#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 1.48 0.00 0.23 0.00 -1.26 -5.10 105.19 100.54 1u3o n GLY 15 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 2.97 -0.80 3.02 -0.02 0.00 -1.26 -5.12 105.19 103.98 1u3o n GLY 16 Ca 0.00 0.37 -0.18 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.22 1.04 0.02 0.00 2.12 -0.94 -4.91 118.70 115.82 1u3o s GLU 18 Ca 0.03 -0.94 -0.30 0.00 0.36 0.00 0.00 54.97 54.12 1u3o s GLU 18 Cb -0.03 -1.13 -0.04 0.00 0.26 0.00 0.00 34.13 33.18 1u3o s GLU 18 CO -0.00 0.27 1.06 -0.51 -0.54 0.00 0.00 175.26 175.54 1u3o s LEU 19 N -1.48 4.37 0.03 2.70 1.43 -1.26 0.19 118.68 124.66 1u3o s LEU 19 Ca 0.03 1.79 -0.01 0.00 -1.03 0.00 0.00 54.13 54.91 1u3o s LEU 19 Cb -0.09 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.53 1u3o s LEU 19 CO 0.02 -0.33 -0.01 0.28 0.23 0.00 0.00 176.35 176.54 1u3o s THR 20 N 1.01 0.14 -0.14 5.49 -1.32 -0.44 -4.86 115.64 115.52 1u3o s THR 20 Ca 0.54 -1.17 0.00 0.00 -1.21 0.00 0.00 61.69 59.86 1u3o s THR 20 Cb -0.24 -0.68 -0.01 0.00 -1.51 0.00 0.00 72.50 70.06 1u3o s THR 20 CO 0.28 -0.64 -0.15 0.68 -2.21 0.00 0.00 174.62 172.59 1u3o s VAL 21 N -2.26 2.81 0.09 5.08 -7.23 -1.26 0.05 120.40 117.68 1u3o s VAL 21 Ca -0.08 -0.73 -0.31 0.00 -1.81 0.00 0.00 61.98 59.05 1u3o s VAL 21 Cb -0.04 -2.18 -0.08 0.00 0.56 0.00 0.00 36.38 34.64 1u3o s VAL 21 CO -0.04 0.52 1.42 0.68 -0.31 0.00 0.00 175.10 177.37 1u3o s VAL 22 N 0.61 3.33 -0.23 1.32 -7.23 -1.08 -0.43 120.40 116.69 1u3o s VAL 22 Ca -0.08 0.91 0.20 0.00 -1.81 0.00 0.00 61.98 61.20 1u3o s VAL 22 Cb -0.16 -3.58 0.22 0.00 0.56 0.00 0.00 36.38 33.41 1u3o s VAL 22 CO 0.03 0.05 1.59 -0.07 -0.31 0.00 0.00 175.10 176.39 1u3o h LEU 23 N 7.23 0.00 -7.90 1.32 3.38 -1.42 -1.78 115.31 116.15 1u3o h LEU 23 Ca -0.41 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.43 1u3o h LEU 23 Cb 1.20 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.78 1u3o h LEU 23 CO 0.88 0.23 -0.52 0.00 0.09 0.00 0.00 178.44 179.12 1u3o s GLN 24 N -3.18 0.59 0.47 1.13 -2.07 -1.25 -4.76 119.66 110.58 1u3o s GLN 24 Ca 0.05 -0.75 -0.23 0.00 -1.82 0.00 0.00 55.36 52.61 1u3o s GLN 24 Cb 0.07 0.23 -0.07 0.00 -1.09 0.00 0.00 33.01 32.15 1u3o s GLN 24 CO 0.69 -0.15 1.15 -0.51 -1.32 0.00 0.00 175.29 175.16 1u3o s ASP 25 N -2.12 6.16 0.03 12.60 1.11 -1.26 -4.06 116.67 129.12 1u3o s ASP 25 Ca -0.05 2.27 -0.07 0.00 0.18 0.00 0.00 52.55 54.88 1u3o s ASP 25 Cb -0.01 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.38 1u3o s ASP 25 CO -0.05 -0.92 0.13 0.12 1.18 0.00 0.00 175.17 175.63 1u3o s PHE 26 N -1.58 0.13 -0.02 4.23 5.36 -0.22 -4.90 117.98 120.98 1u3o s PHE 26 Ca 0.64 -0.37 0.05 0.00 -0.96 0.00 0.00 56.93 56.29 1u3o s PHE 26 Cb -0.27 -0.09 -0.01 0.00 -0.34 0.00 0.00 43.02 42.30 1u3o s