#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 3.99 0.21 3.14 1.01 -1.26 0.05 116.67 123.81 1b3c s ASP 2 Ca 0.00 -1.40 -0.22 0.00 0.71 0.00 0.00 52.55 51.64 1b3c s ASP 2 Cb 0.00 -0.19 0.07 0.00 1.01 0.00 0.00 42.92 43.80 1b3c s ASP 2 CO 0.00 -0.56 0.95 -0.83 0.21 0.00 0.00 175.17 174.95 1b3c s GLY 3 N -3.77 0.02 -0.21 0.21 0.00 0.46 -4.73 107.32 99.29 1b3c s GLY 3 Ca 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 44.72 44.77 1b3c s GLY 3 CO 0.15 0.95 -0.02 -0.47 0.00 0.00 0.00 173.10 173.71 1b3c s TYR 4 N -2.70 1.73 0.35 1.90 6.14 -1.26 -2.44 117.35 121.08 1b3c s TYR 4 Ca 0.17 -1.28 -0.28 0.00 0.64 0.00 0.00 57.07 56.32 1b3c s TYR 4 Cb -0.03 -1.31 -0.10 0.00 0.42 0.00 0.00 41.96 40.94 1b3c s TYR 4 CO 0.05 -0.68 1.34 -0.51 0.64 0.00 0.00 175.55 176.39 1b3c s LEU 5 N 1.62 4.36 0.00 6.97 1.43 -1.23 0.74 118.68 132.57 1b3c s LEU 5 Ca -0.03 2.75 0.00 0.00 -1.03 0.00 0.00 54.13 55.83 1b3c s LEU 5 Cb -0.17 -3.70 0.00 0.00 0.03 0.00 0.00 46.19 42.34 1b3c s LEU 5 CO -0.07 -0.66 0.00 1.33 0.23 0.00 0.00 176.35 177.18 1b3c n VAL 6 N 0.60 0.00 -2.65 -1.59 0.24 -1.26 -4.30 118.33 109.36 1b3c n VAL 6 Ca 0.01 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 1b3c n VAL 6 Cb 0.42 -1.20 0.03 0.00 -1.47 0.00 0.00 33.84 31.62 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 -1.84 2.65 0.55 7.34 2.12 0.61 -4.74 118.70 125.39 1b3c s GLU 7 Ca 0.00 -0.59 0.28 0.00 0.36 0.00 0.00 54.97 55.02 1b3c s GLU 7 Cb 0.00 -2.45 1.54 0.00 0.26 0.00 0.00 34.13 33.48 1b3c s GLU 7 CO 0.00 -0.67 1.85 0.87 -0.54 0.00 0.00 175.26 176.77 1b3c h LYS 8 N 0.05 0.00 0.00 4.30 1.57 -1.92 0.24 116.57 120.81 1b3c h LYS 8 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1b3c h LYS 8 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1b3c h LYS 8 CO 0.55 0.00 -1.56 0.25 -0.57 0.00 0.00 179.45 178.12 1b3c n THR 9 N -2.67 0.00 0.00 -0.16 -2.24 -1.26 -4.99 114.28 102.96 1b3c n THR 9 Ca -0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1b3c n THR 9 Cb 0.26 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 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 1.64 1.58 1.27 3.38 0.00 0.07 -4.91 105.19 108.22 1b3c n GLY 10 Ca -0.02 0.00 -0.12 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 -3.24 0.29 -3.24 0.00 5.02 -1.26 0.23 118.16 115.95 1b3c n LYS 12 Ca 0.05 -0.15 -0.25 0.00 -2.02 0.00 0.00 58.31 55.95 1b3c n LYS 12 Cb 0.23 -0.06 -0.07 0.00 -0.02 0.00 0.00 35.03 35.11 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 -1.14 0.96 -1.11 1.97 5.02 -1.26 -3.89 118.16 118.71 1b3c n LYS 13 Ca 0.01 -3.45 -0.31 0.00 -2.02 0.00 0.00 58.31 52.55 1b3c n LYS 13 Cb 0.04 -1.40 0.12 0.00 -0.02 0.00 0.00 35.03 33.77 1b3c n LYS 13 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1b3c s THR 14 N -1.30 2.86 0.31 -0.18 2.01 -1.26 -0.81 115.64 