#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 5.18 0.07 -5.58 1.11 -1.26 0.25 116.67 116.43 1b3c s ASP 2 Ca 0.00 0.13 -0.03 0.00 0.18 0.00 0.00 52.55 52.83 1b3c s ASP 2 Cb 0.00 -1.45 0.01 0.00 1.07 0.00 0.00 42.92 42.55 1b3c s ASP 2 CO 0.00 0.37 0.15 0.61 1.18 0.00 0.00 175.17 177.49 1b3c n GLY 3 N 2.17 1.71 3.46 0.21 0.00 -0.83 -5.02 105.19 106.90 1b3c n GLY 3 Ca -0.19 -1.04 -0.27 0.00 0.00 0.00 0.00 46.02 44.52 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 -7.38 2.40 -0.10 1.61 2.02 -1.26 -1.89 117.35 112.75 1b3c s TYR 4 Ca 0.03 -0.32 -0.10 0.00 -0.37 0.00 0.00 57.07 56.31 1b3c s TYR 4 Cb -0.01 -1.20 -0.05 0.00 -0.40 0.00 0.00 41.96 40.30 1b3c s TYR 4 CO 0.02 0.48 0.22 -0.51 -1.57 0.00 0.00 175.55 174.19 1b3c s LEU 5 N -2.61 4.38 0.00 -1.29 1.43 -1.19 -0.17 118.68 119.23 1b3c s LEU 5 Ca 0.21 0.56 0.02 0.00 -1.03 0.00 0.00 54.13 53.90 1b3c s LEU 5 Cb -0.09 -2.22 0.08 0.00 0.03 0.00 0.00 46.19 43.99 1b3c s LEU 5 CO 0.11 0.33 0.59 1.33 0.23 0.00 0.00 176.35 178.94 1b3c n VAL 6 N 2.27 0.00 -4.47 -1.59 0.24 -1.26 -4.19 118.33 109.33 1b3c n VAL 6 Ca -0.17 -1.10 -0.30 0.00 -2.04 0.00 0.00 64.34 60.72 1b3c n VAL 6 Cb 0.54 -0.92 -0.06 0.00 -1.47 0.00 0.00 33.84 31.93 1b3c n VAL 6 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1b3c s GLU 7 N -3.95 2.20 0.20 7.34 0.41 0.76 -4.89 118.70 120.76 1b3c s GLU 7 Ca 0.41 -2.24 -0.22 0.00 -0.41 0.00 0.00 54.97 52.51 1b3c s GLU 7 Cb -0.03 -1.72 0.13 0.00 -1.78 0.00 0.00 34.13 30.73 1b3c s GLU 7 CO 0.27 -0.40 1.57 -0.22 -0.49 0.00 0.00 175.26 175.99 1b3c h LYS 8 N 1.21 -0.11 -0.01 1.61 1.63 -1.98 0.33 116.57 119.26 1b3c h LYS 8 Ca -0.42 0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 59.26 1b3c h LYS 8 Cb 1.30 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.94 1b3c h LYS 8 CO 0.70 -0.07 -0.58 1.79 -3.45 0.00 0.00 179.45 177.84 1b3c h THR 9 N -0.11 1.41 0.00 1.00 1.35 -2.01 -3.47 112.91 111.08 1b3c h THR 9 Ca 0.25 -1.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.14 1b3c h THR 9 Cb 0.56 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1b3c h THR 9 CO -0.81 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 175.64 1b3c n GLY 10 N 0.14 1.61 1.19 5.82 0.00 0.12 -4.68 105.19 109.39 1b3c n GLY 10 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.64 1.38 -3.66 0.00 5.02 -1.26 -0.17 118.16 116.83 1b3c n LYS 12 Ca 0.04 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.06 1b3c n LYS 12 Cb 0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.10 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 -0.74 1.78 -0.68 1.97 5.02 -1.26 -4.67 118.16 119.58 1b3c n LYS 13 Ca 0.00 -4.31 -0.31 0.00 -2.02 0.00 0.00 58.31 51.66 1b3c n LYS 13 Cb 0.00 -2.14 0.17 0.00 -0.02 0.00 0.00 35.03 33.04 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 1.70 0.00 -3.65 -0.18 -1.04 -1.26 -2.68 114.28 107.18 1b3c n THR 14 Ca 0.24 -0.12 -0.06 0.00 -2.04 0.00 0.00 64.05 62.07 1b3c n THR 14 Cb 0.39 -0.88 -0.07 0.00 -1.82 0.00 0.00 70.33 67.95 1b3c n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b3c h TYR 16 N 7.18 0.09 0.00 0.00 0.05 -1.99 -3.33 116.97 118.97 1b3c h TYR 16 Ca -0.28 -0.03 -0.65 0.00 0.05 0.00 0.00 58.73 57.82 1b3c h TYR 16 Cb 1.21 -0.02 0.01 0.00 1.01 0.00 0.00 36.73 38.93 1b3c h TYR 16 CO 0.08 0.56 2.84 1.63 -1.05 0.00 0.00 178.16 182.22 1b3c n LYS 17 N -4.79 2.35 -0.61 4.88 4.76 -1.26 -4.94 118.16 118.55 1b3c n LYS 17 Ca -0.08 -2.17 -0.29 0.00 -2.87 0.00 0.00 58.31 52.90 1b3c n LYS 17 Cb 0.28 -3.02 0.26 0.00 -1.84 0.00 0.00 35.03 30.71 1b3c n LYS 17 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1b3c s LEU 18 N 1.41 0.11 0.00 -0.35 1.43 -1.25 -4.44 118.68 115.59 1b3c s LEU 18 Ca 0.52 1.10 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 1b3c s LEU 18 Cb 0.14 -2.82 0.00 0.00 0.03 0.00 0.00 46.19 43.54 1b3c s LEU 18 CO -0.00 -4.56 0.00 0.61 0.23 0.00 0.00 176.35 172.63 1b3c n GLY 19 N 0.60 -1.03 3.21 -3.19 0.00 -0.67 -4.59 105.19 99.52 1b3c n GLY 19 Ca 0.08 -1.84 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 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 0.31 -2.46 1.61 0.28 -1.26 -2.88 120.64 116.24 1b3c n GLU 20 Ca 0.00 -0.94 -0.39 0.00 -0.16 0.00 0.00 57.16 55.67 1b3c n GLU 20 Cb 0.00 -2.36 -0.03 0.00 1.43 0.00 0.00 31.44 30.47 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 5.81 6.18 0.24 -1.84 3.84 -1.26 -4.84 114.94 123.07 1b3c s ASN 21 Ca 0.41 -1.06 -0.05 0.00 0.21 0.00 0.00 52.86 52.37 1b3c s ASN 21 Cb 0.09 -2.56 0.45 0.00 -0.55 0.00 0.00 41.25 38.68 1b3c s ASN 21 CO 0.17 -1.79 1.70 -0.78 -2.79 0.00 0.00 177.10 173.61 1b3c h ASP 22 N 10.30 0.10 0.16 -4.21 3.58 -1.93 0.37 116.42 124.78 1b3c h ASP 22 Ca 0.07 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.65 1b3c h ASP 22 Cb 1.02 0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.21 1b3c h ASP 22 CO 1.36 0.01 -0.32 0.15 -2.88 0.00 0.00 179.24 177.56 1b3c h PHE 23 N 0.32 -0.91 -0.91 0.28 3.57 -1.97 0.41 116.94 117.73 1b3c h PHE 23 Ca 0.41 0.02 0.21 0.00 3.53 0.00 0.00 57.97 62.14 1b3c h PHE 23 Cb 0.67 0.37 -0.07 0.00 2.79 0.00 0.00 35.95 39.72 1b3c h PHE 23 CO -0.23 -0.38 0.60 0.00 -2.23 0.00 0.00 178.31 176.07 1b3c h ASN 25 N 0.39 0.00 -0.35 0.00 -0.73 0.63 0.42 115.58 115.94 1b3c h ASN 25 Ca 0.47 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.55 1b3c h ASN 25 Cb 1.21 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.79 1b3c h ASN 25 CO -0.18 0.41 -0.16 0.03 -0.37 0.00 0.00 177.43 177.16 1b3c h ARG 26 N 0.00 0.72 0.06 6.67 3.08 0.46 -0.51 114.38 124.86 1b3c h ARG 26 Ca -0.00 -0.32 -0.24 0.00 0.07 0.00 0.00 59.98 59.49 1b3c h ARG 26 Cb 0.78 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 