#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 -0.46 0.00 0.46 0.00 -1.26 -5.12 105.19 98.81 1u3o n GLY 15 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 1.40 0.50 2.96 -0.02 0.00 -1.26 -5.08 105.19 103.69 1u3o n GLY 16 Ca -0.52 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 44.53 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 0.45 1.00 0.02 0.00 2.12 -0.94 -4.92 118.70 116.44 1u3o s GLU 18 Ca -0.06 -0.99 -0.30 0.00 0.36 0.00 0.00 54.97 53.97 1u3o s GLU 18 Cb -0.10 -1.11 -0.04 0.00 0.26 0.00 0.00 34.13 33.13 1u3o s GLU 18 CO 0.00 0.26 1.08 -0.51 -0.54 0.00 0.00 175.26 175.55 1u3o s LEU 19 N -1.63 4.37 0.01 2.70 1.43 -1.26 0.19 118.68 124.48 1u3o s LEU 19 Ca 0.02 1.81 -0.00 0.00 -1.03 0.00 0.00 54.13 54.93 1u3o s LEU 19 Cb -0.09 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.54 1u3o s LEU 19 CO 0.03 -0.36 -0.01 0.28 0.23 0.00 0.00 176.35 176.52 1u3o s THR 20 N 1.07 0.07 -0.08 5.49 -1.32 -0.24 -4.84 115.64 115.79 1u3o s THR 20 Ca 0.55 -0.57 -0.01 0.00 -1.21 0.00 0.00 61.69 60.45 1u3o s THR 20 Cb -0.25 -0.18 -0.03 0.00 -1.51 0.00 0.00 72.50 70.53 1u3o s THR 20 CO 0.28 -0.31 -0.03 0.68 -2.21 0.00 0.00 174.62 173.03 1u3o s VAL 21 N -0.92 4.02 -0.13 5.08 -7.23 -1.26 -0.36 120.40 119.60 1u3o s VAL 21 Ca -0.10 -0.36 -0.25 0.00 -1.81 0.00 0.00 61.98 59.47 1u3o s VAL 21 Cb -0.06 -2.67 -0.02 0.00 0.56 0.00 0.00 36.38 34.18 1u3o s VAL 21 CO -0.01 0.60 0.78 0.68 -0.31 0.00 0.00 175.10 176.85 1u3o s VAL 22 N -0.84 4.94 0.10 1.32 -7.23 -1.04 -1.15 120.40 116.50 1u3o s VAL 22 Ca 0.13 1.56 0.15 0.00 -1.81 0.00 0.00 61.98 62.01 1u3o s VAL 22 Cb -0.11 -4.10 0.06 0.00 0.56 0.00 0.00 36.38 32.78 1u3o s VAL 22 CO 0.02 0.10 1.60 -0.07 -0.31 0.00 0.00 175.10 176.44 1u3o h LEU 23 N 7.80 0.00 -7.96 1.32 3.38 0.55 0.58 115.31 120.98 1u3o h LEU 23 Ca -0.33 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.46 1u3o h LEU 23 Cb 1.16 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.69 1u3o h LEU 23 CO 0.80 0.51 -0.70 0.00 0.09 0.00 0.00 178.44 179.14 1u3o s GLN 24 N -3.35 0.28 0.51 1.13 -2.07 -1.18 -4.70 119.66 110.29 1u3o s GLN 24 Ca 0.01 -0.55 -0.21 0.00 -1.82 0.00 0.00 55.36 52.79 1u3o s GLN 24 Cb 0.10 0.10 -0.06 0.00 -1.09 0.00 0.00 33.01 32.06 1u3o s GLN 24 CO 0.73 -0.05 1.18 -0.51 -1.32 0.00 0.00 175.29 175.32 1u3o s ASP 25 N -1.32 5.82 0.02 12.60 1.11 -1.26 -4.14 116.67 129.50 1u3o s ASP 25 Ca -0.14 2.33 -0.07 0.00 0.18 0.00 0.00 52.55 54.84 1u3o s ASP 25 Cb -0.09 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.30 1u3o s ASP 25 CO -0.01 -1.16 0.14 0.12 1.18 0.00 0.00 175.17 175.44 1u3o s PHE 26 N -1.59 0.10 -0.04 4.23 5.36 0.97 -4.90 117.98 122.11 1u3o s PHE 26 Ca 0.69 -0.29 0.05 0.00 -0.96 0.00 0.00 56.93 56.42 1u3o s PHE 26 Cb -0.29 -0.07 -0.01 0.00 -0.34 0.00 0.00 43.02 42.31 1u3o s PHE 26 CO 0.34 -0.35 -0.19 -1.54 -1.46 0.00 0.00 175.22 172.01 1u3o s SER 27 N -1.82 2.35 0.75 6.13 1.04 -1.26 0.12 113.70 121.01 1u3o s SER 27 Ca -0.09 -0.38 -0.07 0.00 0.48 0.00 0.00 55.95 55.89 1u3o s SER 27 Cb -0.04 -0.55 0.11 0.00 0.10 0.00 0.00 66.02 65.64 1u3o s SER 27 CO -0.02 0.19 0.24 0.00 0.98 0.00 0.00 173.24 174.64 1u3o n ALA 28 N 2.97 -1.48 0.00 5.32 0.00 -1.10 -4.83 120.51 121.39 1u3o n ALA 28 Ca -0.17 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1u3o n ALA 28 Cb 0.53 -0.04 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 -3.19 0.00 -2.00 0.00 0.00 -1.26 -4.92 120.51 109.14 1u3o n ALA 29 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.20 1u3o n ALA 29 Cb 0.17 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.65 1u3o n ALA 29 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1u3o s HIS 30 N 0.00 2.57 0.12 0.00 3.76 -1.26 -4.99 115.29 115.49 1u3o s HIS 30 Ca 0.00 -0.32 -0.31 0.00 -0.15 0.00 0.00 55.06 54.28 1u3o s HIS 30 Cb 0.00 -2.51 -0.09 0.00 1.11 0.00 0.00 32.58 31.10 1u3o s HIS 30 CO 0.00 -0.73 1.58 1.03 -0.85 0.00 0.00 174.74 175.77 1u3o h SER 31 N 0.34 -1.38 -0.85 1.40 0.87 -2.01 -2.17 113.55 109.75 1u3o h SER 31 Ca -0.39 0.17 -0.55 0.00 -1.23 0.00 0.00 61.79 59.79 1u3o h SER 31 Cb 1.29 0.54 -0.25 0.00 -0.44 0.00 0.00 62.40 63.54 1u3o h SER 31 CO 0.46 -0.47 0.70 -0.24 -0.53 0.00 0.00 176.83 176.76 1u3o n SER 32 N -5.45 6.50 -4.82 6.23 2.88 -1.26 -4.95 113.62 112.75 1u3o n SER 32 Ca -0.06 -3.53 -0.24 0.00 -1.33 0.00 0.00 58.87 53.71 1u3o n SER 32 Cb 0.38 -0.95 -0.05 0.00 -0.75 0.00 0.00 64.21 62.84 1u3o n SER 32 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1u3o s GLU 33 N -3.14 2.97 0.21 -1.46 0.41 -0.82 -1.89 118.70 114.98 1u3o s GLU 33 Ca 0.54 -0.92 -0.16 0.00 -0.41 0.00 0.00 54.97 54.02 1u3o s GLU 33 Cb 0.43 -2.65 0.02 0.00 -1.78 0.00 0.00 34.13 30.15 1u3o s GLU 33 CO 0.01 0.45 0.51 -0.48 -0.49 0.00 0.00 175.26 175.27 1u3o s LEU 34 N -3.42 0.18 -0.17 1.80 0.05 -1.24 -4.69 118.68 111.19 1u3o s LEU 34 Ca 0.32 -0.64 -0.22 0.00 0.05 0.00 0.00 54.13 53.64 1u3o s LEU 34 Cb -0.09 2.03 -0.03 0.00 -2.05 0.00 0.00 46.19 46.05 1u3o s LEU 34 CO 0.24 -1.09 0.68 -0.94 -0.55 0.00 0.00 176.35 174.69 1u3o s SER 35 N -2.92 6.79 0.30 1.48 1.04 -1.26 -2.72 113.70 116.41 1u3o s SER 35 Ca 0.13 0.97 0.08 0.00 0.48 0.00 0.00 55.95 57.61 1u3o s SER 35 Cb -0.01 -2.38 -0.06 0.00 0.10 0.00 0.00 66.02 63.67 1u3o s SER 35 CO 0.01 -0.27 -0.08 0.27 0.98 0.00 0.00 173.24 174.16 1u3o s ILE 36 N 1.74 1.86 0.06 -1.02 -0.00 0.33 -4.95 121.20 119.22 1u3o s ILE 36 Ca 0.32 -2.16 0.05 0.00 -0.00 0.00 0.00 60.65 58.86 1u3o s ILE 36 Cb -0.16 -2.49 -0.03 0.00 -0.00 0.00 0.00 42.46 39.78 1u3o s ILE 36 CO 0.12 -0.29 -0.14 -1.10 -0.00 0.00 0.00 174.94 173.53 1u3o s GLN 37 N -3.68 0.85 0.18 0.37 -0.21 -1.26 -0.02 119.66 115.89 1u3o s GLN 37 Ca 0.30 -0.91 -0.32 0.00 0.02 0.00 0.00 55.36 54.46 1u3o s GLN 37 Cb 0.03 -0.86 -0.11 0.00 1.00 0.00 0.00 33.01 33.06 1u3o s GLN 37 CO 0.13 0.20 1.68 0.54 -2.12 0.00 0.00 175.29 175.72 1u3o s VAL 38 N -1.16 2.30 0.00 1.09 0.11 -1.26 -2.85 120.40 118.63 1u3o s VAL 38 Ca -0.01 0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 1u3o s VAL 38 Cb -0.09 -3.11 0.00 0.00 -1.53 0.00 0.00 36.38 31.64 1u3o s VAL 38 CO 0.02 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 1u3o n GLY 39 N 3.94 2.08 3.73 6.54 0.00 0.20 -4.93 105.19 116.74 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 -0.02 0.98 -0.12 1.61 -2.07 -1.13 -4.81 119.66 114.10 1u3o s GLN 40 Ca 0.00 0.55 0.02 0.00 -1.82 0.00 0.00 55.36 54.12 1u3o s GLN 40 Cb 0.00 -1.80 0.01 0.00 -1.09 0.00 0.00 33.01 30.13 1u3o s GLN 40 CO 0.00 -2.36 -0.20 0.99 -1.32 0.00 0.00 175.29 172.40 1u3o s THR 41 N -3.05 1.88 -0.02 3.63 2.01 -1.26 -2.51 115.64 116.32 1u3o s THR 41 Ca 0.64 -0.88 -0.02 0.00 0.31 0.00 0.00 61.69 61.74 1u3o s THR 41 Cb -0.17 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.68 1u3o s THR 41 CO 0.56 0.52 0.06 -0.69 -0.69 0.00 0.00 174.62 174.38 1u3o s VAL 42 N 0.79 0.02 0.05 3.82 1.01 0.51 -4.96 120.40 121.64 1u3o s VAL 42 Ca -0.09 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.45 1u3o s VAL 42 Cb -0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 1u3o s VAL 42 CO -0.00 -0.08 1.03 -1.83 0.00 