#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3o n GLY 15 N 0.00 -0.14 2.44 0.46 0.00 -1.26 -5.09 105.19 101.60 1u3o n GLY 15 Ca 0.00 0.71 -0.20 0.00 0.00 0.00 0.00 46.02 46.54 1u3o n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u3o n GLY 16 N 0.00 3.96 2.90 -0.02 0.00 -1.26 -5.06 105.19 105.71 1u3o n GLY 16 Ca 0.00 -1.96 -0.20 0.00 0.00 0.00 0.00 46.02 43.86 1u3o n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3o s GLU 18 N 0.89 0.97 0.16 0.00 2.12 -0.99 -4.96 118.70 116.90 1u3o s GLU 18 Ca -0.11 -0.97 -0.30 0.00 0.36 0.00 0.00 54.97 53.94 1u3o s GLU 18 Cb -0.14 -1.06 -0.07 0.00 0.26 0.00 0.00 34.13 33.11 1u3o s GLU 18 CO 0.00 0.25 1.03 -0.51 -0.54 0.00 0.00 175.26 175.49 1u3o s LEU 19 N -1.62 4.51 0.03 2.70 1.43 -1.26 0.17 118.68 124.64 1u3o s LEU 19 Ca 0.02 1.97 -0.00 0.00 -1.03 0.00 0.00 54.13 55.08 1u3o s LEU 19 Cb -0.09 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 1u3o s LEU 19 CO 0.03 -0.11 -0.03 -0.89 0.23 0.00 0.00 176.35 175.57 1u3o s THR 20 N -0.29 0.16 -0.15 5.49 2.01 0.20 -4.74 115.64 118.32 1u3o s THR 20 Ca 0.47 -1.22 0.01 0.00 0.31 0.00 0.00 61.69 61.26 1u3o s THR 20 Cb -0.27 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.56 1u3o s THR 20 CO 0.33 -0.66 -0.18 0.68 -0.69 0.00 0.00 174.62 174.10 1u3o s VAL 21 N -2.29 1.82 0.11 3.82 -7.23 -1.26 0.11 120.40 115.49 1u3o s VAL 21 Ca -0.08 -0.80 -0.31 0.00 -1.81 0.00 0.00 61.98 58.98 1u3o s VAL 21 Cb -0.04 -1.66 -0.08 0.00 0.56 0.00 0.00 36.38 35.16 1u3o s VAL 21 CO -0.04 0.50 1.45 0.68 -0.31 0.00 0.00 175.10 177.38 1u3o s VAL 22 N 1.25 3.16 -0.20 1.32 -7.23 -1.08 -0.15 120.40 117.47 1u3o s VAL 22 Ca 0.02 0.81 0.16 0.00 -1.81 0.00 0.00 61.98 61.16 1u3o s VAL 22 Cb -0.14 -3.52 0.09 0.00 0.56 0.00 0.00 36.38 33.38 1u3o s VAL 22 CO -0.09 0.05 1.43 -0.07 -0.31 0.00 0.00 175.10 176.11 1u3o h LEU 23 N 7.04 0.00 -7.95 1.32 3.38 -0.98 -0.75 115.31 117.36 1u3o h LEU 23 Ca -0.42 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.41 1u3o h LEU 23 Cb 1.21 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.76 1u3o h LEU 23 CO 0.88 0.42 -0.61 0.00 0.09 0.00 0.00 178.44 179.23 1u3o s GLN 24 N -3.00 0.46 0.49 1.13 -2.07 -1.24 -4.70 119.66 110.72 1u3o s GLN 24 Ca 0.04 -0.70 -0.22 0.00 -1.82 0.00 0.00 55.36 52.66 1u3o s GLN 24 Cb 0.07 0.18 -0.07 0.00 -1.09 0.00 0.00 33.01 32.10 1u3o s GLN 24 CO 0.74 -0.10 1.19 -0.51 -1.32 0.00 0.00 175.29 175.29 1u3o s ASP 