117.27 1b3c s THR 14 Ca 0.36 0.28 0.03 0.00 0.31 0.00 0.00 61.69 62.66 1b3c s THR 14 Cb 0.16 -2.66 -0.01 0.00 0.01 0.00 0.00 72.50 70.00 1b3c s THR 14 CO -0.10 -0.36 0.35 0.00 -0.69 0.00 0.00 174.62 173.82 1b3c n TYR 16 N -0.55 0.00 -3.20 0.00 4.01 -1.26 -4.76 117.16 111.39 1b3c n TYR 16 Ca 0.04 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.36 1b3c n TYR 16 Cb 0.54 -0.41 -0.07 0.00 -0.31 0.00 0.00 39.34 39.08 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 -2.20 3.55 0.04 -0.72 1.02 -1.26 -5.04 119.74 115.13 1b3c s LYS 17 Ca -0.05 -0.18 -0.26 0.00 0.02 0.00 0.00 55.97 55.49 1b3c s LYS 17 Cb 0.03 -3.84 -0.05 0.00 -0.52 0.00 0.00 37.83 33.45 1b3c s LYS 17 CO 0.33 -0.72 0.82 -0.51 -0.92 0.00 0.00 175.35 174.34 1b3c s LEU 18 N 2.50 4.44 0.11 3.17 1.43 -1.26 -4.53 118.68 124.53 1b3c s LEU 18 Ca 0.20 1.51 0.00 0.00 -1.03 0.00 0.00 54.13 54.80 1b3c s LEU 18 Cb -0.15 -3.31 0.00 0.00 0.03 0.00 0.00 46.19 42.75 1b3c s LEU 18 CO 0.14 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.30 1b3c n GLY 19 N 2.48 -2.65 2.25 -3.19 0.00 -0.50 -4.73 105.19 98.86 1b3c n GLY 19 Ca -0.01 -1.38 -0.05 0.00 0.00 0.00 0.00 46.02 44.57 1b3c n GLY 19 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1b3c n GLU 20 N -2.50 -2.16 -2.56 1.61 2.13 -1.26 -4.67 120.64 111.23 1b3c n GLU 20 Ca -0.02 0.02 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1b3c n GLU 20 Cb 0.13 -3.28 -0.02 0.00 0.27 0.00 0.00 31.44 28.53 1b3c n GLU 20 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1b3c s ASN 21 N -1.65 6.63 0.59 4.31 3.84 -1.26 -4.79 114.94 122.60 1b3c s ASN 21 Ca 0.11 -1.87 0.29 0.00 0.21 0.00 0.00 52.86 51.59 1b3c s ASN 21 Cb -0.06 -2.57 1.59 0.00 -0.55 0.00 0.00 41.25 39.65 1b3c s ASN 21 CO 0.13 -1.38 2.02 0.44 -2.79 0.00 0.00 177.10 175.52 1b3c h ASP 22 N 8.86 0.00 -0.41 -4.21 3.32 -1.89 -2.26 116.42 119.84 1b3c h ASP 22 Ca 0.31 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.44 1b3c h ASP 22 Cb 0.95 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.41 1b3c h ASP 22 CO 1.44 0.00 -0.21 0.15 -1.72 0.00 0.00 179.24 178.91 1b3c h PHE 23 N 0.00 -0.52 0.66 4.55 3.57 -1.96 0.36 116.94 123.61 1b3c h PHE 23 Ca 0.13 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 1b3c h PHE 23 Cb 0.75 0.29 0.01 0.00 2.79 0.00 0.00 35.95 39.79 1b3c h PHE 23 CO 0.00 -0.29 -0.32 0.00 -2.23 0.00 0.00 178.31 175.47 1b3c h ASN 25 N -1.19 -0.74 -0.54 0.00 -1.24 -1.52 1.14 115.58 111.48 1b3c h ASN 25 Ca -0.09 0.23 0.11 0.00 0.71 0.00 0.00 56.30 57.25 1b3c h ASN 25 Cb 0.71 0.48 -0.09 0.00 0.73 0.00 0.00 38.32 40.15 1b3c h ASN 25 CO 0.15 -0.25 0.00 -0.09 -1.29 0.00 0.00 177.43 175.95 1b3c h ARG 26 N -0.01 0.12 0.00 6.67 2.43 -0.25 0.52 114.38 123.86 1b3c h ARG 26 Ca 0.35 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.41 1b3c h ARG 26 