#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 3.40 0.24 3.14 1.01 -1.26 -0.04 116.67 123.15 1b3c s ASP 2 Ca 0.00 -0.53 -0.01 0.00 0.71 0.00 0.00 52.55 52.72 1b3c s ASP 2 Cb 0.00 -0.41 -0.03 0.00 1.01 0.00 0.00 42.92 43.49 1b3c s ASP 2 CO 0.00 0.26 0.22 -0.83 0.21 0.00 0.00 175.17 175.03 1b3c s GLY 3 N -1.30 1.47 0.49 0.21 0.00 0.56 -4.94 107.32 103.81 1b3c s GLY 3 Ca 0.13 -1.64 0.08 0.00 0.00 0.00 0.00 44.72 43.29 1b3c s GLY 3 CO 0.03 -1.29 0.61 -0.19 0.00 0.00 0.00 173.10 172.26 1b3c s TYR 4 N -3.96 2.15 0.24 1.90 2.02 -1.03 -0.12 117.35 118.55 1b3c s TYR 4 Ca 0.37 -0.58 0.07 0.00 -0.37 0.00 0.00 57.07 56.56 1b3c s TYR 4 Cb 0.05 -2.24 -0.04 0.00 -0.40 0.00 0.00 41.96 39.34 1b3c s TYR 4 CO 0.15 -0.66 0.16 -0.51 -1.57 0.00 0.00 175.55 173.12 1b3c s LEU 5 N -4.43 3.73 0.00 -1.29 1.43 -1.10 0.20 118.68 117.22 1b3c s LEU 5 Ca 0.54 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 1b3c s LEU 5 Cb -0.07 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.89 1b3c s LEU 5 CO 0.33 -0.02 0.03 1.33 0.23 0.00 0.00 176.35 178.25 1b3c n VAL 6 N -1.05 0.00 -3.28 -1.59 0.24 -1.26 -3.83 118.33 107.56 1b3c n VAL 6 Ca -0.08 -0.26 -0.20 0.00 -2.04 0.00 0.00 64.34 61.77 1b3c n VAL 6 Cb 0.58 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 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 -2.24 2.58 0.62 7.34 2.12 1.00 -4.71 118.70 125.41 1b3c s GLU 7 Ca 0.02 -1.48 0.26 0.00 0.36 0.00 0.00 54.97 54.13 1b3c s GLU 7 Cb -0.00 -2.55 1.26 0.00 0.26 0.00 0.00 34.13 33.09 1b3c s GLU 7 CO 0.02 -0.38 1.69 -0.22 -0.54 0.00 0.00 175.26 175.82 1b3c h LYS 8 N 0.70 0.00 0.00 4.30 3.64 -1.93 0.53 116.57 123.81 1b3c h LYS 8 Ca -0.38 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 58.88 1b3c h LYS 8 Cb 1.28 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 1b3c h LYS 8 CO 0.50 0.00 -2.12 0.25 -2.27 0.00 0.00 179.45 175.80 1b3c n THR 9 N -3.33 0.46 0.00 1.00 -2.24 -1.26 -4.97 114.28 103.93 1b3c n THR 9 Ca 0.09 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1b3c n THR 9 Cb 0.83 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 1b3c n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b3c n GLY 10 N 1.43 1.28 0.00 3.38 0.00 0.19 -4.64 105.19 106.82 1b3c n GLY 10 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.40 0.88 -2.78 0.00 5.02 -1.26 -0.00 118.16 118.62 1b3c n LYS 12 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1b3c n LYS 12 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.06 1b3c n LYS 12 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1b3c n LYS 13 N -0.74 0.82 -2.46 1.97 3.00 -1.25 -3.74 118.16 115.76 1b3c n LYS 13 Ca 0.00 -1.88 -0.37 0.00 -0.00 0.00 0.00 58.31 56.07 1b3c n LYS 13 Cb 0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 35.03 33.62 1b3c n LYS 13 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1b3c s THR 14 N 0.47 3.54 0.30 3.15 2.01 -1.26 -3.09 