25 N -1.84 5.96 0.03 12.60 1.11 -1.26 -4.16 116.67 129.11 1u3o s ASP 25 Ca -0.10 2.37 -0.07 0.00 0.18 0.00 0.00 52.55 54.93 1u3o s ASP 25 Cb -0.05 -2.61 -0.00 0.00 1.07 0.00 0.00 42.92 41.33 1u3o s ASP 25 CO -0.03 -1.07 0.14 0.12 1.18 0.00 0.00 175.17 175.51 1u3o s PHE 26 N -1.53 0.12 -0.03 4.23 5.36 0.90 -4.91 117.98 122.12 1u3o s PHE 26 Ca 0.66 -0.34 0.04 0.00 -0.96 0.00 0.00 56.93 56.33 1u3o s PHE 26 Cb -0.30 -0.08 -0.01 0.00 -0.34 0.00 0.00 43.02 42.29 1u3o s PHE 26 CO 0.36 -0.37 -0.16 -1.54 -1.46 0.00 0.00 175.22 172.05 1u3o s SER 27 N -1.93 1.96 0.77 6.13 1.04 -1.26 0.12 113.70 120.53 1u3o s SER 27 Ca -0.07 -0.31 -0.07 0.00 0.48 0.00 0.00 55.95 55.98 1u3o s SER 27 Cb -0.03 -0.44 0.10 0.00 0.10 0.00 0.00 66.02 65.76 1u3o s SER 27 CO -0.03 0.16 0.23 0.00 0.98 0.00 0.00 173.24 174.58 1u3o n ALA 28 N 3.01 -1.42 0.00 5.32 0.00 -1.12 -4.82 120.51 121.47 1u3o n ALA 28 Ca -0.17 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1u3o n ALA 28 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1u3o n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u3o n ALA 29 N -3.06 0.00 -2.24 0.00 0.00 -1.26 -4.92 120.51 109.02 1u3o n ALA 29 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 1u3o n ALA 29 Cb 0.16 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.63 1u3o n ALA 29 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1u3o s HIS 30 N 0.00 1.55 0.00 0.00 5.04 -1.26 -5.01 115.29 115.61 1u3o s HIS 30 Ca 0.00 -0.79 0.00 0.00 -1.54 0.00 0.00 55.06 52.73 1u3o s HIS 30 Cb 0.00 -2.04 0.00 0.00 0.04 0.00 0.00 32.58 30.58 1u3o s HIS 30 CO 0.00 -0.75 0.78 -1.13 -2.34 0.00 0.00 174.74 171.30 1u3o n SER 31 N -1.96 0.00 -2.23 9.88 3.41 -1.26 -2.01 113.62 119.45 1u3o n SER 31 Ca 0.06 0.78 -0.24 0.00 -0.26 0.00 0.00 58.87 59.21 1u3o n SER 31 Cb 0.63 -0.28 -0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1u3o n SER 31 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1u3o n SER 32 N -1.99 6.62 -4.79 4.04 3.41 -1.26 -4.93 113.62 114.71 1u3o n SER 32 Ca 0.00 -3.22 -0.30 0.00 -0.26 0.00 0.00 58.87 55.09 1u3o n SER 32 Cb 0.00 -1.13 -0.06 0.00 -0.26 0.00 0.00 64.21 62.76 1u3o n SER 32 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1u3o s GLU 33 N -2.03 2.94 0.16 4.33 2.02 -0.85 -2.14 118.70 123.13 1u3o s GLU 33 Ca 0.47 -0.70 -0.11 0.00 0.02 0.00 0.00 54.97 54.66 1u3o s GLU 33 Cb 0.34 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.82 