PHE 26 CO 0.33 -0.37 -0.17 -1.54 -1.46 0.00 0.00 175.22 172.01 1u3o s SER 27 N -1.99 2.01 0.82 6.13 1.04 -1.26 0.12 113.70 120.58 1u3o s SER 27 Ca -0.07 -0.31 -0.08 0.00 0.48 0.00 0.00 55.95 55.97 1u3o s SER 27 Cb -0.02 -0.27 0.13 0.00 0.10 0.00 0.00 66.02 65.96 1u3o s SER 27 CO -0.03 0.20 0.28 0.00 0.98 0.00 0.00 173.24 174.67 1u3o n ALA 28 N 2.72 -1.72 0.00 5.32 0.00 -1.07 -4.80 120.51 120.96 1u3o n ALA 28 Ca -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1u3o n ALA 28 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 -3.39 0.00 -4.59 0.00 0.00 -1.26 -4.91 120.51 106.36 1u3o n ALA 29 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.11 1u3o n ALA 29 Cb 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.59 1u3o n ALA 29 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1u3o n HIS 30 N 0.00 0.89 0.00 0.00 1.44 -1.26 -5.03 115.22 111.26 1u3o n HIS 30 Ca 0.00 -2.05 0.00 0.00 -2.01 0.00 0.00 57.72 53.66 1u3o n HIS 30 Cb 0.00 -0.25 0.00 0.00 0.12 0.00 0.00 29.99 29.86 1u3o n HIS 30 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1u3o n SER 31 N -1.28 0.00 -1.99 4.39 7.64 -1.26 -1.74 113.62 119.38 1u3o n SER 31 Ca -0.16 0.38 -0.18 0.00 1.01 0.00 0.00 58.87 59.92 1u3o n SER 31 Cb 0.52 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.74 1u3o n SER 31 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1u3o n SER 32 N -0.88 6.42 -4.89 6.43 7.64 -1.26 -4.92 113.62 122.16 1u3o n SER 32 Ca 0.00 -3.06 -0.25 0.00 1.01 0.00 0.00 58.87 56.58 1u3o n SER 32 Cb 0.00 -1.10 -0.04 0.00 -1.01 0.00 0.00 64.21 62.06 1u3o n SER 32 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1u3o s GLU 33 N -1.68 3.19 0.19 1.43 0.41 -0.71 -2.30 118.70 119.24 1u3o s GLU 33 Ca 0.36 -0.78 -0.17 0.00 -0.41 0.00 0.00 54.97 53.97 1u3o s GLU 33 Cb 0.26 -2.79 0.02 0.00 -1.78 0.00 0.00 34.13 29.84 1u3o s GLU 33 CO -0.04 0.48 0.51 -0.48 -0.49 0.00 0.00 175.26 175.23 1u3o s LEU 34 N -3.41 0.14 -0.09 1.80 0.05 -1.25 -4.72 118.68 111.21 1u3o s LEU 34 Ca 0.33 -0.52 -0.18 0.00 0.05 0.00 0.00 54.13 53.81 1u3o s LEU 34 Cb -0.10 2.07 -0.05 0.00 -2.05 0.00 0.00 46.19 46.07 1u3o s LEU 34 CO 0.26 -1.04 0.48 -0.94 -0.55 0.00 0.00 176.35 174.56 1u3o s SER 35 N -2.88 6.74 0.34 1.48 1.04 -1.26 -2.61 113.70 116.55 1u3o s SER 35 Ca 0.10 0.88 0.03 0.00 0.48 0.00 0.00 55.95 57.44 1u3o s SER 35 Cb -0.01 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.78 1u3o s SER 35 CO -0.02 0.06 0.10 0.27 0.98 0.00 0.00 173.24 174.63 1u3o s ILE 36 N 0.27 0.79 0.06 -1.02 -5.25 0.33 -4.94 121.20 111.44 1u3o s ILE 36 Ca 0.26 -2.00 0.03 0.00 -0.99 0.00 0.00 60.65 57.95 1u3o s ILE 36 Cb -0.16 -2.58 -0.03 0.00 2.95 0.00 0.00 42.46 42.65 1u3o s ILE 36 CO 0.12 0.00 -0.10 -1.10 -1.79 0.00 0.00 174.94 172.07 1u3o s