115.64 120.76 1b3c s THR 14 Ca 0.30 1.17 0.09 0.00 0.31 0.00 0.00 61.69 63.57 1b3c s THR 14 Cb 0.24 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.10 1b3c s THR 14 CO -0.20 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 173.73 1b3c h TYR 16 N 1.85 0.03 -3.26 0.00 0.05 -1.97 -3.41 116.97 110.26 1b3c h TYR 16 Ca -0.43 -0.02 -0.57 0.00 0.05 0.00 0.00 58.73 57.75 1b3c h TYR 16 Cb 1.25 -0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.94 1b3c h TYR 16 CO 0.69 1.51 -0.04 0.21 -1.05 0.00 0.00 178.16 179.48 1b3c s LYS 17 N -2.38 4.25 0.00 4.88 2.47 -1.26 -4.93 119.74 122.77 1b3c s LYS 17 Ca -0.29 0.69 0.00 0.00 -1.56 0.00 0.00 55.97 54.82 1b3c s LYS 17 Cb 0.06 -3.30 0.00 0.00 -1.46 0.00 0.00 37.83 33.13 1b3c s LYS 17 CO 0.60 0.47 0.00 1.28 0.16 0.00 0.00 175.35 177.86 1b3c n LEU 18 N 2.37 0.00 0.00 5.43 4.77 -1.26 -4.83 117.00 123.48 1b3c n LEU 18 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1b3c n LEU 18 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1b3c n LEU 18 CO 0.42 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1b3c n GLY 19 N 5.00 -1.77 3.52 -0.72 0.00 -1.25 -4.47 105.19 105.51 1b3c n GLY 19 Ca 0.00 -1.59 -0.27 0.00 0.00 0.00 0.00 46.02 44.16 1b3c n GLY 19 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1b3c n GLU 20 N 0.00 0.39 -2.61 1.61 0.28 -1.26 -3.33 120.64 115.73 1b3c n GLU 20 Ca 0.00 -1.63 -0.41 0.00 -0.16 0.00 0.00 57.16 54.95 1b3c n GLU 20 Cb 0.00 -3.44 -0.03 0.00 1.43 0.00 0.00 31.44 29.40 1b3c n GLU 20 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1b3c s ASN 21 N 7.56 6.50 0.45 -1.84 3.84 -1.26 -4.83 114.94 125.35 1b3c s ASN 21 Ca 0.74 -1.48 0.24 0.00 0.21 0.00 0.00 52.86 52.58 1b3c s ASN 21 Cb 0.03 -2.55 1.26 0.00 -0.55 0.00 0.00 41.25 39.44 1b3c s ASN 21 CO 0.22 -1.47 1.78 -0.78 -2.79 0.00 0.00 177.10 174.07 1b3c h ASP 22 N 9.68 0.29 -0.32 -4.21 1.82 -1.88 -0.77 116.42 121.04 1b3c h ASP 22 Ca 0.17 0.06 0.06 0.00 -0.39 0.00 0.00 57.03 56.93 1b3c h ASP 22 Cb 1.01 0.01 -0.08 0.00 0.68 0.00 0.00 39.33 40.95 1b3c h ASP 22 CO 1.38 0.05 -0.42 0.15 -1.61 0.00 0.00 179.24 178.79 1b3c h PHE 23 N 0.25 -1.20 0.36 0.28 3.04 -1.98 0.67 116.94 118.37 1b3c h PHE 23 Ca 0.58 0.06 -0.02 0.00 3.98 0.00 0.00 57.97 62.57 1b3c h PHE 23 Cb 1.75 0.57 0.00 0.00 2.56 0.00 0.00 35.95 40.83 1b3c h PHE 23 CO -0.00 -0.45 -0.17 0.00 -2.02 0.00 0.00 178.31 175.67 1b3c h ASN 25 N -0.61 0.19 0.30 0.00 -1.24 -1.15 0.37 115.58 113.44 1b3c h ASN 25 Ca -0.05 0.14 -0.00 0.00 0.71 0.00 0.00 56.30 57.10 1b3c h ASN 25 Cb 0.45 0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.62 1b3c h ASN 25 CO 0.08 0.02 -0.28 0.03 -1.29 0.00 0.00 177.43 175.99 1b3c h ARG 26 N 0.37 -0.58 -0.88 6.67 2.47 0.61 0.46 114.38 123.49 1b3c h ARG 26 Ca 0.46 0.04 0.04 0.00 -1.26 0.00 0.00 59.98 59.26 1b3c h ARG 26 Cb 0.79 0.13 -0.05 0.00 -1.65 0.00 0.00 29.97 29.19 1b3c h ARG 26 CO -0.48 -0.39 0.58 1.49 