1u3o s GLU 33 CO -0.12 0.56 0.32 -0.48 0.02 0.00 0.00 175.26 175.56 1u3o s LEU 34 N -2.53 0.82 -0.06 1.80 0.05 -1.25 -4.66 118.68 112.85 1u3o s LEU 34 Ca 0.30 -0.74 -0.21 0.00 0.05 0.00 0.00 54.13 53.53 1u3o s LEU 34 Cb -0.12 1.39 -0.04 0.00 -2.05 0.00 0.00 46.19 45.37 1u3o s LEU 34 CO 0.23 -0.90 0.61 -0.94 -0.55 0.00 0.00 176.35 174.80 1u3o s SER 35 N -2.93 6.90 0.24 1.48 1.04 -1.26 -2.80 113.70 116.37 1u3o s SER 35 Ca 0.13 1.08 0.02 0.00 0.48 0.00 0.00 55.95 57.67 1u3o s SER 35 Cb 0.03 -2.37 -0.05 0.00 0.10 0.00 0.00 66.02 63.73 1u3o s SER 35 CO -0.02 -0.03 0.04 0.27 0.98 0.00 0.00 173.24 174.48 1u3o s ILE 36 N 0.51 0.76 0.19 -1.02 -5.25 0.32 -4.95 121.20 111.76 1u3o s ILE 36 Ca 0.33 -2.00 0.07 0.00 -0.99 0.00 0.00 60.65 58.06 1u3o s ILE 36 Cb -0.17 -2.45 -0.05 0.00 2.95 0.00 0.00 42.46 42.75 1u3o s ILE 36 CO 0.16 -0.20 -0.14 -1.10 -1.79 0.00 0.00 174.94 171.86 1u3o s GLN 37 N -3.95 1.28 -0.13 0.37 1.11 -1.26 -0.07 119.66 117.02 1u3o s GLN 37 Ca 0.32 -1.54 -0.29 0.00 0.01 0.00 0.00 55.36 53.85 1u3o s GLN 37 Cb 0.07 -1.08 -0.03 0.00 -1.01 0.00 0.00 33.01 30.96 1u3o s GLN 37 CO 0.10 0.18 1.41 0.54 0.01 0.00 0.00 175.29 177.53 1u3o s VAL 38 N -2.88 4.02 0.00 1.09 0.11 -1.26 -3.39 120.40 118.09 1u3o s VAL 38 Ca 0.21 1.24 0.00 0.00 -2.93 0.00 0.00 61.98 60.49 1u3o s VAL 38 Cb -0.01 -3.80 0.00 0.00 -1.53 0.00 0.00 36.38 31.04 1u3o s VAL 38 CO 0.06 -0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.33 1u3o n GLY 39 N 3.81 2.14 3.86 6.54 0.00 -0.29 -4.94 105.19 116.31 1u3o n GLY 39 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1u3o n GLY 39 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1u3o s GLN 40 N -0.22 1.86 -0.23 1.61 -2.07 -1.22 -4.87 119.66 114.52 1u3o s GLN 40 Ca 0.00 0.26 0.02 0.00 -1.82 0.00 0.00 55.36 53.82 1u3o s GLN 40 Cb 0.00 -1.92 0.04 0.00 -1.09 0.00 0.00 33.01 30.04 1u3o s GLN 40 CO 0.00 -1.70 -0.14 0.99 -1.32 0.00 0.00 175.29 173.12 1u3o s THR 41 N -3.42 2.10 -0.02 3.63 2.01 -1.26 -2.62 115.64 116.07 1u3o s THR 41 Ca 0.62 -1.35 0.03 0.00 0.31 0.00 0.00 61.69 61.30 1u3o s THR 41 Cb -0.12 -2.09 -0.00 0.00 0.01 0.00 0.00 72.50 70.29 1u3o s THR 41 CO 0.51 0.19 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.85 1u3o s VAL 42 N 1.19 0.76 0.10 3.82 1.01 0.29 -4.91 120.40 122.66 1u3o s VAL 42 Ca -0.03 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 1u3o s VAL 42 Cb -0.17 -0.65 -0.06 0.00 0.00 0.00 