GLN 37 N -3.84 0.67 -0.10 0.37 -0.21 -1.26 -1.06 119.66 114.23 1u3o s GLN 37 Ca 0.32 -0.89 -0.29 0.00 0.02 0.00 0.00 55.36 54.52 1u3o s GLN 37 Cb 0.06 -0.48 -0.05 0.00 1.00 0.00 0.00 33.01 33.53 1u3o s GLN 37 CO 0.15 0.09 1.75 0.54 -2.12 0.00 0.00 175.29 175.70 1u3o s VAL 38 N -1.55 3.47 0.00 1.09 0.11 -1.26 -2.98 120.40 119.28 1u3o s VAL 38 Ca -0.05 0.55 0.00 0.00 -2.93 0.00 0.00 61.98 59.55 1u3o s VAL 38 Cb -0.09 -3.41 0.00 0.00 -1.53 0.00 0.00 36.38 31.36 1u3o s VAL 38 CO 0.01 -0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.28 1u3o n GLY 39 N 4.48 2.12 3.89 6.54 0.00 -0.67 -4.93 105.19 116.62 1u3o n GLY 39 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 2.15 -0.16 1.61 -2.07 -1.16 -4.88 119.66 115.15 1u3o s GLN 40 Ca 0.00 0.22 0.01 0.00 -1.82 0.00 0.00 55.36 53.77 1u3o s GLN 40 Cb 0.00 -1.96 0.02 0.00 -1.09 0.00 0.00 33.01 29.98 1u3o s GLN 40 CO 0.00 -1.49 -0.19 0.99 -1.32 0.00 0.00 175.29 173.28 1u3o s THR 41 N -3.50 1.96 -0.00 3.63 2.01 -1.26 -2.64 115.64 115.83 1u3o s THR 41 Ca 0.61 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1u3o s THR 41 Cb -0.11 -1.77 -0.00 0.00 0.01 0.00 0.00 72.50 70.63 1u3o s THR 41 CO 0.50 0.52 -0.01 -0.69 -0.69 0.00 0.00 174.62 174.25 1u3o s VAL 42 N 1.21 0.09 0.12 3.82 1.01 0.11 -4.95 120.40 121.81 1u3o s VAL 42 Ca 0.02 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1u3o s VAL 42 Cb -0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 36.38 36.10 1u3o s VAL 42 CO -0.10 0.03 1.01 -1.83 0.00 0.00 0.00 175.10 174.21 1u3o s GLU 43 N -0.03 4.65 0.41 2.72 -1.05 -1.24 -1.32 118.70 122.84 1u3o s GLU 43 Ca 0.00 1.53 -0.24 0.00 -0.15 0.00 0.00 54.97 56.12 1u3o s GLU 43 Cb -0.00 -3.35 -0.09 0.00 -0.44 0.00 0.00 34.13 30.24 1u3o s GLU 43 CO -0.00 0.14 1.04 -0.48 0.95 0.00 0.00 175.26 176.91 1u3o s LEU 44 N 0.01 4.11 -0.09 1.83 2.34 0.50 0.12 118.68 127.51 1u3o s LEU 44 Ca 0.48 2.01 -0.21 0.00 0.06 0.00 0.00 54.13 56.47 1u3o s LEU 44 Cb -0.25 -4.23 -0.18 0.00 -0.56 0.00 0.00 46.19 40.98 1u3o s LEU 44 CO 0.31 -0.50 0.71 -0.07 -1.06 0.00 0.00 176.35 175.74 1u3o h LEU 45 N 2.41 -0.06 0.00 1.48 3.38 -1.83 -2.50 115.31 118.19 1u3o h LEU 45 Ca -0.48 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 56.92 1u3o h LEU 45 Cb 1.21 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1u3o h LEU 45 CO 0.62 0.66 0.00 -1.84 0.09 0.00 0.00 178.44 177.97 1u3o n GLU 46 N -4.76 1.74 -4.25 1.13 0.28 -1.26 -4.33 120.64 109.18 1u3o n GLU 46 Ca -0.07 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.79 1u3o n GLU 46 Cb 0.31 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.07 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 1.73 1.23 -0.68 3.44 3.00 -1.26 -4.67 118.95 121.74 1u3o s ARG 47 Ca 0.00 -1.64 -0.07 0.00 0.00 