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1b3c h ARG 26 CO -0.77 0.08 -0.50 1.49 -1.51 0.00 0.00 179.97 178.75 1b3c h GLU 27 N 0.12 0.00 0.00 0.20 4.81 -0.15 -3.04 114.58 116.52 1b3c h GLU 27 Ca 0.28 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 1b3c h GLU 27 Cb 0.42 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1b3c h GLU 27 CO -0.45 0.50 -0.07 0.00 -0.73 0.00 0.00 179.01 178.26 1b3c n LYS 29 N -3.31 2.08 0.00 0.00 -0.00 -0.60 -4.71 118.16 111.62 1b3c n LYS 29 Ca -0.01 -1.93 0.00 0.00 -0.00 0.00 0.00 58.31 56.37 1b3c n LYS 29 Cb 0.25 -1.85 0.00 0.00 -0.00 0.00 0.00 35.03 33.43 1b3c n LYS 29 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.40 178.31 1b3c n TRP 30 N 0.54 -1.77 0.03 5.58 5.03 -1.10 -4.85 117.44 120.90 1b3c n TRP 30 Ca 0.39 0.00 -0.01 0.00 3.03 0.00 0.00 57.50 60.90 1b3c n TRP 30 Cb 0.58 0.00 0.26 0.00 -1.03 0.00 0.00 31.31 31.11 1b3c n TRP 30 CO 0.00 0.00 0.00 1.57 -0.03 0.00 0.00 177.69 179.23 1b3c h LYS 31 N 0.00 0.45 -0.90 -0.99 2.10 -1.92 -3.41 116.57 111.89 1b3c h LYS 31 Ca 0.00 -0.14 -0.03 0.00 -2.00 0.00 0.00 60.65 58.49 1b3c h LYS 31 Cb 0.00 -0.04 -0.19 0.00 -0.90 0.00 0.00 32.23 31.10 1b3c h LYS 31 CO 0.00 0.60 -0.40 -1.58 -2.00 0.00 0.00 179.45 176.07 1b3c s HIS 32 N -4.66 -1.59 0.00 0.07 5.04 -1.26 -5.01 115.29 107.88 1b3c s HIS 32 Ca -0.07 0.32 0.00 0.00 -1.54 0.00 0.00 55.06 53.78 1b3c s HIS 32 Cb 0.15 0.29 0.00 0.00 0.04 0.00 0.00 32.58 33.05 1b3c s HIS 32 CO 0.77 -1.06 0.00 1.51 -2.34 0.00 0.00 174.74 173.63 1b3c n ILE 33 N 4.45 0.00 -1.14 0.89 0.13 -1.26 -5.09 119.36 117.34 1b3c n ILE 33 Ca 0.10 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.75 1b3c n ILE 33 Cb 0.57 -0.49 0.00 0.00 -0.84 0.00 0.00 39.64 38.89 1b3c n ILE 33 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1b3c n GLY 34 N 3.16 -0.26 3.09 4.50 0.00 -1.26 -4.65 105.19 109.77 1b3c n GLY 34 Ca 0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.11 -0.06 -0.03 -0.02 0.00 -1.25 -2.91 107.32 101.94 1b3c s GLY 35 Ca 0.00 0.22 -0.04 0.00 0.00 0.00 0.00 44.72 44.90 1b3c s GLY 35 CO 0.00 0.11 -0.07 -1.14 0.00 0.00 0.00 173.10 172.00 1b3c n SER 36 N 2.21 0.47 -4.84 1.64 3.41 0.19 -4.97 113.62 111.74 1b3c n SER 36 Ca -0.18 0.08 -0.37 0.00 -0.26 0.00 0.00 58.87 58.14 1b3c n SER 36 Cb 0.57 -0.44 -0.06 0.00 -0.26 0.00 0.00 64.21 64.02 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 -1.46 3.69 -0.18 7.33 5.04 -1.25 -4.91 117.35 125.62 1b3c s TYR 37 Ca -0.06 0.93 -0.08 0.00 -2.44 0.00 0.00 57.07 55.43 1b3c s TYR 37 Cb 0.01 -2.25 0.07 0.00 0.35 0.00 0.00 41.96 40.15 1b3c s TYR 37 CO 0.09 0.62 0.40 0.20 -1.34 0.00 0.00 175.55 175.52 1b3c s GLY 38 N -1.22 -0.32 0.32 8.97 0.00 -1.26 -0.61 107.32 113.19 1b3c s GLY 38 Ca 0.25 1.45 -0.18 0.00 0.00 0.00 0.00 44.72 46.25 1b3c s GLY 38 CO 0.14 2.06 0.83 -2.52 0.00 0.00 0.00 173.10 173.61 1b3c s TYR 39 N 2.09 0.04 -0.16 1.90 1.13 -0.17 -3.95 117.35 118.22 1b3c s TYR 39 Ca -0.05 -0.60 -0.11 0.00 -1.41 0.00 0.00 57.07 54.89 1b3c s TYR 39 Cb -0.11 0.78 -0.05 0.00 -1.10 0.00 0.00 41.96 41.49 1b3c s TYR 39 CO -0.12 -1.36 0.22 0.00 -2.51 0.00 0.00 175.55 171.78 1b3c s TYR 41 N 0.09 0.80 -0.89 0.00 6.14 -0.84 -1.41 117.35 121.24 1b3c s TYR 41 Ca 0.14 -0.26 -0.02 0.00 0.64 0.00 0.00 57.07 57.58 1b3c s TYR 41 Cb -0.12 -0.83 0.00 0.00 0.42 0.00 0.00 41.96 41.43 1b3c s TYR 41 CO 0.03 -0.32 0.22 0.41 0.64 0.00 0.00 175.55 176.53 1b3c n GLY 42 N 4.87 -0.01 2.89 8.97 0.00 -1.26 -3.79 105.19 116.85 1b3c n GLY 42 Ca -0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.96 -2.74 0.00 1.61 3.72 -1.26 -4.99 117.46 109.84 1b3c n PHE 43 Ca -0.09 1.05 0.00 0.00 -0.05 0.00 0.00 57.45 58.37 1b3c n PHE 43 Cb 0.58 -3.86 0.00 0.00 -0.94 0.00 0.00 39.48 35.26 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 -1.55 1.37 3.66 1.37 0.00 -1.25 -4.13 105.19 104.67 1b3c n GLY 44 Ca 0.01 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 3.86 2.36 0.04 0.00 5.04 0.90 -3.52 117.35 126.02 1b3c s TYR 46 Ca 0.68 -0.36 -0.09 0.00 -2.44 0.00 0.00 57.07 54.86 1b3c s TYR 46 Cb -0.30 -1.29 0.00 0.00 0.35 0.00 0.00 41.96 40.73 1b3c s TYR 46 CO 0.25 0.32 0.18 0.00 -1.34 0.00 0.00 175.55 174.96 1b3c s GLU 48 N -2.62 1.31 0.00 0.00 2.02 0.22 -0.40 118.70 119.23 1b3c s GLU 48 Ca -0.05 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.60 1b3c s GLU 48 Cb -0.01 -1.61 0.00 0.00 0.10 0.00 0.00 34.13 32.61 1b3c s GLU 48 CO -0.04 0.36 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1b3c n GLY 49 N 0.70 1.20 3.52 -1.39 0.00 0.11 0.57 105.19 109.89 1b3c n GLY 49 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 4.39 1.09 0.99 2.01 -1.15 -3.95 118.68 122.07 1b3c s LEU 50 Ca 0.00 -0.30 -0.12 0.00 0.01 0.00 0.00 54.13 53.72 1b3c s LEU 50 Cb 0.00 -2.82 0.23 0.00 0.01 0.00 0.00 46.19 43.61 1b3c s LEU 50 CO 0.00 -0.90 0.97 -0.81 1.01 0.00 0.00 176.35 176.61 1b3c n PRO 51 N 6.60 -1.76 0.03 1.29 -0.04 -1.26 -4.81 135.00 135.05 1b3c n PRO 51 Ca 0.00 -0.47 -0.10 0.00 -0.04 0.00 0.00 63.50 62.89 1b3c n PRO 51 Cb 0.48 -2.19 -0.04 0.00 -0.04 0.00 0.00 33.50 31.70 1b3c n PRO 51 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1b3c h ASP 52 N -2.39 -0.31 -0.01 3.54 3.58 -2.00 -0.25 116.42 118.58 1b3c h ASP 52 Ca -0.55 0.05 0.00 0.00 0.42 0.00 0.00 57.03 56.96 1b3c h ASP 52 Cb 1.31 0.14 -0.00 0.00 1.72 0.00 0.00 39.33 42.51 1b3c h ASP 52 CO 0.45 -0.14 0.41 0.28 -2.88 0.00 0.00 179.24 177.36 1b3c h SER 53 N -0.15 0.00 -3.85 2.28 0.02 -2.01 -3.41 113.55 106.43 1b3c h SER 53 Ca 0.06 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.50 1b3c h SER 53 Cb 0.23 0.00 0.04 0.00 0.14 0.00 0.00 62.40 62.81 1b3c h SER 53 CO -0.14 0.00 0.53 -0.89 -1.14 0.00 0.00 176.83 175.19 1b3c s THR 54 N -4.10 3.20 -0.01 -2.27 2.01 -0.11 -5.01 115.64 109.35 1b3c s THR 54 Ca -0.03 1.18 -0.14 0.00 0.31 0.00 0.00 61.69 63.02 1b3c s THR 54 Cb 0.08 -3.74 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 1b3c s THR 54 CO 0.25 0.26 0.38 -1.58 -0.69 0.00 0.00 174.62 173.25 1b3c s GLN 55 N -1.67 3.87 0.24 4.92 0.74 -1.26 -4.90 119.66 121.59 1b3c s GLN 55 Ca 0.48 0.36 -0.13 0.00 0.05 0.00 0.00 55.36 56.12 1b3c s GLN 55 Cb -0.34 -3.21 -0.00 0.00 1.10 0.00 0.00 33.01 30.55 1b3c s GLN 55 CO 0.44 0.70 0.47 -0.08 -0.55 0.00 0.00 175.29 176.28 1b3c s THR 56 N -1.08 0.01 0.48 -0.34 -1.32 -1.26 -4.85 115.64 107.28 1b3c s THR 56 Ca 0.23 -1.36 -0.22 0.00 -1.21 0.00 0.00 61.69 59.13 1b3c s THR 56 Cb -0.16 -2.14 -0.07 0.00 -1.51 0.00 0.00 72.50 68.62 1b3c s THR 56 CO 0.13 -0.03 1.18 0.86 -2.21 0.00 0.00 174.62 174.56 1b3c s TRP 57 N -4.00 2.77 1.02 9.09 -0.00 0.23 -4.11 118.94 123.93 1b3c s TRP 57 Ca 0.21 1.52 -0.17 0.00 -0.00 0.00 0.00 56.10 57.66 1b3c s TRP 57 Cb -0.01 -3.42 0.23 0.00 -0.00 0.00 0.00 33.47 30.27 1b3c s TRP 57 CO 0.08 -1.70 1.31 -1.25 -0.00 0.00 0.00 176.95 175.38 1b3c s PRO 58 N -2.81 0.14 0.51 5.86 0.04 -1.26 -4.49 135.00 132.99 1b3c s PRO 58 Ca 0.66 -0.43 0.02 0.00 0.04 0.00 0.00 61.00 61.29 1b3c s PRO 58 Cb -0.29 -1.79 0.02 0.00 0.04 0.00 0.00 34.50 32.48 1b3c s PRO 58 CO 0.35 -2.75 0.73 -0.51 0.04 0.00 0.00 177.00 174.86 1b3c s LEU 59 N -6.11 3.41 0.00 -3.56 1.43 -1.26 -5.09 118.68 107.50 1b3c s LEU 59 Ca 0.75 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1b3c s LEU 59 Cb -0.04 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.27 1b3c s LEU 59 CO 0.54 -0.99 0.00 -2.65 0.23 0.00 0.00 176.35 173.47 1b3c n PRO 60 N -2.22 1.36 -0.27 1.29 -0.02 -1.26 -4.52 135.00 129.36 1b3c n PRO 60 Ca 0.06 0.00 0.30 0.00 -2.02 0.00 0.00 63.50 61.85 1b3c n PRO 60 Cb 0.59 0.00 0.70 0.00 -0.02 0.00 0.00 33.50 34.77 1b3c n PRO 60 CO 0.00 0.00 0.00 -2.95 1.98 0.00 0.00 175.50 174.53 1b3c h ASN 61 N -0.21 0.09 -1.02 2.55 7.08 -2.06 -2.98 115.58 119.03 1b3c h ASN 61 Ca 0.00 0.02 -0.74 0.00 -3.08 0.00 0.00 56.30 52.49 1b3c h ASN 61 Cb 0.00 0.00 -0.12 0.00 -2.08 0.00 0.00 38.32 36.12 1b3c h ASN 61 CO 0.00 0.02 2.31 1.17 -2.08 0.00 0.00 177.43 178.85 1b3c n LYS 62 N -4.29 3.38 -0.20 4.14 4.81 -1.26 -4.98 118.16 119.76 1b3c n LYS 62 Ca 0.23 -3.28 -0.05 0.00 -0.87 0.00 0.00 58.31 54.34 1b3c n LYS 62 Cb 1.07 -3.05 0.04 0.00 0.02 0.00 0.00 35.03 33.12 1b3c n LYS 62 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1b3c n THR 63 N 3.98 0.00 1.63 3.15 -1.04 -1.13 -4.84 114.28 116.04 1b3c n THR 63 Ca 0.43 -0.09 0.15 0.00 -2.04 0.00 0.00 64.05 62.50 1b3c n THR 63 Cb 0.38 -1.10 0.64 0.00 -1.82 0.00 0.00 70.33 68.43 1b3c n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43