0.00 36.38 35.50 1u3o s VAL 42 CO -0.08 0.22 1.02 -1.83 0.00 0.00 0.00 175.10 174.43 1u3o s GLU 43 N -0.04 4.63 0.42 2.72 -1.05 -1.24 -0.63 118.70 123.51 1u3o s GLU 43 Ca 0.01 1.54 -0.23 0.00 -0.15 0.00 0.00 54.97 56.14 1u3o s GLU 43 Cb -0.06 -3.36 -0.09 0.00 -0.44 0.00 0.00 34.13 30.18 1u3o s GLU 43 CO -0.00 0.09 1.04 -0.48 0.95 0.00 0.00 175.26 176.87 1u3o s LEU 44 N 0.17 4.05 -0.06 1.83 0.05 0.45 0.12 118.68 125.30 1u3o s LEU 44 Ca 0.49 2.00 -0.13 0.00 0.05 0.00 0.00 54.13 56.54 1u3o s LEU 44 Cb -0.25 -4.30 -0.08 0.00 -2.05 0.00 0.00 46.19 39.50 1u3o s LEU 44 CO 0.31 -0.57 0.50 -0.07 -0.55 0.00 0.00 176.35 175.97 1u3o h LEU 45 N 2.22 -0.23 0.00 1.48 3.38 -1.83 -2.62 115.31 117.70 1u3o h LEU 45 Ca -0.49 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1u3o h LEU 45 Cb 1.22 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1u3o h LEU 45 CO 0.61 0.28 0.00 -1.84 0.09 0.00 0.00 178.44 177.58 1u3o n GLU 46 N -4.95 2.06 -4.24 1.13 0.28 -1.26 -4.38 120.64 109.28 1u3o n GLU 46 Ca -0.05 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.81 1u3o n GLU 46 Cb 0.18 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.95 1u3o n GLU 46 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1u3o s ARG 47 N 1.69 1.23 -0.61 3.44 0.52 -1.26 -4.64 118.95 119.31 1u3o s ARG 47 Ca 0.00 -1.64 -0.09 0.00 -0.52 0.00 0.00 55.73 53.48 1u3o s ARG 47 Cb 0.00 0.01 -0.08 0.00 0.52 0.00 0.00 34.95 35.39 1u3o s ARG 47 CO 0.00 -0.30 1.78 -0.35 0.02 0.00 0.00 175.30 176.45 1u3o n PRO 48 N -0.31 1.35 -0.04 3.54 -0.04 -1.26 -4.40 135.00 133.84 1u3o n PRO 48 Ca -0.01 -1.28 -0.19 0.00 -0.04 0.00 0.00 63.50 61.97 1u3o n PRO 48 Cb 0.65 -2.44 -0.13 0.00 -0.04 0.00 0.00 33.50 31.54 1u3o n PRO 48 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1u3o h SER 49 N 7.27 0.18 0.35 3.54 0.02 -1.96 -3.39 113.55 119.56 1u3o h SER 49 Ca 0.35 -0.81 -0.33 0.00 -0.84 0.00 0.00 61.79 60.17 1u3o h SER 49 Cb 0.26 -0.06 0.02 0.00 0.14 0.00 0.00 62.40 62.76 1u3o h SER 49 CO 1.49 1.39 -1.52 1.05 -1.14 0.00 0.00 176.83 178.11 1u3o h GLU 50 N -0.69 0.41 -4.71 3.45 4.11 -2.02 -3.46 114.58 111.67 1u3o h GLU 50 Ca -0.22 -0.70 -0.42 0.00 0.07 0.00 0.00 59.36 58.09 1u3o h GLU 50 Cb 1.41 0.26 -0.30 0.00 0.50 0.00 0.00 28.75 30.63 1u3o h GLU 50 CO -0.02 1.32 -0.79 -0.98 0.07 0.00 0.00 179.01 178.61 1u3o s ARG 51 N -2.61 0.89 -0.43 1.06 1.70 -1.26 -5.12 118.95 113.18 1u3o s ARG 51 Ca -0.10 -0.33 -0.16 0.00 -0.47 0.00 0.00 55.73 54.67 1u3o s ARG 51 Cb 0.05 -0.85 0.03 0.00 -0.57 0.00 0.00 34.95 33.62 1u3o s ARG 51 CO 0.90 0.16 0.40 -1.25 -1.08 0.00 0.00 175.30 174.43 1u3o s PRO 52 N -0.01 3.04 0.00 3.89 0.04 -1.26 -4.17 135.00 136.52 1u3o s PRO 52 Ca 0.00 -0.93 0.00 0.00 0.04 0.00 0.00 61.00 60.11 1u3o s PRO 52 Cb -0.06 -4.00 0.00 0.00 0.04 0.00 0.00 34.50 30.48 1u3o s PRO 52 CO 0.00 -0.86 0.00 0.41 0.04 0.00 0.00 177.00 176.59 1u3o n GLY 53 N 5.14 0.54 3.83 0.56 0.00 -1.26 -5.07 105.19 108.93 1u3o n GLY 53 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 1u3o n GLY 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1u3o s TRP 54 N -0.77 2.93 0.05 1.61 1.48 -1.26 0.22 118.94 123.20 1u3o s TRP 54 Ca 0.00 -0.26 -0.23 0.00 -1.06 0.00 0.00 56.10 54.55 1u3o s TRP 54 Cb 0.00 -1.68 0.05 0.00 -1.16 0.00 0.00 33.47 30.68 1u3o s TRP 54 CO 0.00 0.28 0.54 0.00 -4.06 0.00 0.00 176.95 173.71 1u3o s LEU 56 N -1.96 3.42 -0.05 0.00 1.02 -1.26 -1.32 118.68 118.52 1u3o s LEU 56 Ca -0.05 -0.53 -0.00 0.00 0.02 0.00 0.00 54.13 53.57 1u3o s LEU 56 Cb -0.01 -1.94 0.03 0.00 0.02 0.00 0.00 46.19 44.29 1u3o s LEU 56 CO -0.02 -0.06 -0.01 0.68 0.02 0.00 0.00 176.35 176.97 1u3o s VAL 57 N -2.27 0.34 -0.13 -1.59 -7.23 0.12 -3.66 120.40 105.99 1u3o s VAL 57 Ca 0.33 0.07 -0.06 0.00 -1.81 0.00 0.00 61.98 60.50 1u3o s VAL 57 Cb -0.06 -0.46 -0.04 0.00 0.56 0.00 0.00 36.38 36.38 1u3o s VAL 57 CO 0.22 0.22 0.10 -0.60 -0.31 0.00 0.00 175.10 174.73 1u3o s ARG 58 N 1.47 3.46 -0.21 4.82 6.06 0.33 0.19 118.95 135.08 1u3o s ARG 58 Ca -0.03 -0.23 -0.13 0.00 -2.50 0.00 0.00 55.73 52.85 1u3o s ARG 58 Cb -0.13 -3.12 -0.05 0.00 0.06 0.00 0.00 34.95 31.71 1u3o s ARG 58 CO -0.03 0.66 0.24 0.99 -2.50 0.00 0.00 175.30 174.67 1u3o s THR 59 N -0.72 5.32 -0.01 4.11 2.01 0.12 -3.62 115.64 122.85 1u3o s THR 59 Ca 0.13 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.53 1u3o s THR 59 Cb -0.12 -3.58 -0.00 0.00 0.01 0.00 0.00 72.50 68.81 1u3o s THR 59 CO 0.03 0.35 0.01 1.07 -0.69 0.00 0.00 174.62 175.38 1u3o n THR 60 N 4.02 0.00 0.79 -0.82 5.66 -1.26 -1.94 114.28 120.73 1u3o n THR 60 Ca -0.13 -0.28 0.04 0.00 -3.05 0.00 0.00 64.05 60.63 1u3o n THR 60 Cb 0.52 0.78 0.14 0.00 -1.55 0.00 0.00 70.33 70.22 1u3o n THR 60 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1u3o n GLU 61 N -1.23 1.97 -3.44 1.09 0.28 -1.26 -4.53 120.64 113.52 1u3o n GLU 61 Ca 0.00 -1.13 -0.22 0.00 -0.16 