0.56 0.00 0.00 179.97 181.73 1b3c h GLU 27 N -0.60 1.06 0.00 0.04 4.22 -0.55 0.22 114.58 118.96 1b3c h GLU 27 Ca -0.01 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.36 1b3c h GLU 27 Cb 0.55 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1b3c h GLU 27 CO -0.05 0.70 0.00 0.00 -2.18 0.00 0.00 179.01 177.48 1b3c h LYS 29 N 0.00 0.47 0.00 0.00 3.64 0.33 -3.37 116.57 117.63 1b3c h LYS 29 Ca 0.00 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1b3c h LYS 29 Cb 0.14 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1b3c h LYS 29 CO 0.00 1.08 0.00 0.91 -2.27 0.00 0.00 179.45 179.17 1b3c n TRP 30 N -4.22 0.00 -3.08 1.91 5.03 -1.23 -4.24 117.44 111.62 1b3c n TRP 30 Ca -0.09 0.00 -0.40 0.00 3.03 0.00 0.00 57.50 60.04 1b3c n TRP 30 Cb 0.64 -0.23 -0.05 0.00 -1.03 0.00 0.00 31.31 30.64 1b3c n TRP 30 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1b3c s LYS 31 N -1.91 4.31 -0.11 -0.99 3.01 -1.26 -5.02 119.74 117.78 1b3c s LYS 31 Ca 0.00 0.75 -0.32 0.00 -1.01 0.00 0.00 55.97 55.39 1b3c s LYS 31 Cb 0.00 -3.52 0.12 0.00 -1.01 0.00 0.00 37.83 33.42 1b3c s LYS 31 CO 0.00 -0.11 1.05 -1.58 0.51 0.00 0.00 175.35 175.22 1b3c s HIS 32 N 1.44 -0.24 0.00 3.18 2.46 -1.26 -4.91 115.29 115.95 1b3c s HIS 32 Ca 0.33 0.18 0.00 0.00 0.47 0.00 0.00 55.06 56.04 1b3c s HIS 32 Cb -0.16 0.52 0.00 0.00 -0.13 0.00 0.00 32.58 32.81 1b3c s HIS 32 CO 0.13 -0.37 0.00 -0.89 -2.47 0.00 0.00 174.74 171.15 1b3c n ILE 33 N -0.09 0.00 -0.07 0.89 5.41 -1.26 -4.93 119.36 119.31 1b3c n ILE 33 Ca -0.04 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.63 1b3c n ILE 33 Cb 0.60 -0.49 -0.06 0.00 -0.71 0.00 0.00 39.64 38.98 1b3c n ILE 33 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1b3c h GLY 34 N 0.00 0.00 -4.04 7.39 0.00 -1.94 -3.50 103.07 100.99 1b3c h GLY 34 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1b3c h GLY 34 CO 0.00 0.00 -0.34 0.61 0.00 0.00 0.00 176.54 176.81 1b3c n GLY 35 N 1.66 -0.00 0.08 4.60 0.00 -1.26 -4.95 105.19 105.32 1b3c n GLY 35 Ca -0.08 0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1b3c n GLY 35 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1b3c n SER 36 N -2.18 1.85 -3.60 1.61 3.41 -1.24 -5.04 113.62 108.43 1b3c n SER 36 Ca -0.03 0.54 -0.01 0.00 -0.26 0.00 0.00 58.87 59.11 1b3c n SER 36 Cb 0.55 -0.84 -0.06 0.00 -0.26 0.00 0.00 64.21 63.60 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 -2.44 -0.55 -0.12 7.33 5.04 -1.24 -5.04 117.35 120.33 1b3c s TYR 37 Ca -0.20 1.06 -0.00 0.00 -2.44 0.00 0.00 57.07 55.49 1b3c s TYR 37 Cb 0.03 0.33 -0.02 0.00 0.35 0.00 0.00 41.96 42.65 1b3c s TYR 37 CO 0.30 -0.27 -0.12 0.20 -1.34 0.00 0.00 175.55 174.31 1b3c s GLY 38 N 1.52 1.56 0.10 8.97 0.00 -1.26 -1.91 107.32 116.30 1b3c s GLY 38 Ca -0.08 -0.89 -0.20 0.00 0.00 0.00 0.00 44.72 43.55 1b3c s GLY 38 CO -0.15 -0.25 0.48 -2.52 0.00 0.00 0.00 173.10 170.67 1b3c s TYR 39 N 0.22 -0.35 0.07 1.90 -0.85 -0.31 -4.43 117.35 113.59 1b3c s TYR 39 Ca -0.08 0.19 -0.27 0.00 -0.52 0.00 0.00 57.07 56.40 1b3c s TYR 39 Cb -0.15 0.35 -0.05 0.00 0.38 0.00 0.00 41.96 42.48 1b3c s TYR 39 CO 0.05 -0.71 0.84 0.00 -1.52 0.00 0.00 175.55 174.21 1b3c s TYR 41 N 0.01 1.33 -1.06 0.00 5.04 0.27 -3.81 117.35 119.13 1b3c s TYR 41 Ca 0.42 -0.56 -0.08 0.00 -2.44 0.00 0.00 57.07 54.41 1b3c s TYR 41 Cb -0.21 -1.07 -0.06 0.00 0.35 0.00 0.00 41.96 40.97 1b3c s TYR 41 CO 0.25 -0.36 0.90 0.41 -1.34 0.00 0.00 175.55 175.41 1b3c n GLY 42 N 4.36 -1.15 3.97 8.97 0.00 -1.26 -2.84 105.19 117.25 1b3c n GLY 42 Ca -0.18 0.57 -0.35 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.35 -1.58 -3.64 1.61 3.01 -1.26 -4.94 117.46 107.31 1b3c n PHE 43 Ca -0.07 0.42 -0.05 0.00 1.01 0.00 0.00 57.45 58.76 1b3c n PHE 43 Cb 0.61 -3.20 -0.07 0.00 -0.01 0.00 0.00 39.48 36.81 1b3c n PHE 43 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1b3c s GLY 44 N -3.85 0.00 -0.25 1.37 0.00 -1.13 -3.80 107.32 99.66 1b3c s GLY 44 Ca 0.29 3.02 -0.29 0.00 0.00 0.00 0.00 44.72 47.74 1b3c s GLY 44 CO 0.93 2.22 1.65 0.00 0.00 0.00 0.00 173.10 177.90 1b3c s TYR 46 N 5.59 2.79 -0.09 0.00 5.04 0.68 -2.71 117.35 128.65 1b3c s TYR 46 Ca 0.73 -0.92 0.01 0.00 -2.44 0.00 0.00 57.07 54.45 1b3c s TYR 46 Cb -0.24 -1.88 -0.03 0.00 0.35 0.00 0.00 41.96 40.16 1b3c s TYR 46 CO 0.31 -0.40 -0.09 0.00 -1.34 0.00 0.00 175.55 174.03 1b3c s GLU 48 N -0.45 2.25 0.00 0.00 2.02 -0.80 -0.33 118.70 121.39 1b3c s GLU 48 Ca 0.06 -1.16 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1b3c s GLU 48 Cb -0.12 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.83 1b3c s GLU 48 CO 0.02 0.45 0.00 0.41 0.02 0.00 0.00 175.26 176.16 1b3c n GLY 49 N 0.01 2.25 1.95 -1.39 0.00 0.95 -3.58 105.19 105.37 1b3c n GLY 49 Ca -0.10 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 1b3c n GLY 49 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1b3c n LEU 50 N 0.00 0.21 -4.45 0.99 -0.00 -1.25 -4.07 117.00 108.42 1b3c n LEU 50 Ca 0.00 0.15 -0.29 0.00 -0.00 0.00 0.00 56.01 55.87 1b3c n LEU 50 Cb 0.00 -0.52 0.26 0.00 -0.00 0.00 0.00 43.42 43.16 1b3c n LEU 50 CO 0.00 -0.41 0.50 -2.84 -0.00 0.00 0.00 177.39 174.64 1b3c s PRO 51 N 4.80 -1.47 0.51 1.47 0.02 -1.26 -4.65 135.00 134.41 1b3c s PRO 51 Ca 0.75 0.53 0.37 0.00 0.02 0.00 0.00 61.00 62.68 1b3c s PRO 51 Cb -0.73 -1.51 1.53 0.00 0.02 0.00 0.00 34.50 33.81 1b3c s PRO 51 CO 0.29 -4.01 1.71 0.22 -0.33 0.00 0.00 177.00 174.88 1b3c h ASP 52 N -2.82 0.09 -0.04 2.53 1.82 -1.95 0.47 116.42 116.52 1b3c h ASP 52 Ca -0.56 0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.12 1b3c h ASP 52 Cb 1.34 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 41.37 1b3c h ASP 52 CO 0.45 -0.02 0.14 0.28 -1.61 0.00 0.00 179.24 178.48 1b3c h SER 53 N 0.06 0.00 -3.62 2.28 0.02 -1.98 -3.42 113.55 106.89 1b3c h SER 53 Ca 0.71 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 