0.00 0.00 175.10 174.23 1u3o s GLU 43 N -0.21 4.57 0.41 2.72 -1.05 -1.24 -1.08 118.70 122.82 1u3o s GLU 43 Ca -0.03 1.53 -0.23 0.00 -0.15 0.00 0.00 54.97 56.09 1u3o s GLU 43 Cb -0.02 -3.40 -0.09 0.00 -0.44 0.00 0.00 34.13 30.18 1u3o s GLU 43 CO 0.00 -0.03 1.02 -0.48 0.95 0.00 0.00 175.26 176.72 1u3o s LEU 44 N 0.68 4.08 -0.11 1.83 0.05 0.49 0.12 118.68 125.82 1u3o s LEU 44 Ca 0.52 1.93 -0.28 0.00 0.05 0.00 0.00 54.13 56.35 1u3o s LEU 44 Cb -0.24 -4.29 -0.25 0.00 -2.05 0.00 0.00 46.19 39.36 1u3o s LEU 44 CO 0.29 -0.47 0.87 -0.07 -0.55 0.00 0.00 176.35 176.42 1u3o h LEU 45 N 2.32 0.03 -7.22 1.48 3.38 -1.82 -2.49 115.31 110.99 1u3o h LEU 45 Ca -0.48 -0.90 -0.10 0.00 0.09 0.00 0.00 57.88 56.48 1u3o h LEU 45 Cb 1.21 -0.01 -0.24 0.00 0.09 0.00 0.00 40.66 41.71 1u3o h LEU 45 CO 0.62 0.93 -0.18 -1.83 0.09 0.00 0.00 178.44 178.06 1u3o s GLU 46 N -2.60 0.52 0.74 1.13 -1.05 -1.26 -4.42 118.70 111.76 1u3o s GLU 46 Ca -0.18 0.74 -0.10 0.00 -0.15 0.00 0.00 54.97 55.28 1u3o s GLU 46 Cb -0.02 0.18 0.05 0.00 -0.44 0.00 0.00 34.13 33.90 1u3o s GLU 46 CO 0.69 -0.10 1.10 1.03 0.95 0.00 0.00 175.26 178.93 1u3o s ARG 47 N 0.69 2.30 -0.61 -4.83 0.52 -1.26 -4.09 118.95 111.67 1u3o s ARG 47 Ca -0.04 0.09 -0.24 0.00 -0.52 0.00 0.00 55.73 55.02 1u3o s ARG 47 Cb -0.05 -2.05 -0.25 0.00 0.52 0.00 0.00 34.95 33.13 1u3o s ARG 47 CO -0.05 -1.31 1.78 -0.35 0.02 0.00 0.00 175.30 175.39 1u3o n PRO 48 N -3.09 0.05 -0.05 3.54 -0.04 -1.25 -4.59 135.00 129.57 1u3o n PRO 48 Ca 0.07 -1.26 -0.19 0.00 -0.04 0.00 0.00 63.50 62.08 1u3o n PRO 48 Cb 0.60 -3.11 -0.13 0.00 -0.04 0.00 0.00 33.50 30.82 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 10.72 0.14 0.00 3.54 0.87 -1.94 -3.41 113.55 123.47 1u3o h SER 49 Ca 0.08 -0.78 -0.38 0.00 -1.23 0.00 0.00 61.79 59.48 1u3o h SER 49 Cb 0.89 -0.05 -0.07 0.00 -0.44 0.00 0.00 62.40 62.73 1u3o h SER 49 CO 1.29 1.39 -2.43 -1.84 -0.53 0.00 0.00 176.83 174.71 1u3o n GLU 50 N -4.30 0.66 -4.21 2.24 0.28 -1.26 -4.91 120.64 109.14 1u3o n GLU 50 Ca -0.23 0.12 -0.34 0.00 -0.16 0.00 0.00 57.16 56.55 1u3o n GLU 50 Cb 0.70 -1.51 -0.14 0.00 1.43 0.00 0.00 31.44 31.93 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 -2.50 3.46 -0.28 3.44 1.70 -1.26 -5.10 118.95 118.40 1u3o s ARG 51 Ca -0.30 -0.61 -0.15 0.00 -0.47 0.00 0.00 55.73 54.20 1u3o s ARG 51 Cb 0.08 -2.92 -0.03 0.00 -0.57 0.00 