0.00 0.00 57.16 55.65 1u3o n GLU 61 Cb 0.01 -1.42 -0.11 0.00 1.43 0.00 0.00 31.44 31.35 1u3o n GLU 61 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1u3o s ARG 62 N -1.64 0.37 0.01 3.44 0.52 -1.26 -5.13 118.95 115.26 1u3o s ARG 62 Ca 0.20 -0.55 -0.26 0.00 -0.52 0.00 0.00 55.73 54.60 1u3o s ARG 62 Cb 0.12 -0.90 -0.04 0.00 0.52 0.00 0.00 34.95 34.64 1u3o s ARG 62 CO 0.11 -1.08 0.83 -1.12 0.02 0.00 0.00 175.30 174.05 1u3o s SER 63 N 1.94 7.23 0.61 0.23 0.01 -1.26 -2.88 113.70 119.58 1u3o s SER 63 Ca 0.12 1.47 -0.15 0.00 1.31 0.00 0.00 55.95 58.70 1u3o s SER 63 Cb -0.16 -2.49 -0.03 0.00 0.21 0.00 0.00 66.02 63.55 1u3o s SER 63 CO -0.24 -0.10 1.06 -2.16 0.41 0.00 0.00 173.24 172.21 1u3o s PRO 64 N 0.44 3.25 0.99 12.44 0.04 -1.26 -5.12 135.00 145.77 1u3o s PRO 64 Ca 0.43 1.16 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 1u3o s PRO 64 Cb -0.20 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.23 1u3o s PRO 64 CO 0.24 -0.86 -0.46 -0.35 0.04 0.00 0.00 177.00 175.60 1u3o n PRO 65 N -2.22 -0.15 -4.38 0.56 -0.04 -1.14 -5.00 135.00 122.63 1u3o n PRO 65 Ca 0.09 -0.03 -0.19 0.00 -0.04 0.00 0.00 63.50 63.33 1u3o n PRO 65 Cb 0.53 -1.29 -0.10 0.00 -0.04 0.00 0.00 33.50 32.60 1u3o n PRO 65 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1u3o s GLN 66 N -2.55 1.51 0.03 0.54 -1.52 -0.82 -4.91 119.66 111.94 1u3o s GLN 66 Ca 0.45 -1.82 0.02 0.00 -1.95 0.00 0.00 55.36 52.06 1u3o s GLN 66 Cb -0.17 -0.55 -0.02 0.00 -0.22 0.00 0.00 33.01 32.05 1u3o s GLN 66 CO 0.76 -0.23 -0.06 -1.21 -0.25 0.00 0.00 175.29 174.30 1u3o s GLU 67 N -3.96 0.45 0.08 2.91 2.02 -1.26 0.11 118.70 119.06 1u3o s GLU 67 Ca 0.37 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.69 1u3o s GLU 67 Cb 0.08 -0.18 -0.04 0.00 0.10 0.00 0.00 34.13 34.09 1u3o s GLU 67 CO 0.14 0.02 -0.05 0.20 0.02 0.00 0.00 175.26 175.60 1u3o s GLY 68 N -1.45 0.69 -0.02 -1.39 0.00 0.51 -3.36 107.32 102.28 1u3o s GLY 68 Ca -0.11 -1.31 0.00 0.00 0.00 0.00 0.00 44.72 43.30 1u3o s GLY 68 CO -0.00 -1.41 0.01 1.08 0.00 0.00 0.00 173.10 172.78 1u3o s LEU 69 N -3.01 1.22 0.32 0.66 1.02 -1.23 -0.70 118.68 116.97 1u3o s LEU 69 Ca 0.11 -0.01 -0.19 0.00 0.02 0.00 0.00 54.13 54.06 1u3o s LEU 69 Cb 0.06 -0.17 0.04 0.00 0.02 0.00 0.00 46.19 46.14 1u3o s LEU 69 CO -0.06 -0.10 0.78 0.68 0.02 0.00 0.00 176.35 177.68 1u3o s VAL 70 N 0.93 0.00 0.34 -1.59 -7.23 -0.44 -4.88 120.40 107.54 1u3o s VAL 70 Ca -0.09 -0.96 -0.08 0.00 -1.81 0.00 0.00 61.98 59.04 1u3o s VAL 70 Cb -0.12 -2.46 -0.06 0.00 0.56 0.00 0.00 36.38 34.30 1u3o s VAL 70 CO -0.02 0.00 0.67 -2.16 -0.31 0.00 0.00 175.10 173.28 1u3o s PRO 71 N -3.04 3.72 0.56 4.82 0.04 -1.26 0.09 135.00 139.94 1u3o s PRO 71 Ca 0.14 0.27 0.38 0.00 0.04 0.00 0.00 61.00 61.82 1u3o s PRO 71 Cb -0.05 -2.51 1.49 0.00 0.04 0.00 0.00 34.50 33.47 1u3o s PRO 71 CO 0.09 0.09 1.67 1.03 0.04 0.00 0.00 177.00 179.92 1u3o h SER 72 N 1.53 0.00 -0.30 6.66 0.87 0.24 0.59 113.55 123.13 1u3o h SER 72 Ca -0.47 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.17 1u3o h SER 72 Cb 1.19 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 1u3o h SER 72 CO 0.65 0.00 0.22 0.77 -0.53 0.00 0.00 176.83 177.94 1u3o h SER 73 N 0.00 0.02 -0.02 6.23 4.64 -1.93 -0.54 113.55 121.95 1u3o h SER 73 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1u3o h SER 73 Cb 2.66 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.75 1u3o h SER 73 CO -0.01 0.01 -0.04 0.35 -0.87 0.00 0.00 176.83 176.28 1u3o n THR 74 N -4.45 0.00 -3.90 2.95 -2.24 0.20 -4.34 114.28 102.50 1u3o n THR 74 Ca 0.04 -0.48 -0.24 0.00 -2.27 0.00 0.00 64.05 61.10 1u3o n THR 74 Cb 0.37 1.31 -0.17 0.00 -2.10 0.00 0.00 70.33 69.74 1u3o n THR 74 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1u3o s LEU 75 N -1.41 0.94 -0.18 3.22 1.02 -0.21 -0.46 118.68 121.60 1u3o s LEU 75 Ca 0.18 -0.18 -0.29 0.00 0.02 0.00 0.00 54.13 53.86 1u3o s LEU 75 Cb 0.13 -0.61 -0.05 0.00 0.02 0.00 0.00 46.19 45.68 1u3o s LEU 75 CO 0.22 -0.14 2.08 0.00 0.02 0.00 0.00 176.35 178.53 1u3o n ILE 77 N 7.20 0.31 0.00 0.00 -6.64 -1.26 -4.37 119.36 114.60 1u3o n ILE 77 Ca 0.26 -0.16 0.00 0.00 -1.77 0.00 0.00 62.75 61.08 1u3o n ILE 77 Cb 0.44 -0.81 0.00 0.00 -1.44 0.00 0.00 39.64 37.83 1u3o n ILE 77 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 1u3o n SER 78 N -2.36 0.00 -3.37 7.28 2.88 -1.26 -4.74 113.62 112.05 1u3o n SER 78 Ca -0.08 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.29 1u3o n SER 78 Cb 0.63 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.17 1u3o n SER 78 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1u3o n HIS 79 N 0.00 -2.29 0.56 0.66 -0.00 -1.26 -5.25 115.22 107.64 1u3o n HIS 79 Ca 0.00 0.90 0.04 0.00 -0.00 0.00 0.00 57.72 58.66 1u3o n HIS 79 Cb 0.00 -4.65 0.27 0.00 -0.00 0.00 0.00 29.99 25.61 1u3o n HIS 79 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79