1b3c h ARG 26 CO 0.05 0.92 -1.09 0.93 -1.07 0.00 0.00 179.97 179.71 1b3c h GLU 27 N 0.50 0.14 0.00 0.04 4.39 -1.30 -3.21 114.58 115.14 1b3c h GLU 27 Ca 0.08 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.55 1b3c h GLU 27 Cb 0.70 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 1b3c h GLU 27 CO 0.05 1.09 0.00 0.00 -1.16 0.00 0.00 179.01 178.99 1b3c h LYS 29 N 0.00 -0.96 -3.17 0.00 3.64 -1.08 -3.48 116.57 111.52 1b3c h LYS 29 Ca 0.00 0.07 0.30 0.00 -1.27 0.00 0.00 60.65 59.74 1b3c h LYS 29 Cb 0.76 0.22 -0.16 0.00 -0.41 0.00 0.00 32.23 32.63 1b3c h LYS 29 CO 0.00 -0.64 -1.09 0.91 -2.27 0.00 0.00 179.45 176.36 1b3c n TRP 30 N -4.70 -3.30 -4.54 1.91 5.03 -1.25 -4.62 117.44 105.97 1b3c n TRP 30 Ca -0.12 1.83 -0.27 0.00 3.03 0.00 0.00 57.50 61.96 1b3c n TRP 30 Cb 0.39 -3.01 -0.10 0.00 -1.03 0.00 0.00 31.31 27.56 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 -4.47 1.96 -1.46 -0.99 1.02 -1.26 -4.70 119.74 109.84 1b3c s LYS 31 Ca 0.00 -2.02 -0.07 0.00 0.02 0.00 0.00 55.97 53.90 1b3c s LYS 31 Cb 0.00 -1.71 0.03 0.00 -0.52 0.00 0.00 37.83 35.64 1b3c s LYS 31 CO 0.00 0.00 0.64 0.72 -0.92 0.00 0.00 175.35 175.79 1b3c n HIS 32 N -0.95 -2.01 0.00 3.18 8.25 -1.26 -4.78 115.22 117.65 1b3c n HIS 32 Ca -0.05 0.57 0.00 0.00 -0.26 0.00 0.00 57.72 57.98 1b3c n HIS 32 Cb 0.66 -4.04 0.00 0.00 1.12 0.00 0.00 29.99 27.73 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 -4.39 0.00 0.00 1.59 5.41 -1.26 -5.11 119.36 115.59 1b3c n ILE 33 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.69 1b3c n ILE 33 Cb 0.59 -0.28 0.00 0.00 -0.71 0.00 0.00 39.64 39.24 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 1.78 0.59 3.41 7.39 0.00 -1.26 -4.41 105.19 112.69 1b3c n GLY 34 Ca 0.00 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 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 1.51 -0.05 -0.02 0.00 -1.26 -2.90 107.32 104.60 1b3c s GLY 35 Ca 0.00 -1.25 -0.04 0.00 0.00 0.00 0.00 44.72 43.44 1b3c s GLY 35 CO 0.00 -1.15 -0.09 -1.14 0.00 0.00 0.00 173.10 170.73 1b3c n SER 36 N 1.56 0.59 -3.51 1.64 3.41 -1.11 -4.99 113.62 111.21 1b3c n SER 36 Ca -0.17 0.10 -0.16 0.00 -0.26 0.00 0.00 58.87 58.38 1b3c n SER 36 Cb 0.52 -0.23 -0.12 0.00 -0.26 0.00 0.00 64.21 64.12 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 -2.14 -0.36 -0.28 7.33 6.14 -1.19 -5.03 117.35 121.82 1b3c s TYR 37 Ca -0.09 0.44 0.03 0.00 0.64 0.00 0.00 57.07 58.09 1b3c s TYR 37 Cb 0.03 -0.26 0.07 0.00 0.42 0.00 0.00 41.96 42.23 1b3c s TYR 37 CO 0.12 -0.56 -0.05 0.20 0.64 0.00 0.00 175.55 175.90 1b3c s GLY 38 N 2.37 1.66 0.39 8.97 0.00 -1.26 -1.37 107.32 118.08 1b3c s GLY 38 Ca 0.06 -1.92 0.05 0.00 0.00 0.00 0.00 44.72 42.92 1b3c s GLY 38 CO -0.12 0.79 0.03 -2.52 0.00 0.00 0.00 173.10 171.29 1b3c s TYR 39 N 1.11 2.28 0.05 1.90 1.13 -0.23 -3.63 117.35 119.96 1b3c