0.00 0.00 55.73 54.02 1u3o s ARG 47 Cb 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 34.95 34.73 1u3o s ARG 47 CO 0.00 -0.28 2.90 -2.30 0.00 0.00 0.00 175.30 175.62 1u3o n PRO 48 N -0.32 2.40 -0.03 3.54 -0.02 -1.26 -4.35 135.00 134.96 1u3o n PRO 48 Ca -0.02 -1.38 -0.19 0.00 -2.02 0.00 0.00 63.50 59.89 1u3o n PRO 48 Cb 0.65 -2.29 -0.13 0.00 -0.02 0.00 0.00 33.50 31.71 1u3o n PRO 48 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1u3o h SER 49 N 4.46 0.20 0.36 2.55 0.87 -1.96 -3.36 113.55 116.68 1u3o h SER 49 Ca 0.45 -0.83 -0.32 0.00 -1.23 0.00 0.00 61.79 59.85 1u3o h SER 49 Cb 0.76 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1u3o h SER 49 CO 0.96 1.38 -1.57 1.05 -0.53 0.00 0.00 176.83 178.12 1u3o h GLU 50 N -0.67 0.34 -4.99 2.24 4.11 -2.02 -3.44 114.58 110.15 1u3o h GLU 50 Ca -0.20 -0.58 -0.66 0.00 0.07 0.00 0.00 59.36 57.99 1u3o h GLU 50 Cb 1.42 0.22 -0.35 0.00 0.50 0.00 0.00 28.75 30.54 1u3o h GLU 50 CO -0.00 1.23 -0.86 0.50 0.07 0.00 0.00 179.01 179.96 1u3o s ARG 51 N -2.61 2.87 -0.41 1.06 3.52 -1.26 -5.10 118.95 117.02 1u3o s ARG 51 Ca -0.11 -0.79 -0.20 0.00 -0.13 0.00 0.00 55.73 54.51 1u3o s ARG 51 Cb 0.06 -2.50 0.02 0.00 -1.56 0.00 0.00 34.95 30.97 1u3o s ARG 51 CO 0.87 -0.22 0.58 -1.25 -0.81 0.00 0.00 175.30 174.48 1u3o s PRO 52 N 1.32 3.34 0.00 5.12 0.04 -1.26 -3.94 135.00 139.63 1u3o s PRO 52 Ca 0.05 -0.37 0.00 0.00 0.04 0.00 0.00 61.00 60.72 1u3o s PRO 52 Cb -0.13 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.49 1u3o s PRO 52 CO -0.13 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.43 1u3o n GLY 53 N 4.98 1.09 3.71 0.56 0.00 -1.26 -5.06 105.19 109.21 1u3o n GLY 53 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 2.70 0.06 1.61 1.48 -1.25 0.19 118.94 121.73 1u3o s TRP 54 Ca 0.00 -0.36 -0.22 0.00 -1.06 0.00 0.00 56.10 54.47 1u3o s TRP 54 Cb 0.00 -1.56 0.05 0.00 -1.16 0.00 0.00 33.47 30.81 1u3o s TRP 54 CO 0.00 0.40 0.51 0.00 -4.06 0.00 0.00 176.95 173.80 1u3o s LEU 56 N -2.11 3.48 -0.05 0.00 1.02 -1.26 -1.09 118.68 118.66 1u3o s LEU 56 Ca -0.04 -0.48 -0.01 0.00 0.02 0.00 0.00 54.13 53.63 1u3o s LEU 56 Cb -0.00 -2.00 0.03 0.00 0.02 0.00 0.00 46.19 44.23 1u3o s LEU 56 CO -0.04 -0.04 0.01 0.68 0.02 0.00 0.00 176.35 176.98 1u3o s VAL 57 N -2.25 0.24 -0.11 -1.59 -7.23 0.26 -3.70 120.40 106.02 1u3o s VAL 57 Ca 0.33 0.13 -0.05 0.00 -1.81 0.00 0.00 61.98 60.57 1u3o s VAL 57 Cb -0.07 -0.38 -0.04 0.00 0.56 0.00 0.00 36.38 36.45 1u3o s VAL 57 CO 0.22 0.20 0.09 -0.60 -0.31 0.00 0.00 175.10 174.70 1u3o s ARG 58 N 1.54 3.33 -0.19 4.82 6.06 0.33 0.19 118.95 135.03 1u3o s ARG 58 Ca -0.02 -0.24 -0.15 0.00 -2.50 0.00 0.00 55.73 52.82 1u3o s ARG 58 Cb -0.13 -3.06 -0.04 0.00 0.06 0.00 0.00 34.95 31.78 1u3o s ARG 58 CO -0.03 0.71 0.35 0.99 -2.50 0.00 0.00 175.30 174.82 1u3o s THR 59 N -0.87 5.25 0.00 4.11 2.01 0.15 -3.60 115.64 122.69 1u3o s THR 59 Ca 0.14 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.75 1u3o s THR 59 Cb -0.12 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.71 1u3o s THR 59 CO 0.03 0.31 0.00 1.07 -0.69 0.00 0.00 174.62 175.34 1u3o n THR 60 N 4.06 0.00 0.30 -0.82 5.66 -1.26 -1.98 114.28 120.23 1u3o n THR 60 Ca -0.10 -0.20 0.05 0.00 -3.05 0.00 0.00 64.05 60.75 1u3o n THR 60 Cb 0.51 0.69 0.20 0.00 -1.55 0.00 0.00 70.33 70.18 1u3o n THR 60 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1u3o n GLU 61 N -1.25 2.61 -3.44 1.09 4.07 -1.26 -4.57 120.64 117.89 1u3o n GLU 61 Ca 0.00 -1.54 -0.22 0.00 -0.06 0.00 0.00 57.16 55.34 1u3o n GLU 61 Cb 0.00 -1.68 -0.11 0.00 -0.06 0.00 0.00 31.44 29.59 1u3o n GLU 61 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1u3o s ARG 62 N -1.76 0.37 -0.05 5.31 0.52 -1.26 -5.13 118.95 116.95 1u3o s ARG 62 Ca 0.27 -0.52 -0.27 0.00 -0.52 0.00 0.00 55.73 54.70 1u3o s ARG 62 Cb 0.19 -0.88 -0.03 0.00 0.52 0.00 0.00 34.95 34.74 1u3o s ARG 62 CO 0.12 -1.08 0.85 -1.12 0.02 0.00 0.00 175.30 174.09 1u3o s SER 63 N 1.97 7.16 0.53 0.23 0.01 -1.26 -2.41 113.70 119.94 1u3o s SER 63 Ca 0.12 1.41 -0.18 0.00 1.31 0.00 0.00 55.95 58.61 1u3o s SER 63 Cb -0.16 -2.49 -0.06 0.00 0.21 0.00 0.00 66.02 63.51 1u3o s SER 63 CO -0.25 -0.23 1.03 -2.16 0.41 0.00 0.00 173.24 172.05 1u3o s PRO 64 N 1.09 3.64 1.02 12.44 0.04 -1.26 -5.13 135.00 146.84 1u3o s PRO 64 Ca 0.44 1.21 -0.23 0.00 0.04 0.00 0.00 61.00 62.47 1u3o s PRO 64 Cb -0.19 -2.08 -0.12 0.00 0.04 0.00 0.00 34.50 32.15 1u3o s PRO 64 CO 0.22 -0.54 -0.97 -2.30 0.04 0.00 0.00 177.00 173.45 1u3o n PRO 65 N -1.52 -0.30 -4.33 0.56 -0.02 -1.01 -5.01 135.00 123.38 1u3o n PRO 65 Ca 0.08 -0.08 -0.17 0.00 -2.02 0.00 0.00 63.50 61.31 1u3o n PRO 65 Cb 0.53 -1.18 -0.10 0.00 -0.02 0.00 0.00 33.50 32.72 1u3o n PRO 65 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1u3o s GLN 66 N -2.37 1.42 0.02 -0.52 -1.52 -0.84 -4.90 119.66 110.96 1u3o s GLN 66 Ca 0.42 -1.77 0.01 0.00 -1.95 0.00 0.00 55.36 52.07 1u3o s GLN 66 Cb -0.02 -0.31 -0.02 0.00 -0.22 0.00 0.00 33.01 32.43 1u3o s GLN 66 CO 0.70 -0.28 -0.05 -1.21 -0.25 0.00 0.00 175.29 174.20 1u3o s GLU 67 N -4.02 0.39 0.10 2.91 2.02 -1.26 0.30 118.70 119.14 1u3o s GLU 67 Ca 0.37 -0.55 -0.01 0.00 0.02 0.00 0.00 54.97 54.80 1u3o s GLU 67 Cb 0.08 -0.16 -0.04 0.00 0.10 0.00 0.00 34.13 34.11 1u3o s GLU 67 CO 0.14 0.02 0.03 0.20 0.02 0.00 0.00 175.26 175.66 1u3o s GLY 68 N -1.17 0.79 -0.02 -1.39 0.00 0.51 -3.47 107.32 102.56 1u3o s GLY 68 Ca -0.09 -1.36 -0.00 0.00 0.00 0.00 0.00 44.72 43.26 1u3o s GLY 68 CO -0.00 -1.34 0.03 1.08 0.00 0.00 0.00 173.10 172.87 1u3o s LEU 69 N -3.00 1.29 