61.15 1b3c h SER 53 Cb 2.63 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 65.14 1b3c h SER 53 CO -0.10 0.00 0.03 -0.89 -1.14 0.00 0.00 176.83 174.72 1b3c s THR 54 N -4.27 4.76 -0.34 -2.27 2.01 0.16 -5.05 115.64 110.65 1b3c s THR 54 Ca -0.04 0.81 -0.13 0.00 0.31 0.00 0.00 61.69 62.64 1b3c s THR 54 Cb 0.12 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.99 1b3c s THR 54 CO 0.41 -0.12 0.24 -1.58 -0.69 0.00 0.00 174.62 172.87 1b3c s GLN 55 N -2.86 3.47 0.06 4.92 2.00 -1.26 -4.94 119.66 121.04 1b3c s GLN 55 Ca 0.51 -0.66 0.02 0.00 -2.00 0.00 0.00 55.36 53.23 1b3c s GLN 55 Cb -0.11 -3.81 -0.03 0.00 0.80 0.00 0.00 33.01 29.86 1b3c s GLN 55 CO 0.19 -0.45 -0.07 0.95 -0.50 0.00 0.00 175.29 175.40 1b3c s THR 56 N 1.72 0.57 0.54 -0.34 -4.23 -1.26 -4.94 115.64 107.69 1b3c s THR 56 Ca 0.06 -1.39 -0.20 0.00 -1.18 0.00 0.00 61.69 58.98 1b3c s THR 56 Cb -0.17 -1.00 -0.07 0.00 1.34 0.00 0.00 72.50 72.60 1b3c s THR 56 CO 0.10 -0.58 0.93 1.87 -0.54 0.00 0.00 174.62 176.41 1b3c n TRP 57 N 0.91 0.77 -1.50 3.99 -0.00 0.55 -4.33 117.44 117.82 1b3c n TRP 57 Ca -0.19 0.47 -0.30 0.00 -0.00 0.00 0.00 57.50 57.48 1b3c n TRP 57 Cb 0.57 -2.15 0.21 0.00 -0.00 0.00 0.00 31.31 29.94 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 -0.32 0.52 5.87 0.04 -1.26 -2.46 135.00 134.95 1b3c s PRO 58 Ca 0.71 -0.24 0.07 0.00 0.04 0.00 0.00 61.00 61.58 1b3c s PRO 58 Cb -0.46 -1.72 0.05 0.00 0.04 0.00 0.00 34.50 32.41 1b3c s PRO 58 CO 0.51 -3.08 0.71 -0.51 0.04 0.00 0.00 177.00 174.67 1b3c s LEU 59 N -6.43 3.35 0.00 -3.56 1.02 -1.26 -5.03 118.68 106.78 1b3c s LEU 59 Ca 0.72 -0.54 0.00 0.00 0.02 0.00 0.00 54.13 54.33 1b3c s LEU 59 Cb -0.07 -2.23 0.00 0.00 0.02 0.00 0.00 46.19 43.92 1b3c s LEU 59 CO 0.54 -1.11 0.00 -0.81 0.02 0.00 0.00 176.35 175.00 1b3c n PRO 60 N -2.13 1.00 0.29 1.29 -0.04 -1.26 -4.69 135.00 129.47 1b3c n PRO 60 Ca 0.12 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.72 1b3c n PRO 60 Cb 0.60 0.00 0.72 0.00 -0.04 0.00 0.00 33.50 34.79 1b3c n PRO 60 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1b3c h ASN 61 N -0.00 0.00 -2.04 3.54 -0.26 -2.06 -3.12 115.58 111.64 1b3c h ASN 61 Ca 0.00 0.00 -0.76 0.00 -0.56 0.00 0.00 56.30 54.98 1b3c h ASN 61 Cb 0.00 0.00 -0.19 0.00 -1.06 0.00 0.00 38.32 37.07 1b3c h ASN 61 CO 0.00 0.00 1.50 0.29 -1.06 0.00 0.00 177.43 178.16 1b3c n LYS 62 N -2.97 3.61 0.00 0.81 4.01 -1.26 -5.00 118.16 117.37 1b3c n LYS 62 Ca -0.00 -3.84 0.00 0.00 -0.51 0.00 0.00 58.31 53.96 1b3c n LYS 62 Cb 0.49 -2.89 0.00 0.00 -0.51 0.00 0.00 35.03 32.12 1b3c n LYS 62 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1b3c n THR 63 N 3.55 0.00 1.47 -0.18 5.66 -1.18 -4.82 114.28 118.77 1b3c n THR 63 Ca 0.36 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.48 1b3c n THR 63 Cb 0.39 -1.26 0.70 0.00 -1.55 0.00 0.00 70.33 68.60 1b3c n THR 63 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02