s TYR 39 Ca -0.02 -0.80 -0.19 0.00 -1.41 0.00 0.00 57.07 54.65 1b3c s TYR 39 Cb -0.19 -1.59 -0.06 0.00 -1.10 0.00 0.00 41.96 39.01 1b3c s TYR 39 CO -0.07 0.27 0.55 0.00 -2.51 0.00 0.00 175.55 173.79 1b3c s TYR 41 N -0.95 -0.29 -1.07 0.00 5.04 0.56 -1.66 117.35 118.98 1b3c s TYR 41 Ca 0.28 0.71 -0.17 0.00 -2.44 0.00 0.00 57.07 55.45 1b3c s TYR 41 Cb -0.19 0.10 -0.01 0.00 0.35 0.00 0.00 41.96 42.21 1b3c s TYR 41 CO 0.18 -0.14 0.77 0.41 -1.34 0.00 0.00 175.55 175.43 1b3c n GLY 42 N 2.95 -1.05 3.63 8.97 0.00 -1.26 -3.07 105.19 115.36 1b3c n GLY 42 Ca -0.13 0.48 -0.31 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 -3.79 -2.39 0.00 1.61 3.01 -1.26 -4.93 117.46 109.71 1b3c n PHE 43 Ca -0.10 0.99 0.00 0.00 1.01 0.00 0.00 57.45 59.35 1b3c n PHE 43 Cb 0.59 -2.37 0.00 0.00 -0.01 0.00 0.00 39.48 37.69 1b3c n PHE 43 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1b3c n GLY 44 N -0.96 2.53 3.65 1.37 0.00 -1.18 -4.18 105.19 106.44 1b3c n GLY 44 Ca -0.20 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.60 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 1.64 2.96 -0.08 0.00 5.04 0.13 -3.15 117.35 123.90 1b3c s TYR 46 Ca 0.21 -0.60 0.02 0.00 -2.44 0.00 0.00 57.07 54.26 1b3c s TYR 46 Cb -0.15 -2.01 -0.02 0.00 0.35 0.00 0.00 41.96 40.13 1b3c s TYR 46 CO 0.09 -0.28 -0.15 0.00 -1.34 0.00 0.00 175.55 173.88 1b3c s GLU 48 N -0.24 3.33 0.00 0.00 2.02 -0.47 -1.97 118.70 121.36 1b3c s GLU 48 Ca 0.01 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.33 1b3c s GLU 48 Cb -0.13 -2.64 0.00 0.00 0.10 0.00 0.00 34.13 31.46 1b3c s GLU 48 CO 0.03 0.26 0.00 0.41 0.02 0.00 0.00 175.26 175.98 1b3c n GLY 49 N 3.39 3.15 3.53 -1.39 0.00 0.14 -2.73 105.19 111.27 1b3c n GLY 49 Ca -0.18 -1.02 -0.53 0.00 0.00 0.00 0.00 46.02 44.29 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 0.63 -4.77 0.99 -0.00 -1.14 -3.66 117.00 109.06 1b3c n LEU 50 Ca 0.00 1.14 -0.35 0.00 -0.00 0.00 0.00 56.01 56.80 1b3c n LEU 50 Cb 0.00 -1.07 0.02 0.00 -0.00 0.00 0.00 43.42 42.37 1b3c n LEU 50 CO 0.00 -1.68 0.79 -2.16 -0.00 0.00 0.00 177.39 174.34 1b3c s PRO 51 N -0.13 3.16 0.63 1.47 0.04 -1.26 -3.32 135.00 135.59 1b3c s PRO 51 Ca 0.81 1.64 0.30 0.00 0.04 0.00 0.00 61.00 63.78 1b3c s PRO 51 Cb -1.04 -1.98 1.62 0.00 0.04 0.00 0.00 34.50 33.15 1b3c s PRO 51 CO 0.53 -1.01 1.91 0.22 0.04 0.00 0.00 177.00 178.68 1b3c h ASP 52 N 0.92 0.00 -0.24 6.66 1.82 -1.95 -1.98 116.42 121.65 1b3c h ASP 52 Ca -0.50 0.00 0.05 0.00 -0.39 0.00 0.00 57.03 56.20 1b3c h ASP 52 Cb 1.27 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 41.23 1b3c h ASP 52 CO 0.56 0.00 -0.08 -1.28 -1.61 0.00 0.00 179.24 176.82 1b3c h SER 53 N 0.00 -0.29 -3.92 2.28 0.87 -2.00 -3.42 113.55 107.06 1b3c h SER 53 Ca 0.00 0.08 -0.55 0.00 -1.23 0.00 0.00 61.79 60.09 1b3c h SER 53 Cb 0.59 0.18 0.18 0.00 -0.44 0.00 0.00 