0.00 34.95 31.52 1u3o s ARG 51 CO 0.62 -0.01 0.39 -1.25 -1.08 0.00 0.00 175.30 173.98 1u3o s PRO 52 N 0.98 3.94 0.00 3.89 0.04 -1.26 -4.11 135.00 138.47 1u3o s PRO 52 Ca -0.00 -0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.03 1u3o s PRO 52 Cb -0.15 -3.68 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1u3o s PRO 52 CO 0.00 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1u3o n GLY 53 N 4.71 1.30 3.87 0.56 0.00 -1.26 -5.06 105.19 109.30 1u3o n GLY 53 Ca -0.08 0.00 -0.21 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 -1.91 3.00 0.06 1.61 1.48 -1.26 0.20 118.94 122.12 1u3o s TRP 54 Ca 0.00 -0.24 -0.23 0.00 -1.06 0.00 0.00 56.10 54.57 1u3o s TRP 54 Cb 0.00 -1.73 0.06 0.00 -1.16 0.00 0.00 33.47 30.64 1u3o s TRP 54 CO 0.00 0.24 0.55 0.00 -4.06 0.00 0.00 176.95 173.68 1u3o s LEU 56 N -2.08 2.99 -0.05 0.00 1.02 -1.26 -1.53 118.68 117.76 1u3o s LEU 56 Ca -0.04 -0.79 -0.00 0.00 0.02 0.00 0.00 54.13 53.31 1u3o s LEU 56 Cb -0.00 -1.49 0.03 0.00 0.02 0.00 0.00 46.19 44.74 1u3o s LEU 56 CO -0.03 -0.00 -0.00 0.68 0.02 0.00 0.00 176.35 177.01 1u3o s VAL 57 N -2.40 0.32 -0.12 -1.59 -7.23 0.21 -3.65 120.40 105.95 1u3o s VAL 57 Ca 0.31 0.09 -0.06 0.00 -1.81 0.00 0.00 61.98 60.51 1u3o s VAL 57 Cb -0.06 -0.44 -0.04 0.00 0.56 0.00 0.00 36.38 36.40 1u3o s VAL 57 CO 0.18 0.22 0.10 -0.60 -0.31 0.00 0.00 175.10 174.69 1u3o s ARG 58 N 1.53 3.41 -0.22 4.82 6.06 0.32 0.18 118.95 135.05 1u3o s ARG 58 Ca -0.02 -0.22 -0.12 0.00 -2.50 0.00 0.00 55.73 52.86 1u3o s ARG 58 Cb -0.13 -3.11 -0.05 0.00 0.06 0.00 0.00 34.95 31.73 1u3o s ARG 58 CO -0.03 0.70 0.25 0.99 -2.50 0.00 0.00 175.30 174.70 1u3o s THR 59 N -0.81 5.30 -0.05 4.11 2.01 0.13 -3.64 115.64 122.69 1u3o s THR 59 Ca 0.13 0.38 0.02 0.00 0.31 0.00 0.00 61.69 62.52 1u3o s THR 59 Cb -0.12 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.79 1u3o s THR 59 CO 0.03 0.32 0.06 0.41 -0.69 0.00 0.00 174.62 174.74 1u3o n THR 60 N 4.26 0.00 0.94 -0.82 -1.04 -1.26 -1.92 114.28 114.43 1u3o n THR 60 Ca -0.13 -0.31 0.04 0.00 -2.04 0.00 0.00 64.05 61.62 1u3o n THR 60 Cb 0.52 0.80 0.13 0.00 -1.82 0.00 0.00 70.33 69.96 1u3o n THR 60 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1u3o n GLU 61 N -1.23 1.82 -3.44 -2.82 1.02 -1.26 -4.53 120.64 110.21 1u3o n GLU 61 Ca 0.00 -1.03 -0.22 0.00 -0.02 0.00 0.00 57.16 55.89 1u3o n GLU 61 Cb 0.03 -1.34 -0.11 0.00 -0.02 0.00 0.00 31.44 30.00 1u3o n GLU 61 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1u3o s ARG 62 N -1.64 0.37 0.00 3.49 0.52 -1.26 -5.13 118.95 115.30 1u3o s ARG 62 Ca 0.19 -0.56 -0.26 0.00 -0.52 0.00 0.00 55.73 54.58 1u3o s ARG 62 Cb 0.11 -0.91 -0.04 0.00 0.52 0.00 0.00 34.95 34.63 1u3o s ARG 62 CO 0.11 -1.08 0.81 -1.54 0.02 0.00 0.00 175.30 173.62 1u3o s SER 63 N 1.93 7.20 0.58 0.23 1.04 -1.26 -2.75 113.70 120.67 1u3o s SER 63 Ca 0.12 1.44 -0.17 0.00 0.48 0.00 0.00 55.95 57.83 1u3o s SER 63 Cb -0.16 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.43 1u3o s SER 63 CO -0.24 -0.10 1.06 -2.16 0.98 0.00 0.00 173.24 172.78 1u3o s PRO 64 N 0.50 3.35 1.01 4.02 0.04 -1.26 -5.12 135.00 137.54 1u3o s PRO 64 Ca 0.42 1.28 -0.20 0.00 0.04 0.00 0.00 61.00 62.54 1u3o s PRO 64 Cb -0.20 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 1u3o s PRO 64 CO 0.23 -0.79 -0.68 -2.30 0.04 0.00 0.00 177.00 173.50 1u3o n PRO 65 N -1.84 -0.29 -4.34 0.56 -0.02 -1.11 -5.01 135.00 122.95 1u3o n PRO 65 Ca 0.09 -0.07 -0.17 0.00 -2.02 0.00 0.00 63.50 61.32 1u3o n PRO 65 Cb 0.53 -1.26 -0.10 0.00 -0.02 0.00 0.00 33.50 32.64 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 -2.51 1.45 0.03 -0.52 -0.21 -0.81 -4.91 119.66 112.18 1u3o s GLN 66 Ca 0.44 -1.79 0.02 0.00 0.02 0.00 0.00 55.36 54.05 1u3o s GLN 66 Cb -0.09 -0.39 -0.02 0.00 1.00 0.00 0.00 33.01 33.50 1u3o s GLN 66 CO 0.73 -0.27 -0.06 -1.21 -2.12 0.00 0.00 175.29 172.36 1u3o s GLU 67 N -4.00 0.47 0.05 2.91 2.02 -1.26 0.18 118.70 119.07 1u3o s GLU 67 Ca 0.37 -0.68 -0.01 0.00 0.02 0.00 0.00 54.97 54.67 1u3o s GLU 67 Cb 0.08 -0.20 -0.04 0.00 0.10 0.00 0.00 34.13 34.07 1u3o s GLU 67 CO 0.14 0.03 -0.03 0.20 0.02 0.00 0.00 175.26 175.61 1u3o s GLY 68 N -1.45 0.49 -0.02 -1.39 0.00 0.48 -3.21 107.32 102.22 1u3o s GLY 68 Ca -0.11 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.43 1u3o s GLY 68 CO 0.00 -1.29 0.00 1.08 0.00 0.00 0.00 173.10 172.89 1u3o s LEU 69 N -2.83 1.38 0.29 0.66 1.02 -1.23 -0.62 118.68 117.35 1u3o s LEU 69 Ca 0.06 -0.01 -0.20 0.00 0.02 0.00 0.00 54.13 54.00 1u3o s LEU 69 Cb 0.06 -0.15 0.03 0.00 0.02 0.00 0.00 46.19 46.16 1u3o s LEU 69 CO -0.09 -0.07 0.76 0.68 0.02 0.00 0.00 176.35 177.65 1u3o s VAL 70 N 0.74 0.00 0.41 -1.59 -7.23 -0.58 -4.88 120.40 107.26 1u3o s VAL 70 Ca -0.07 -0.97 -0.10 0.00 -1.81 