#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 0.73 2.04 0.46 0.00 -1.26 -4.87 105.19 102.29 1u3o n GLY 15 Ca 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 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 4.82 4.43 2.99 -0.02 0.00 -1.26 -4.91 105.19 111.24 1u3o n GLY 16 Ca 0.00 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 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 0.02 1.02 0.04 0.00 2.56 -0.95 -4.92 118.70 116.46 1u3o s GLU 18 Ca -0.00 -0.97 -0.30 0.00 0.00 0.00 0.00 54.97 53.69 1u3o s GLU 18 Cb -0.06 -1.13 -0.04 0.00 2.00 0.00 0.00 34.13 34.90 1u3o s GLU 18 CO -0.00 0.27 1.05 -0.51 -0.56 0.00 0.00 175.26 175.51 1u3o s LEU 19 N -1.58 4.39 0.03 2.70 1.43 -1.26 0.18 118.68 124.57 1u3o s LEU 19 Ca 0.03 1.80 -0.01 0.00 -1.03 0.00 0.00 54.13 54.92 1u3o s LEU 19 Cb -0.09 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 1u3o s LEU 19 CO 0.03 -0.30 -0.02 0.28 0.23 0.00 0.00 176.35 176.57 1u3o s THR 20 N 0.87 0.15 -0.10 5.49 -1.32 -0.33 -4.84 115.64 115.55 1u3o s THR 20 Ca 0.53 -1.23 0.03 0.00 -1.21 0.00 0.00 61.69 59.82 1u3o s THR 20 Cb -0.24 -0.74 -0.01 0.00 -1.51 0.00 0.00 72.50 70.00 1u3o s THR 20 CO 0.29 -0.68 -0.20 0.68 -2.21 0.00 0.00 174.62 172.51 1u3o s VAL 21 N -2.39 2.47 0.01 5.08 -7.23 -1.26 -0.34 120.40 116.75 1u3o s VAL 21 Ca -0.07 -0.88 -0.30 0.00 -1.81 0.00 0.00 61.98 58.91 1u3o s VAL 21 Cb -0.03 -1.98 -0.05 0.00 0.56 0.00 0.00 36.38 34.88 1u3o s VAL 21 CO -0.04 0.55 1.27 0.68 -0.31 0.00 0.00 175.10 177.25 1u3o s VAL 22 N 0.21 3.96 -0.13 1.32 -7.23 -1.18 0.18 120.40 117.54 1u3o s VAL 22 Ca -0.12 1.36 0.20 0.00 -1.81 0.00 0.00 61.98 61.61 1u3o s VAL 22 Cb -0.16 -3.87 0.19 0.00 0.56 0.00 0.00 36.38 33.09 1u3o s VAL 22 CO 0.07 0.04 1.61 -0.07 -0.31 0.00 0.00 175.10 176.44 1u3o h LEU 23 N 7.66 0.00 -7.81 1.32 3.38 -1.36 -1.34 115.31 117.17 1u3o h LEU 23 Ca -0.38 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.44 1u3o h LEU 23 Cb 1.19 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.73 1u3o h LEU 23 CO 0.86 0.29 -0.54 0.00 0.09 0.00 0.00 178.44 179.14 1u3o s GLN 24 N -3.24 0.44 0.51 1.13 -2.07 -1.25 -4.75 119.66 110.43 1u3o s GLN 24 Ca 0.04 -0.45 -0.21 0.00 -1.82 0.00 0.00 55.36 52.91 1u3o s GLN 24 Cb 0.08 0.18 -0.06 0.00 -1.09 0.00 0.00 33.01 32.12 1u3o s GLN 24 CO 0.69 -0.10 1.19 -0.51 -1.32 0.00 0.00 175.29 175.24 1u3o s ASP 25 N -1.41 5.81 0.03 12.60 1.01 -1.26 -4.11 116.67 129.33 1u3o s ASP 25 Ca -0.15 2.36 -0.07 0.00 0.71 0.00 0.00 52.55 55.40 1u3o s ASP 25 Cb -0.08 -2.60 -0.00 0.00 1.01 0.00 0.00 42.92 41.24 1u3o s ASP 25 CO 0.01 -1.17 0.14 0.12 0.21 0.00 0.00 175.17 174.47 1u3o s PHE 26 N -1.56 0.11 -0.03 4.23 5.36 0.10 -4.90 117.98 121.29 1u3o s PHE 26 Ca 0.69 -0.32 0.05 0.00 -0.96 0.00 0.00 56.93 56.39 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 0.35 -0.36 -0.19 -1.54 -1.46 0.00 0.00 175.22 172.02 1u3o s SER 27 N -1.86 2.31 0.78 6.13 1.04 -1.26 0.12 113.70 120.96 1u3o s SER 27 Ca -0.08 -0.37 -0.07 0.00 0.48 0.00 0.00 55.95 55.90 1u3o s SER 27 Cb -0.03 -0.50 0.11 0.00 0.10 0.00 0.00 66.02 65.70 1u3o s SER 27 CO -0.02 0.20 0.25 0.00 0.98 0.00 0.00 173.24 174.65 1u3o n ALA 28 N 2.92 -1.53 0.00 5.32 0.00 -1.08 -4.83 120.51 121.31 1u3o n ALA 28 Ca -0.17 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.83 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 -2.23 0.00 0.00 -1.26 -4.91 120.51 108.92 1u3o n ALA 29 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 1u3o n ALA 29 Cb 0.17 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.65 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 1.61 0.01 0.00 5.04 -1.26 -5.00 115.29 115.69 1u3o s HIS 30 Ca 0.00 -0.76 -0.04 0.00 -1.54 0.00 0.00 55.06 52.72 1u3o s HIS 30 Cb 0.00 -2.06 -0.01 0.00 0.04 0.00 0.00 32.58 30.55 1u3o s HIS 30 CO 0.00 -0.74 1.06 0.77 -2.34 0.00 0.00 174.74 173.48 1u3o h SER 31 N 0.52 -0.20 -0.74 9.88 0.02 -2.01 -2.25 113.55 118.77 1u3o h SER 31 Ca -0.34 0.03 -0.44 0.00 -0.84 0.00 0.00 61.79 60.20 1u3o h SER 31 Cb 1.29 0.08 -0.18 0.00 0.14 0.00 0.00 62.40 63.74 1u3o h SER 31 CO 0.50 -0.04 0.51 -1.20 -1.14 0.00 0.00 176.83 175.46 1u3o n SER 32 N -2.98 6.73 -4.76 3.07 7.64 -1.26 -4.93 113.62 117.12 1u3o n SER 32 Ca -0.00 -3.25 -0.27 0.00 1.01 0.00 0.00 58.87 56.36 1u3o n SER 32 Cb 0.04 -1.08 -0.06 0.00 -1.01 0.00 0.00 64.21 62.09 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 -2.22 2.78 0.20 1.43 2.02 -0.85 -1.48 118.70 120.58 1u3o s GLU 33 Ca 0.43 -0.88 -0.14 0.00 0.02 0.00 0.00 54.97 54.40 1u3o s GLU 33 Cb 0.32 -2.60 0.01 0.00 0.10 0.00 0.00 34.13 31.97 1u3o s GLU 33 CO -0.06 0.50 0.45 -0.48 0.02 0.00 0.00 175.26 175.68 1u3o s LEU 34 N -2.90 0.37 -0.18 1.80 0.05 -1.23 -4.68 118.68 111.91 1u3o s LEU 34 Ca 0.30 -0.68 -0.21 0.00 0.05 0.00 0.00 54.13 53.59 1u3o s LEU 34 Cb -0.10 1.82 -0.03 0.00 -2.05 0.00 0.00 46.19 45.83 1u3o s LEU 34 CO 0.22 -1.03 0.63 -0.94 -0.55 0.00 0.00 176.35 174.68 1u3o s SER 35 N -2.93 6.72 0.29 1.48 1.04 -1.26 -2.62 113.70 116.43 1u3o s SER 35 Ca 0.14 0.87 0.07 0.00 0.48 0.00 0.00 55.95 57.51 1u3o s SER 35 Cb 0.00 -2.35 -0.06 0.00 0.10 0.00 0.00 66.02 63.71 1u3o s SER 35 CO 0.01 -0.24 -0.06 0.27 0.98 0.00 0.00 173.24 174.19 1u3o s ILE 36 N 1.73 1.72 0.04 -1.02 -0.00 0.33 -4.95 121.20 119.05 1u3o s ILE 36 Ca 0.30 -2.13 0.04 0.00 -0.00 0.00 0.00 60.65 58.86 1u3o s ILE 36 Cb -0.16 -2.51 -0.02 0.00 -0.00 0.00 0.00 42.46 39.77 1u3o s ILE 36 CO 0.11 -0.26 -0.13 -1.10 -0.00 0.00 0.00 174.94 173.56 1u3o s GLN 37 N -3.72 0.83 0.12 0.37 -0.21 -1.26 0.01 119.66 115.80 1u3o s GLN 37 Ca 0.30 -0.75 -0.31 0.00 0.02 0.00 0.00 55.36 54.62 1u3o s GLN 37 Cb 0.04 -0.81 -0.10 0.00 1.00 0.00 0.00 33.01 