#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3o h GLY 15 N 0.00 0.00 -5.37 0.23 0.00 -2.02 -3.41 103.07 92.50 1u3o h GLY 15 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1u3o h GLY 15 CO 0.00 0.00 -0.64 -0.32 0.00 0.00 0.00 176.54 175.58 1u3o s GLY 16 N -4.07 1.81 -0.06 4.60 0.00 -1.26 -5.10 107.32 103.23 1u3o s GLY 16 Ca -0.05 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.86 1u3o s GLY 16 CO 0.61 -0.49 -0.04 0.00 0.00 0.00 0.00 173.10 173.19 1u3o s GLU 18 N 1.22 0.94 0.17 0.00 2.56 -0.99 -4.97 118.70 117.63 1u3o s GLU 18 Ca -0.06 -0.98 -0.30 0.00 0.00 0.00 0.00 54.97 53.63 1u3o s GLU 18 Cb -0.14 -1.02 -0.07 0.00 2.00 0.00 0.00 34.13 34.90 1u3o s GLU 18 CO -0.02 0.24 1.05 -0.51 -0.56 0.00 0.00 175.26 175.46 1u3o s LEU 19 N -1.66 4.50 0.02 2.70 1.43 -1.26 0.15 118.68 124.56 1u3o s LEU 19 Ca 0.01 2.01 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 1u3o s LEU 19 Cb -0.10 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 1u3o s LEU 19 CO 0.03 -0.15 -0.02 -0.89 0.23 0.00 0.00 176.35 175.55 1u3o s THR 20 N -0.27 0.10 -0.11 5.49 2.01 0.24 -4.73 115.64 118.37 1u3o s THR 20 Ca 0.48 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.67 1u3o s THR 20 Cb -0.28 -0.25 -0.01 0.00 0.01 0.00 0.00 72.50 71.97 1u3o s THR 20 CO 0.34 -0.45 -0.16 0.68 -0.69 0.00 0.00 174.62 174.33 1u3o s VAL 21 N -1.34 2.78 -0.12 3.82 -7.23 -1.26 0.79 120.40 117.84 1u3o s VAL 21 Ca -0.15 -0.77 -0.28 0.00 -1.81 0.00 0.00 61.98 58.97 1u3o s VAL 21 Cb -0.09 -2.13 -0.01 0.00 0.56 0.00 0.00 36.38 34.70 1u3o s VAL 21 CO -0.01 0.54 0.96 0.68 -0.31 0.00 0.00 175.10 176.97 1u3o s VAL 22 N 0.24 4.80 0.01 1.32 -7.23 -1.06 -1.61 120.40 116.87 1u3o s VAL 22 Ca -0.11 1.94 0.17 0.00 -1.81 0.00 0.00 61.98 62.17 1u3o s VAL 22 Cb -0.16 -4.27 0.09 0.00 0.56 0.00 0.00 36.38 32.60 1u3o s VAL 22 CO 0.06 0.00 1.58 -0.07 -0.31 0.00 0.00 175.10 176.36 1u3o h LEU 23 N 8.13 0.00 -8.10 1.32 3.38 0.67 0.11 115.31 120.81 1u3o h LEU 23 Ca -0.30 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.51 1u3o h LEU 23 Cb 1.14 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.70 1u3o h LEU 23 CO 0.86 0.46 -0.70 0.00 0.09 0.00 0.00 178.44 179.15 1u3o s GLN 24 N -3.25 0.44 0.47 1.13 -2.07 -1.18 -4.66 119.66 110.54 1u3o s GLN 24 Ca 0.02 -0.85 -0.23 0.00 -1.82 0.00 0.00 55.36 52.49 1u3o s GLN 24 Cb 0.09 0.10 -0.07 0.00 -1.09 0.00 0.00 33.01 32.04 1u3o s GLN 24 CO 0.72 -0.06 1.19 -0.51 -1.32 0.00 0.00 175.29 175.31 1u3o s ASP 25 N -2.00 6.05 0.03 12.60 1.11 -1.26 -4.14 116.67 129.05 1u3o s ASP 25 Ca -0.07 2.36 -0.07 0.00 0.18 0.00 0.00 52.55 54.95 1u3o s ASP 25 Cb -0.04 -2.61 -0.00 0.00 1.07 0.00 0.00 42.92 41.34 1u3o s ASP 25 CO -0.04 -1.00 0.13 0.12 1.18 0.00 0.00 175.17 175.56 1u3o s PHE 26 N -1.52 