62.40 62.91 1b3c h SER 53 CO 0.00 -0.11 0.20 0.41 -0.53 0.00 0.00 176.83 176.80 1b3c n THR 54 N -5.25 2.81 -2.51 2.23 -1.04 -0.75 -4.92 114.28 104.85 1b3c n THR 54 Ca -0.01 -0.34 -0.41 0.00 -2.04 0.00 0.00 64.05 61.24 1b3c n THR 54 Cb 0.17 -1.17 -0.04 0.00 -1.82 0.00 0.00 70.33 67.48 1b3c n THR 54 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1b3c s GLN 55 N -3.56 4.54 0.01 -2.82 -1.52 -1.26 -5.00 119.66 110.05 1b3c s GLN 55 Ca 0.74 1.69 0.00 0.00 -1.95 0.00 0.00 55.36 55.84 1b3c s GLN 55 Cb -0.33 -3.33 -0.01 0.00 -0.22 0.00 0.00 33.01 29.12 1b3c s GLN 55 CO 0.50 -0.05 -0.02 0.95 -0.25 0.00 0.00 175.29 176.42 1b3c s THR 56 N 0.35 0.09 0.61 -0.19 -4.23 -1.26 -4.32 115.64 106.68 1b3c s THR 56 Ca 0.53 -0.43 -0.19 0.00 -1.18 0.00 0.00 61.69 60.41 1b3c s THR 56 Cb -0.28 -0.16 -0.03 0.00 1.34 0.00 0.00 72.50 73.38 1b3c s THR 56 CO 0.32 -0.22 1.29 0.86 -0.54 0.00 0.00 174.62 176.33 1b3c s TRP 57 N -0.67 2.21 0.88 3.99 -0.00 0.76 -4.31 118.94 121.81 1b3c s TRP 57 Ca -0.07 1.46 -0.15 0.00 -0.00 0.00 0.00 56.10 57.35 1b3c s TRP 57 Cb -0.05 -3.67 0.22 0.00 -0.00 0.00 0.00 33.47 29.97 1b3c s TRP 57 CO -0.00 -2.75 0.88 -0.35 -0.00 0.00 0.00 176.95 174.73 1b3c n PRO 58 N -1.60 -2.20 -2.68 5.86 -0.04 -1.26 -4.31 135.00 128.77 1b3c n PRO 58 Ca 0.14 -1.39 -0.22 0.00 -0.04 0.00 0.00 63.50 61.99 1b3c n PRO 58 Cb 0.48 -1.19 0.07 0.00 -0.04 0.00 0.00 33.50 32.82 1b3c n PRO 58 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1b3c s LEU 59 N 0.00 3.14 0.00 1.53 1.02 -1.26 -5.03 118.68 118.08 1b3c s LEU 59 Ca 0.55 -0.29 0.00 0.00 0.02 0.00 0.00 54.13 54.41 1b3c s LEU 59 Cb -0.04 -2.32 0.00 0.00 0.02 0.00 0.00 46.19 43.85 1b3c s LEU 59 CO 0.41 -1.46 0.00 -2.65 0.02 0.00 0.00 176.35 172.67 1b3c n PRO 60 N -2.52 1.50 0.33 1.29 -0.02 -1.26 -4.42 135.00 129.90 1b3c n PRO 60 Ca 0.12 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.73 1b3c n PRO 60 Cb 0.60 0.00 0.70 0.00 -0.02 0.00 0.00 33.50 34.78 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 -0.00 0.00 -2.77 2.55 -0.00 -2.05 -2.93 115.58 110.37 1b3c h ASN 61 Ca 0.00 0.00 -0.72 0.00 -0.00 0.00 0.00 56.30 55.58 1b3c h ASN 61 Cb 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 38.32 37.98 1b3c h ASN 61 CO 0.00 0.00 0.13 1.17 -0.00 0.00 0.00 177.43 178.73 1b3c n LYS 62 N -2.85 3.43 0.00 6.67 3.00 -1.26 -5.05 118.16 122.10 1b3c n LYS 62 Ca -0.01 -4.58 0.00 0.00 -0.00 0.00 0.00 58.31 53.72 1b3c n LYS 62 Cb 0.48 -2.41 0.00 0.00 0.00 0.00 0.00 35.03 33.10 1b3c n LYS 62 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1b3c n THR 63 N 1.40 0.00 1.48 3.15 5.66 -1.11 -4.84 114.28 120.02 1b3c n THR 63 Ca 0.26 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.40 1b3c n THR 63 Cb 0.37 -1.17 0.51 0.00 -1.55 0.00 0.00 70.33 68.49 1b3c n THR 63 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02