33.14 1u3o s GLN 37 CO 0.13 0.19 1.86 1.55 -2.12 0.00 0.00 175.29 176.90 1u3o n VAL 38 N 1.81 0.40 0.00 1.09 3.14 -1.26 -2.79 118.33 120.73 1u3o n VAL 38 Ca -0.19 -0.07 0.00 0.00 -2.96 0.00 0.00 64.34 61.12 1u3o n VAL 38 Cb 0.55 -2.16 0.00 0.00 -1.06 0.00 0.00 33.84 31.17 1u3o n VAL 38 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u3o n GLY 39 N 4.28 1.97 3.80 7.55 0.00 -0.50 -4.93 105.19 117.35 1u3o n GLY 39 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.17 1.18 -0.18 1.61 -2.07 -1.12 -4.88 119.66 114.04 1u3o s GLN 40 Ca 0.00 0.25 0.01 0.00 -1.82 0.00 0.00 55.36 53.80 1u3o s GLN 40 Cb 0.00 -1.85 0.02 0.00 -1.09 0.00 0.00 33.01 30.09 1u3o s GLN 40 CO 0.00 -2.16 -0.19 0.99 -1.32 0.00 0.00 175.29 172.61 1u3o s THR 41 N -3.32 1.98 -0.00 3.63 2.01 -1.26 -3.10 115.64 115.58 1u3o s THR 41 Ca 0.64 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.75 1u3o s THR 41 Cb -0.14 -1.80 0.00 0.00 0.01 0.00 0.00 72.50 70.57 1u3o s THR 41 CO 0.53 0.52 -0.02 -0.69 -0.69 0.00 0.00 174.62 174.27 1u3o s VAL 42 N 1.32 0.17 0.01 3.82 1.01 0.54 -4.96 120.40 122.32 1u3o s VAL 42 Ca 0.05 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 1u3o s VAL 42 Cb -0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 1u3o s VAL 42 CO -0.13 0.06 1.04 -1.83 0.00 0.00 0.00 175.10 174.24 1u3o s GLU 43 N 0.02 4.52 0.43 2.72 -1.05 -1.24 -1.19 118.70 122.92 1u3o s GLU 43 Ca 0.00 1.51 -0.23 0.00 -0.15 0.00 0.00 54.97 56.10 1u3o s GLU 43 Cb -0.02 -3.44 -0.08 0.00 -0.44 0.00 0.00 34.13 30.15 1u3o s GLU 43 CO -0.00 -0.11 1.08 -0.48 0.95 0.00 0.00 175.26 176.70 1u3o s LEU 44 N 1.07 4.05 -0.07 1.83 0.05 0.48 0.11 118.68 126.21 1u3o s LEU 44 Ca 0.54 2.10 -0.17 0.00 0.05 0.00 0.00 54.13 56.65 1u3o s LEU 44 Cb -0.23 -4.27 -0.13 0.00 -2.05 0.00 0.00 46.19 39.52 1u3o s LEU 44 CO 0.28 -0.68 0.65 -0.07 -0.55 0.00 0.00 176.35 175.98 1u3o h LEU 45 N 2.20 -0.18 0.00 1.48 3.38 -1.84 -2.54 115.31 117.81 1u3o h LEU 45 Ca -0.49 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1u3o h LEU 45 Cb 1.23 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u3o h LEU 45 CO 0.61 0.39 0.00 -1.84 0.09 0.00 0.00 178.44 177.69 1u3o n GLU 46 N -4.90 0.49 -4.24 1.13 0.28 -1.26 -4.34 120.64 107.80 1u3o n GLU 46 Ca -0.06 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.80 1u3o n GLU 46 Cb 0.23 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.00 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 1.35 1.22 -0.47 3.44 0.52 -1.26 -4.50 118.95 119.25 1u3o s ARG 47 Ca 0.00 -1.64 -0.29 0.00 -0.52 0.00 0.00 55.73 53.29 1u3o s ARG 47 Cb 0.00 -0.00 -0.30 0.00 0.52 0.00 0.00 34.95 35.16 1u3o s ARG 47 CO 0.00 -0.30 1.81 -0.35 0.02 0.00 0.00 175.30 176.48 1u3o n PRO 48 N -0.31 0.22 -0.05 3.54 -0.04 -1.26 -4.56 135.00 132.54 1u3o n PRO 48 Ca -0.01 -1.37 -0.19 0.00 -0.04 0.00 0.00 63.50 