0.12 -0.03 4.23 5.36 0.34 -4.91 117.98 121.58 1u3o s PHE 26 Ca 0.65 -0.35 0.05 0.00 -0.96 0.00 0.00 56.93 56.31 1u3o s PHE 26 Cb -0.30 -0.09 -0.01 0.00 -0.34 0.00 0.00 43.02 42.28 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 -1.95 2.02 0.77 6.13 1.04 -1.26 0.12 113.70 120.57 1u3o s SER 27 Ca -0.07 -0.32 -0.07 0.00 0.48 0.00 0.00 55.95 55.97 1u3o s SER 27 Cb -0.03 -0.41 0.11 0.00 0.10 0.00 0.00 66.02 65.80 1u3o s SER 27 CO -0.03 0.17 0.25 0.00 0.98 0.00 0.00 173.24 174.61 1u3o n ALA 28 N 2.93 -1.51 0.00 5.32 0.00 -1.11 -4.82 120.51 121.32 1u3o n ALA 28 Ca -0.16 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.84 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 -3.18 0.00 -2.22 0.00 0.00 -1.26 -4.91 120.51 108.94 1u3o n ALA 29 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.16 1u3o n ALA 29 Cb 0.17 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.64 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 1.60 0.02 0.00 5.04 -1.26 -5.00 115.29 115.68 1u3o s HIS 30 Ca 0.00 -0.77 -0.04 0.00 -1.54 0.00 0.00 55.06 52.71 1u3o s HIS 30 Cb 0.00 -2.06 -0.01 0.00 0.04 0.00 0.00 32.58 30.54 1u3o s HIS 30 CO 0.00 -0.76 1.07 1.03 -2.34 0.00 0.00 174.74 173.74 1u3o h SER 31 N 0.51 -0.24 -0.74 9.88 0.87 -2.01 -2.26 113.55 119.56 1u3o h SER 31 Ca -0.34 0.03 -0.44 0.00 -1.23 0.00 0.00 61.79 59.81 1u3o h SER 31 Cb 1.29 0.10 -0.18 0.00 -0.44 0.00 0.00 62.40 63.17 1u3o h SER 31 CO 0.50 -0.05 0.53 -1.20 -0.53 0.00 0.00 176.83 176.07 1u3o n SER 32 N -3.03 6.76 -4.81 6.23 7.64 -1.26 -4.93 113.62 120.22 1u3o n SER 32 Ca -0.01 -3.26 -0.26 0.00 1.01 0.00 0.00 58.87 56.35 1u3o n SER 32 Cb 0.04 -1.07 -0.05 0.00 -1.01 0.00 0.00 64.21 62.12 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 -2.29 2.94 0.18 1.43 2.02 -0.85 -1.71 118.70 120.42 1u3o s GLU 33 Ca 0.43 -0.85 -0.15 0.00 0.02 0.00 0.00 54.97 54.42 1u3o s GLU 33 Cb 0.33 -2.67 0.02 0.00 0.10 0.00 0.00 34.13 31.91 1u3o s GLU 33 CO -0.06 0.49 0.45 -0.48 0.02 0.00 0.00 175.26 175.68 1u3o s LEU 34 N -3.12 0.33 -0.07 1.80 0.05 -1.24 -4.69 118.68 111.75 1u3o s LEU 34 Ca 0.31 -0.58 -0.21 0.00 0.05 0.00 0.00 54.13 53.70 1u3o s LEU 34 Cb -0.10 1.88 -0.04 0.00 -2.05 0.00 0.00 46.19 45.87 1u3o s LEU 34 CO 0.24 -1.00 0.61 -0.94 -0.55 0.00 0.00 176.35 174.71 1u3o s SER 35 N -2.89 6.89 0.30 1.48 1.04 -1.26 -2.76 113.70 116.50 1u3o s SER 35 Ca 0.11 1.07 0.03 0.00 0.48 0.00 0.00 55.95 57.64 1u3o s SER 35 Cb 0.00 -2.36 -0.06 0.00 0.10 0.00 0.00 66.02 63.70 1u3o s SER 35 CO -0.03 -0.03 0.08 0.27 0.98 0.00 0.00 173.24 174.51 1u3o s ILE 36 N 0.53 0.92 0.19 -1.02 -5.25 0.33 -4.95 121.20 111.95 1u3o s ILE 36 Ca 0.33 -2.00 0.06 0.00 -0.99 0.00 0.00 60.65 58.05 1u3o s ILE 36 Cb -0.17 -2.72 -0.05 0.00 2.95 0.00 0.00 42.46 42.47 1u3o