0.00 0.00 61.98 59.03 1u3o s VAL 70 Cb -0.10 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 1u3o s VAL 70 CO -0.02 0.00 0.77 -2.16 -0.31 0.00 0.00 175.10 173.39 1u3o s PRO 71 N -3.46 3.77 0.59 4.82 0.04 -1.26 -0.27 135.00 139.23 1u3o s PRO 71 Ca 0.12 0.47 0.29 0.00 0.04 0.00 0.00 61.00 61.92 1u3o s PRO 71 Cb -0.05 -2.39 1.35 0.00 0.04 0.00 0.00 34.50 33.45 1u3o s PRO 71 CO 0.08 -0.04 1.73 1.03 0.04 0.00 0.00 177.00 179.84 1u3o h SER 72 N 1.23 0.00 -0.38 6.66 0.87 0.22 0.44 113.55 122.59 1u3o h SER 72 Ca -0.47 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.13 1u3o h SER 72 Cb 1.19 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 1u3o h SER 72 CO 0.64 0.00 0.25 0.77 -0.53 0.00 0.00 176.83 177.96 1u3o h SER 73 N 0.00 0.31 0.01 6.23 4.64 -1.90 -0.61 113.55 122.24 1u3o h SER 73 Ca 0.32 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1u3o h SER 73 Cb 1.75 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1u3o h SER 73 CO -0.00 0.22 -0.49 0.35 -0.87 0.00 0.00 176.83 176.03 1u3o n THR 74 N -4.48 0.00 -4.52 2.95 -2.24 0.15 -4.49 114.28 101.65 1u3o n THR 74 Ca 0.04 -0.23 -0.24 0.00 -2.27 0.00 0.00 64.05 61.35 1u3o n THR 74 Cb 0.18 1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 69.52 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 -0.17 0.00 -4.72 3.22 4.32 -0.23 0.11 117.00 119.52 1u3o n LEU 75 Ca 0.09 -2.32 -0.38 0.00 -0.02 0.00 0.00 56.01 53.39 1u3o n LEU 75 Cb 0.45 0.25 0.05 0.00 -1.62 0.00 0.00 43.42 42.55 1u3o n LEU 75 CO 0.29 -0.34 0.90 0.00 -1.22 0.00 0.00 177.39 177.02 1u3o n ILE 77 N -1.43 0.00 -2.62 0.00 -0.00 -1.26 -4.83 119.36 109.21 1u3o n ILE 77 Ca 0.13 0.00 -0.05 0.00 -0.00 0.00 0.00 62.75 62.83 1u3o n ILE 77 Cb 0.46 -0.29 -0.04 0.00 -0.00 0.00 0.00 39.64 39.77 1u3o n ILE 77 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1u3o n SER 78 N -1.99 -1.16 0.26 7.28 7.64 -1.26 -4.96 113.62 119.43 1u3o n SER 78 Ca 0.00 1.36 -0.11 0.00 1.01 0.00 0.00 58.87 61.13 1u3o n SER 78 Cb 0.18 -5.24 -0.05 0.00 -1.01 0.00 0.00 64.21 58.08 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 4.05 -0.66 0.00 1.43 3.86 -2.04 -3.57 115.15 118.22 1u3o h HIS 79 Ca -0.52 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.68 1u3o h HIS 79 Cb 1.16 0.22 0.00 0.00 1.06 0.00 0.00 27.41 29.85 1u3o h HIS 79 CO 0.00 -0.41 0.00 0.43 0.86 0.00 0.00 177.93 178.81