61.89 1u3o n PRO 48 Cb 0.65 -3.07 -0.13 0.00 -0.04 0.00 0.00 33.50 30.91 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 10.38 0.15 0.06 3.54 0.02 -1.96 -3.41 113.55 122.32 1u3o h SER 49 Ca 0.19 -0.80 -0.38 0.00 -0.84 0.00 0.00 61.79 59.96 1u3o h SER 49 Cb 0.81 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.25 1u3o h SER 49 CO 1.66 1.37 -2.30 -1.84 -1.14 0.00 0.00 176.83 174.58 1u3o n GLU 50 N -4.32 0.68 -4.62 3.45 0.28 -1.26 -4.90 120.64 109.95 1u3o n GLU 50 Ca -0.22 0.17 -0.33 0.00 -0.16 0.00 0.00 57.16 56.63 1u3o n GLU 50 Cb 0.69 -1.59 -0.14 0.00 1.43 0.00 0.00 31.44 31.83 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 3.35 -0.34 3.44 1.70 -1.26 -5.10 118.95 118.20 1u3o s ARG 51 Ca -0.28 -0.69 -0.15 0.00 -0.47 0.00 0.00 55.73 54.14 1u3o s ARG 51 Cb 0.08 -2.67 -0.01 0.00 -0.57 0.00 0.00 34.95 31.78 1u3o s ARG 51 CO 0.68 0.12 0.38 -1.25 -1.08 0.00 0.00 175.30 174.15 1u3o s PRO 52 N 0.58 3.59 0.00 3.89 0.04 -1.26 -4.15 135.00 137.68 1u3o s PRO 52 Ca -0.08 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 60.59 1u3o s PRO 52 Cb -0.16 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.59 1u3o s PRO 52 CO 0.03 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.96 1u3o n GLY 53 N 4.93 0.99 3.85 0.56 0.00 -1.26 -5.06 105.19 109.21 1u3o n GLY 53 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.84 2.92 0.05 1.61 1.48 -1.26 0.21 118.94 122.11 1u3o s TRP 54 Ca 0.00 -0.29 -0.21 0.00 -1.06 0.00 0.00 56.10 54.54 1u3o s TRP 54 Cb 0.00 -1.78 0.05 0.00 -1.16 0.00 0.00 33.47 30.58 1u3o s TRP 54 CO 0.00 0.20 0.49 0.00 -4.06 0.00 0.00 176.95 173.58 1u3o s LEU 56 N -2.00 3.38 -0.04 0.00 1.02 -1.26 -1.36 118.68 118.41 1u3o s LEU 56 Ca -0.05 -0.54 -0.01 0.00 0.02 0.00 0.00 54.13 53.55 1u3o s LEU 56 Cb -0.01 -1.90 0.03 0.00 0.02 0.00 0.00 46.19 44.33 1u3o s LEU 56 CO -0.02 -0.03 0.02 0.68 0.02 0.00 0.00 176.35 177.02 1u3o s VAL 57 N -2.28 0.09 -0.12 -1.59 -7.23 0.66 -3.69 120.40 106.25 1u3o s VAL 57 Ca 0.32 0.21 -0.06 0.00 -1.81 0.00 0.00 61.98 60.65 1u3o s VAL 57 Cb -0.07 -0.25 -0.04 0.00 0.56 0.00 0.00 36.38 36.58 1u3o s VAL 57 CO 0.22 0.17 0.10 -0.60 -0.31 0.00 0.00 175.10 174.67 1u3o s ARG 58 N 1.53 3.40 -0.22 4.82 6.06 0.31 0.18 118.95 135.02 1u3o s ARG 58 Ca -0.03 -0.22 -0.12 0.00 -2.50 0.00 0.00 55.73 52.86 1u3o s ARG 58 Cb -0.13 -3.10 -0.05 0.00 0.06 0.00 0.00 34.95 31.73 1u3o s ARG 58 CO -0.03 0.70 0.24 0.99 -2.50 0.00 0.00 175.30 174.71 1u3o s THR 59 N -0.83 5.31 -0.02 4.11 2.01 0.12 -3.64 115.64 122.68 1u3o s THR 59 Ca 0.13 0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.51 1u3o s THR 59 Cb -0.12 -3.