s ILE 36 CO 0.16 0.00 -0.12 -1.10 -1.79 0.00 0.00 174.94 172.09 1u3o s GLN 37 N -3.94 1.24 -0.15 0.37 1.11 -1.26 -0.51 119.66 116.53 1u3o s GLN 37 Ca 0.37 -1.55 -0.29 0.00 0.01 0.00 0.00 55.36 53.89 1u3o s GLN 37 Cb 0.08 -0.91 -0.02 0.00 -1.01 0.00 0.00 33.01 31.15 1u3o s GLN 37 CO 0.15 0.12 1.36 0.54 0.01 0.00 0.00 175.29 177.47 1u3o s VAL 38 N -3.13 4.11 0.00 1.09 0.11 -1.26 -3.42 120.40 117.90 1u3o s VAL 38 Ca 0.21 1.33 0.00 0.00 -2.93 0.00 0.00 61.98 60.59 1u3o s VAL 38 Cb 0.01 -3.88 0.00 0.00 -1.53 0.00 0.00 36.38 30.98 1u3o s VAL 38 CO 0.05 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.28 1u3o n GLY 39 N 3.79 2.34 3.74 6.54 0.00 0.37 -4.94 105.19 117.03 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 -0.25 0.96 -0.20 1.61 -2.07 -1.22 -4.82 119.66 113.67 1u3o s GLN 40 Ca 0.00 0.48 0.01 0.00 -1.82 0.00 0.00 55.36 54.03 1u3o s GLN 40 Cb 0.00 -1.80 0.03 0.00 -1.09 0.00 0.00 33.01 30.15 1u3o s GLN 40 CO 0.00 -2.36 -0.16 0.99 -1.32 0.00 0.00 175.29 172.44 1u3o s THR 41 N -3.10 2.00 -0.01 3.63 2.01 -1.26 -2.56 115.64 116.35 1u3o s THR 41 Ca 0.64 -1.09 0.02 0.00 0.31 0.00 0.00 61.69 61.57 1u3o s THR 41 Cb -0.17 -1.92 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 1u3o s THR 41 CO 0.56 0.35 -0.07 -0.69 -0.69 0.00 0.00 174.62 174.07 1u3o s VAL 42 N 1.27 0.60 0.05 3.82 1.01 0.24 -4.91 120.40 122.47 1u3o s VAL 42 Ca 0.01 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1u3o s VAL 42 Cb -0.15 -0.52 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 1u3o s VAL 42 CO -0.10 0.18 1.05 -1.83 0.00 0.00 0.00 175.10 174.39 1u3o s GLU 43 N -0.06 4.55 0.43 2.72 -1.05 -1.24 -0.59 118.70 123.46 1u3o s GLU 43 Ca 0.01 1.55 -0.22 0.00 -0.15 0.00 0.00 54.97 56.15 1u3o s GLU 43 Cb -0.04 -3.40 -0.09 0.00 -0.44 0.00 0.00 34.13 30.16 1u3o s GLU 43 CO -0.00 -0.06 1.05 -0.48 0.95 0.00 0.00 175.26 176.72 1u3o s LEU 44 N 0.76 4.02 -0.07 1.83 0.05 0.40 0.12 118.68 125.79 1u3o s LEU 44 Ca 0.53 2.00 -0.07 0.00 0.05 0.00 0.00 54.13 56.63 1u3o s LEU 44 Cb -0.24 -4.34 -0.04 0.00 -2.05 0.00 0.00 46.19 39.52 1u3o s LEU 44 CO 0.29 -0.61 0.30 -0.07 -0.55 0.00 0.00 176.35 175.71 1u3o h LEU 45 N 2.11 -0.21 0.00 1.48 3.38 -1.82 -2.63 115.31 117.62 1u3o h LEU 45 Ca -0.49 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1u3o h LEU 45 Cb 1.22 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u3o h LEU 45 CO 0.61 0.27 0.00 -1.84 0.09 0.00 0.00 178.44 177.57 1u3o n GLU 46 N -4.94 1.63 -4.23 1.13 0.28 -1.26 -4.38 120.64 108.87 1u3o n GLU 46 Ca -0.03 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.84 1u3o n GLU 46 Cb 0.11 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.87 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 1.40 1.20 -0.52 3.44 0.52 -1.26 -4.50 