0.32 0.66 1.02 -1.24 -0.58 118.68 117.15 1u3o s LEU 69 Ca 0.18 0.04 -0.19 0.00 0.02 0.00 0.00 54.13 54.18 1u3o s LEU 69 Cb 0.08 -0.03 0.03 0.00 0.02 0.00 0.00 46.19 46.29 1u3o s LEU 69 CO -0.03 -0.10 0.74 0.68 0.02 0.00 0.00 176.35 177.67 1u3o s VAL 70 N 0.80 0.00 0.42 -1.59 -7.23 -0.25 -4.87 120.40 107.68 1u3o s VAL 70 Ca -0.07 -1.00 -0.07 0.00 -1.81 0.00 0.00 61.98 59.03 1u3o s VAL 70 Cb -0.10 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.46 1u3o s VAL 70 CO -0.02 0.00 0.74 -2.16 -0.31 0.00 0.00 175.10 173.35 1u3o s PRO 71 N -3.30 3.65 0.59 4.82 0.04 -1.26 0.26 135.00 139.79 1u3o s PRO 71 Ca 0.13 0.28 0.30 0.00 0.04 0.00 0.00 61.00 61.74 1u3o s PRO 71 Cb -0.06 -2.42 1.37 0.00 0.04 0.00 0.00 34.50 33.43 1u3o s PRO 71 CO 0.09 -0.07 1.75 1.03 0.04 0.00 0.00 177.00 179.84 1u3o h SER 72 N 0.86 0.00 -0.19 6.66 0.87 0.20 0.46 113.55 122.40 1u3o h SER 72 Ca -0.47 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.10 1u3o h SER 72 Cb 1.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 1u3o h SER 72 CO 0.63 0.00 0.13 0.28 -0.53 0.00 0.00 176.83 177.34 1u3o h SER 73 N 0.00 0.20 -0.43 6.23 0.02 -1.92 -1.30 113.55 116.34 1u3o h SER 73 Ca 0.33 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1u3o h SER 73 Cb 1.73 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.22 1u3o h SER 73 CO -0.00 0.14 0.00 0.35 -1.14 0.00 0.00 176.83 176.18 1u3o n THR 74 N -4.51 0.90 -3.95 -2.27 -2.24 0.16 -4.41 114.28 97.95 1u3o n THR 74 Ca 0.00 -0.95 -0.16 0.00 -2.27 0.00 0.00 64.05 60.67 1u3o n THR 74 Cb 0.10 0.58 -0.15 0.00 -2.10 0.00 0.00 70.33 68.76 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 -1.03 1.44 0.12 3.22 1.02 -0.49 -1.31 118.68 121.65 1u3o s LEU 75 Ca 0.30 -0.03 -0.33 0.00 0.02 0.00 0.00 54.13 54.09 1u3o s LEU 75 Cb 0.16 -0.19 -0.13 0.00 0.02 0.00 0.00 46.19 46.06 1u3o s LEU 75 CO 0.21 -0.06 1.68 0.00 0.02 0.00 0.00 176.35 178.21 1u3o s ILE 77 N 1.75 0.43 0.17 0.00 -0.00 -1.26 -4.71 121.20 117.57 1u3o s ILE 77 Ca 0.81 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 59.46 1u3o s ILE 77 Cb -0.63 -2.60 0.00 0.00 -0.00 0.00 0.00 42.46 39.23 1u3o s ILE 77 CO 0.39 0.00 0.00 -1.20 -0.00 0.00 0.00 174.94 174.13 1u3o n SER 78 N -0.46 -0.53 0.50 4.36 7.64 -1.26 -4.96 113.62 118.90 1u3o n SER 78 Ca 0.01 0.30 -0.20 0.00 1.01 0.00 0.00 58.87 59.99 1u3o n SER 78 Cb 0.66 0.65 -0.09 0.00 -1.01 0.00 0.00 64.21 64.41 1u3o n SER 78 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1u3o h HIS 79 N 0.00 -1.18 -0.03 1.43 3.86 -2.04 -3.56 115.15 113.63 1u3o h HIS 79 Ca 0.00 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1u3o h HIS 79 Cb 0.00 0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.86 1u3o h HIS 79 CO 0.00 -0.73 0.00 -1.13 0.86 0.00 0.00 177.93 176.93