 -3.12 0.00 0.00 179.24 175.35 1b3c n SER 53 N -3.06 0.68 -4.87 6.45 7.64 -1.26 -4.77 113.62 114.43 1b3c n SER 53 Ca 0.01 0.60 -0.35 0.00 1.01 0.00 0.00 58.87 60.13 1b3c n SER 53 Cb 0.32 -0.77 -0.05 0.00 -1.01 0.00 0.00 64.21 62.70 1b3c n SER 53 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1b3c s THR 54 N -3.16 5.16 0.42 0.44 2.01 -1.03 -5.10 115.64 114.39 1b3c s THR 54 Ca 0.09 0.42 0.08 0.00 0.31 0.00 0.00 61.69 62.58 1b3c s THR 54 Cb 0.12 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 69.01 1b3c s THR 54 CO 0.52 0.36 0.57 -1.10 -0.69 0.00 0.00 174.62 174.28 1b3c s GLN 55 N -1.73 2.82 0.36 4.92 -0.21 -1.26 -4.88 119.66 119.68 1b3c s GLN 55 Ca 0.30 -1.23 -0.09 0.00 0.02 0.00 0.00 55.36 54.35 1b3c s GLN 55 Cb -0.14 -2.76 0.03 0.00 1.00 0.00 0.00 33.01 31.14 1b3c s GLN 55 CO 0.16 -0.28 0.62 0.95 -2.12 0.00 0.00 175.29 174.63 1b3c s THR 56 N -2.36 0.00 0.46 -0.19 -4.23 -1.26 -4.82 115.64 103.24 1b3c s THR 56 Ca 0.55 -1.30 -0.22 0.00 -1.18 0.00 0.00 61.69 59.54 1b3c s THR 56 Cb -0.10 -2.71 -0.08 0.00 1.34 0.00 0.00 72.50 70.96 1b3c s THR 56 CO 0.33 0.00 1.10 0.86 -0.54 0.00 0.00 174.62 176.37 1b3c s TRP 57 N -2.79 2.97 1.15 3.99 -0.00 0.34 -4.04 118.94 120.56 1b3c s TRP 57 Ca 0.23 1.58 -0.19 0.00 -0.00 0.00 0.00 56.10 57.71 1b3c s TRP 57 Cb -0.03 -3.23 0.28 0.00 -0.00 0.00 0.00 33.47 30.49 1b3c s TRP 57 CO 0.15 -1.13 1.21 -1.25 -0.00 0.00 0.00 176.95 175.93 1b3c s PRO 58 N -2.86 -0.84 0.41 5.86 0.04 -1.26 -4.49 135.00 131.85 1b3c s PRO 58 Ca 0.64 -0.33 0.06 0.00 0.04 0.00 0.00 61.00 61.42 1b3c s PRO 58 Cb -0.23 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1b3c s PRO 58 CO 0.28 -3.42 0.56 -0.51 0.04 0.00 0.00 177.00 173.96 1b3c s LEU 59 N -6.62 3.73 0.00 -3.56 1.43 -1.26 -5.07 118.68 107.33 1b3c s LEU 59 Ca 0.74 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1b3c s LEU 59 Cb -0.05 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.41 1b3c s LEU 59 CO 0.55 -0.68 0.00 -2.65 0.23 0.00 0.00 176.35 173.80 1b3c n PRO 60 N -1.84 0.12 -0.08 1.29 -0.02 -1.26 -4.46 135.00 128.74 1b3c n PRO 60 Ca 0.05 0.00 0.25 0.00 -2.02 0.00 0.00 63.50 61.78 1b3c n PRO 60 Cb 0.59 0.00 0.61 0.00 -0.02 0.00 0.00 33.50 34.67 1b3c n PRO 60 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1b3c h ASN 61 N -1.15 0.00 -0.87 2.55 4.21 -2.05 -2.74 115.58 115.53 1b3c h ASN 61 Ca 0.00 0.00 -0.74 0.00 1.21 0.00 0.00 56.30 56.77 1b3c h ASN 61 Cb 0.00 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 37.09 1b3c h ASN 61 CO 0.00 0.00 2.47 1.17 -1.29 0.00 0.00 177.43 179.78 1b3c n LYS 62 N -3.50 3.42 -1.41 0.81 0.00 -1.26 -4.96 118.16 111.25 1b3c n LYS 62 Ca 0.16 -3.18 -0.12 0.00 0.00 0.00 0.00 58.31 55.18 1b3c n LYS 62 Cb 1.10 -3.03 0.07 0.00 0.00 0.00 0.00 35.03 33.17 1b3c n LYS 62 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1b3c n THR 63 N 3.84 0.00 1.92 3.15 -1.04 -1.04 -4.79 114.28 116.33 1b3c n THR 63 Ca 0.46 -0.69 0.15 0.00 -2.04 0.00 0.00 64.05 61.93 1b3c n THR 63 Cb 0.36 -1.28 0.91 0.00 -1.82 0.00 0.00 70.33 68.50 1b3c n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43