118.95 119.22 1u3o s ARG 47 Ca 0.00 -1.62 -0.28 0.00 -0.52 0.00 0.00 55.73 53.31 1u3o s ARG 47 Cb 0.00 0.02 -0.29 0.00 0.52 0.00 0.00 34.95 35.20 1u3o s ARG 47 CO 0.00 -0.30 1.82 -0.35 0.02 0.00 0.00 175.30 176.49 1u3o n PRO 48 N -0.29 0.33 -0.05 3.54 -0.04 -1.26 -4.57 135.00 132.67 1u3o n PRO 48 Ca -0.01 -1.44 -0.19 0.00 -0.04 0.00 0.00 63.50 61.82 1u3o n PRO 48 Cb 0.65 -3.10 -0.13 0.00 -0.04 0.00 0.00 33.50 30.89 1u3o n PRO 48 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1u3o h SER 49 N 10.25 0.14 0.07 3.54 0.87 -1.96 -3.41 113.55 123.05 1u3o h SER 49 Ca 0.20 -0.80 -0.37 0.00 -1.23 0.00 0.00 61.79 59.58 1u3o h SER 49 Cb 0.81 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.67 1u3o h SER 49 CO 1.65 1.36 -2.28 -1.84 -0.53 0.00 0.00 176.83 175.20 1u3o n GLU 50 N -4.32 0.69 -4.84 2.24 0.28 -1.26 -4.90 120.64 108.52 1u3o n GLU 50 Ca -0.21 0.18 -0.33 0.00 -0.16 0.00 0.00 57.16 56.63 1u3o n GLU 50 Cb 0.69 -1.59 -0.15 0.00 1.43 0.00 0.00 31.44 31.81 1u3o n GLU 50 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1u3o s ARG 51 N -2.53 3.29 -0.29 3.44 1.70 -1.26 -5.11 118.95 118.19 1u3o s ARG 51 Ca -0.26 -0.74 -0.15 0.00 -0.47 0.00 0.00 55.73 54.11 1u3o s ARG 51 Cb 0.08 -2.56 -0.03 0.00 -0.57 0.00 0.00 34.95 31.87 1u3o s ARG 51 CO 0.69 0.18 0.35 -1.25 -1.08 0.00 0.00 175.30 174.20 1u3o s PRO 52 N 0.41 3.90 0.00 3.89 0.04 -1.26 -4.16 135.00 137.82 1u3o s PRO 52 Ca -0.12 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 60.82 1u3o s PRO 52 Cb -0.16 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.69 1u3o s PRO 52 CO 0.06 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1u3o n GLY 53 N 4.79 1.24 3.92 0.56 0.00 -1.26 -5.06 105.19 109.38 1u3o n GLY 53 Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 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 3.04 0.07 1.61 1.48 -1.26 0.24 118.94 122.12 1u3o s TRP 54 Ca 0.00 -0.24 -0.22 0.00 -1.06 0.00 0.00 56.10 54.58 1u3o s TRP 54 Cb 0.00 -1.86 0.05 0.00 -1.16 0.00 0.00 33.47 30.51 1u3o s TRP 54 CO 0.00 0.12 0.52 0.00 -4.06 0.00 0.00 176.95 173.54 1u3o s LEU 56 N -2.17 3.50 -0.04 0.00 1.02 -1.26 -1.09 118.68 118.64 1u3o s LEU 56 Ca -0.03 -0.46 -0.00 0.00 0.02 0.00 0.00 54.13 53.65 1u3o s LEU 56 Cb -0.00 -2.03 0.03 0.00 0.02 0.00 0.00 46.19 44.20 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 -2.24 0.15 -0.12 -1.59 -7.23 0.30 -3.68 120.40 105.99 1u3o s VAL 57 Ca 0.33 0.17 -0.06 0.00 -1.81 0.00 0.00 61.98 60.60 1u3o s VAL 57 Cb -0.07 -0.29 -0.04 0.00 0.56 0.00 0.00 36.38 36.54 1u3o s VAL 57 CO 0.23 0.17 0.09 -0.60 -0.31 0.00 0.00 175.10 174.68 1u3o s ARG 58 N 1.44 3.40 -0.21 4.82 6.06 0.34 0.17 118.95 134.97 1u3o s ARG 58 Ca -0.04 -0.23 -0.12 0.00 -2.50 0.00 0.00 55.73 52.84 1u3o s ARG 58 Cb -0.13 -3.09 -0.05 0.00 0.06 0.00 0.00 34.95 31.74 1u3o s ARG 58 CO -0.03 0.69 0.24 0.99 -2.50 0.00 0.00 175.30 174.70 1u3o s THR 59 N -0.79 5.32 0.00 4.11 2.01 0.10 -3.62 115.64 122.77 1u3o s THR 59 Ca 0.13 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.52 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 0.34 0.00 1.07 -0.69 0.00 0.00 174.62 175.37 1u3o n THR 60 N 4.03 0.00 0.91 -0.82 5.66 -1.26 -1.92 114.28 120.89 1u3o n THR 60 Ca -0.13 -0.33 0.04 0.00 -3.05 0.00 0.00 64.05 60.58 1u3o n THR 60 Cb 0.52 0.83 0.13 0.00 -1.55 0.00 0.00 70.33 70.26 1u3o n THR 60 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1u3o n GLU 61 N -1.16 1.84 -3.44 1.09 1.02 -1.26 -4.51 120.64 114.22 1u3o n GLU 61 Ca 0.00 -1.05 -0.22 0.00 -0.02 0.00 0.00 57.16 55.86 1u3o n GLU 61 Cb 0.00 -1.35 -0.11 0.00 -0.02 0.00 0.00 31.44 29.96 1u3o n GLU 61 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1u3o s ARG 62 N -1.63 0.37 0.01 3.49 3.52 -1.26 -5.13 118.95 118.31 1u3o s ARG 62 Ca 0.19 -0.56 -0.26 0.00 -0.13 0.00 0.00 55.73 54.98 1u3o s ARG 62 Cb 0.11 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.55 1u3o s ARG 62 CO 0.11 -1.08 0.81 0.45 -0.81 0.00 0.00 175.30 174.77 1u3o s SER 63 N 1.93 7.20 0.59 -2.12 0.15 -1.26 -2.77 113.70 117.41 1u3o s SER 63 Ca 0.12 1.44 -0.16 0.00 0.70 0.00 0.00 55.95 58.04 1u3o s SER 63 Cb -0.16 -2.48 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 1u3o s SER 63 CO -0.24 -0.09 1.07 -2.84 1.20 0.00 0.00 173.24 172.34 1u3o s PRO 64 N 0.45 3.30 0.99 5.44 0.02 -1.26 -5.12 135.00 138.82 1u3o s PRO 64 Ca 0.42 1.29 -0.16 0.00 0.02 0.00 0.00 61.00 62.56 1u3o s PRO 64 Cb -0.20 -2.03 -0.09 0.00 0.02 0.00 0.00 34.50 32.21 1u3o s PRO 64 CO 0.23 -0.84 -0.45 -2.30 -0.33 0.00 0.00 177.00 173.31 1u3o n PRO 65 N -1.89 -0.14 -4.44 5.54 -0.02 -1.11 -5.01 135.00 127.92 1u3o n PRO 65 Ca 0.09 -0.03 -0.21 0.00 -2.02 0.00 0.00 63.50 61.33 1u3o n PRO 65 Cb 0.52 -1.29 -0.10 0.00 -0.02 0.00 0.00 33.50 32.61 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 -2.55 1.64 0.05 -0.52 -0.21 -0.81 -4.92 119.66 112.34 1u3o s GLN 66 Ca 0.45 -1.91 0.03 0.00 0.02 0.00 0.00 55.36 53.95 1u3o s GLN 66 Cb -0.17 -0.80 -0.02 0.00 1.00 0.00 0.00 33.01 33.02 1u3o s GLN 66 CO 0.77 -0.21 -0.09 -1.21 -2.12 0.00 0.00 175.29 172.43 1u3o s GLU 67 N -3.90 0.58 0.08 2.91 8.01 -1.26 0.03 118.70 125.15 1u3o s GLU 67 Ca 0.36 -0.77 -0.01 0.00 0.01 0.00 0.00 54.97 54.56 1u3o s GLU 67 Cb 0.08 -0.41 -0.04 0.00 -4.31 0.00 0.00 34.13 29.46 1u3o s GLU 67 CO 0.15 0.08 0.01 0.20 0.01 0.00 0.00 175.26 175.71 1u3o s GLY 68 N -1.53 0.63 -0.01 -1.39 0.00 0.46 -3.08 107.32 102.39 1u3o s GLY 68 Ca -0.08 -1.27 -0.00 0.00 0.00 0.00 0.00 44.72 43.37 1u3o s GLY 68 CO 0.01 -1.31 0.02 1.08 0.00 0.00 0.00 173.10 172.90 1u3o s LEU 69 N -2.96 1.40 0.30 0.66 1.02 -1.23 -0.54 118.68 117.33 1u3o s LEU 69 Ca 0.13 0.03 -0.20 0.00 0.02 0.00 0.00 54.13 54.11 1u3o s LEU 69 Cb 0.08 -0.04 0.03 0.00 0.02 0.00 0.00 46.19 46.28 1u3o s LEU 69 CO -0.06 -0.08 0.73 0.68 0.02 0.00 0.00 176.35 177.64 1u3o s VAL 70 N 0.69 0.00 0.37 -1.59 -7.23 -0.25 -4.87 120.40 107.52 1u3o s VAL 70 Ca -0.06 -1.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 1u3o s VAL 70 Cb -0.08 -2.21 -0.07 0.00 0.56 0.00 0.00 36.38 34.58 1u3o s VAL 70 CO -0.02 0.00 0.75 -2.16 -0.31 0.00 0.00 175.10 173.36 1u3o s PRO 71 N -3.55 3.84 0.59 4.82 0.04 -1.26 0.23 135.00 139.72 1u3o s PRO 71 Ca 0.12 0.51 0.29 0.00 0.04 0.00 0.00 61.00 61.96 1u3o s PRO 71 Cb -0.06 -2.42 1.36 0.00 0.04 0.00 0.00 34.50 33.43 1u3o s PRO 71 CO 0.08 0.04 1.75 1.03 0.04 0.00 0.00 177.00 179.94 1u3o h SER 72 N 1.60 0.00 -0.49 6.66 0.87 0.30 0.45 113.55 122.95 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 1.18 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 1u3o h SER 72 CO 0.64 0.00 0.32 0.28 -0.53 0.00 0.00 176.83 177.55 1u3o h SER 73 N 0.00 0.54 -0.02 6.23 0.02 -1.89 -1.14 113.55 117.28 1u3o h SER 73 Ca 0.31 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1u3o h SER 73 Cb 1.68 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 64.09 1u3o h SER 73 CO -0.00 0.38 -0.16 0.35 -1.14 0.00 0.00 176.83 176.27 1u3o n THR 74 N -4.47 0.00 -4.50 -2.27 -2.24 0.15 -4.55 114.28 96.40 1u3o n THR 74 Ca 0.04 -0.42 -0.22 0.00 -2.27 0.00 0.00 64.05 61.19 1u3o n THR 74 Cb 0.07 1.40 -0.05 0.00 -2.10 0.00 0.00 70.33 69.66 1u3o n THR 74 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1u3o n LEU 75 N 0.88 0.00 -4.72 3.22 4.32 -0.43 0.12 117.00 120.39 1u3o n LEU 75 Ca 0.13 -2.25 -0.38 0.00 -0.02 0.00 0.00 56.01 53.48 1u3o n LEU 75 Cb 0.55 0.35 0.05 0.00 -1.62 0.00 0.00 43.42 42.75 1u3o n LEU 75 CO 0.19 -0.32 0.92 0.00 -1.22 0.00 0.00 177.39 176.96 1u3o s ILE 77 N -1.32 0.38 -0.30 0.00 -4.36 -1.26 -4.81 121.20 109.53 1u3o s ILE 77 Ca 0.74 -1.02 0.17 0.00 -0.26 0.00 0.00 60.65 60.28 1u3o s ILE 77 Cb -0.41 -0.48 0.44 0.00 1.25 0.00 0.00 42.46 43.26 1u3o s ILE 77 CO 0.47 -0.42 1.35 -1.20 0.24 0.00 0.00 174.94 175.39 1u3o n SER 78 N 1.52 -0.20 0.04 4.36 7.64 -1.26 -4.99 113.62 120.73 1u3o n SER 78 Ca -0.23 -2.13 0.00 0.00 1.01 0.00 0.00 58.87 57.52 1u3o n SER 78 Cb 0.55 0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 1u3o n SER 78 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1u3o n HIS 79 N -1.11 -2.24 1.75 1.43 -0.00 -1.26 -5.31 115.22 108.48 1u3o n HIS 79 Ca -0.08 0.30 0.15 0.00 -0.00 0.00 0.00 57.72 58.09 1u3o n HIS 79 Cb 0.85 1.01 0.73 0.00 -0.00 0.00 0.00 29.99 32.58 1u3o n HIS 79 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77