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 1u3o s THR 59 CO 0.03 0.32 0.03 0.41 -0.69 0.00 0.00 174.62 174.72 1u3o n THR 60 N 4.21 0.00 1.03 -0.82 -1.04 -1.26 -1.91 114.28 114.49 1u3o n THR 60 Ca -0.13 -0.32 0.04 0.00 -2.04 0.00 0.00 64.05 61.60 1u3o n THR 60 Cb 0.52 0.82 0.12 0.00 -1.82 0.00 0.00 70.33 69.97 1u3o n THR 60 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1u3o n GLU 61 N -1.19 1.73 -3.44 -2.82 4.07 -1.26 -4.51 120.64 113.22 1u3o n GLU 61 Ca 0.00 -0.96 -0.22 0.00 -0.06 0.00 0.00 57.16 55.92 1u3o n GLU 61 Cb 0.01 -1.30 -0.11 0.00 -0.06 0.00 0.00 31.44 29.98 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 -1.65 0.38 0.01 5.31 0.52 -1.26 -5.13 118.95 117.12 1u3o s ARG 62 Ca 0.18 -0.56 -0.26 0.00 -0.52 0.00 0.00 55.73 54.56 1u3o s ARG 62 Cb 0.10 -0.91 -0.04 0.00 0.52 0.00 0.00 34.95 34.62 1u3o s ARG 62 CO 0.11 -1.09 0.81 -1.12 0.02 0.00 0.00 175.30 174.03 1u3o s SER 63 N 1.92 7.21 0.58 0.23 0.01 -1.26 -2.80 113.70 119.59 1u3o s SER 63 Ca 0.12 1.45 -0.17 0.00 1.31 0.00 0.00 55.95 58.66 1u3o s SER 63 Cb -0.16 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.54 1u3o s SER 63 CO -0.23 -0.09 1.07 -2.84 0.41 0.00 0.00 173.24 171.56 1u3o s PRO 64 N 0.42 3.31 0.99 12.44 0.02 -1.26 -5.12 135.00 145.80 1u3o s PRO 64 Ca 0.42 1.30 -0.16 0.00 0.02 0.00 0.00 61.00 62.58 1u3o s PRO 64 Cb -0.20 -2.02 -0.08 0.00 0.02 0.00 0.00 34.50 32.22 1u3o s PRO 64 CO 0.23 -0.83 -0.39 -2.30 -0.33 0.00 0.00 177.00 173.38 1u3o n PRO 65 N -1.85 -0.16 -4.44 5.54 -0.02 -1.12 -5.01 135.00 127.94 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 -1.32 -0.10 0.00 -0.02 0.00 0.00 33.50 32.57 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 -2.63 1.63 0.04 -0.52 -0.21 -0.80 -4.92 119.66 112.26 1u3o s GLN 66 Ca 0.46 -1.91 0.02 0.00 0.02 0.00 0.00 55.36 53.96 1u3o s GLN 66 Cb -0.17 -0.78 -0.02 0.00 1.00 0.00 0.00 33.01 33.03 1u3o s GLN 66 CO 0.76 -0.21 -0.07 -1.21 -2.12 0.00 0.00 175.29 172.44 1u3o s GLU 67 N -3.90 0.50 0.05 2.91 8.01 -1.26 0.10 118.70 125.10 1u3o s GLU 67 Ca 0.36 -0.70 0.01 0.00 0.01 0.00 0.00 54.97 54.65 1u3o s GLU 67 Cb 0.08 -0.25 -0.03 0.00 -4.31 0.00 0.00 34.13 29.62 1u3o s GLU 67 CO 0.15 0.04 -0.05 0.20 0.01 0.00 0.00 175.26 175.61 1u3o s GLY 68 N -1.47 0.48 -0.04 -1.39 0.00 0.47 -2.89 107.32 102.47 1u3o s GLY 68 Ca -0.10 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.73 1u3o s GLY 68 CO 0.00 -0.98 -0.04 1.08 0.00 0.00 0.00 173.10 173.17 1u3o s LEU 69 N -2.04 1.39 0.33 0.66 1.02 -1.19 -0.25 118.68 118.61 1u3o s LEU 69 Ca -0.05 -0.11 -0.18 0.00 0.02 0.00 0.00 54.13 53.81 1u3o s LEU 69 Cb -0.04 -0.39 0.04 0.00 0.02 0.00 0.00 46.19 45.82 1u3o s LEU 69 CO -0.03 -0.04 0.77 0.68 0.02 0.00 0.00 176.35 177.75 1u3o s VAL 70 N 0.78 0.00 0.40 -1.59 -7.23 -0.46 -4.89 120.40 107.41 1u3o s VAL 70 Ca -0.10 -0.98 -0.06 0.00 -1.81 0.00 0.00 61.98 59.03 1u3o s VAL 70 Cb -0.13 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.25 1u3o s VAL 70 CO -0.00 0.00 0.70 -2.16 -0.31 0.00 0.00 175.10 173.33 1u3o s PRO 71 N -2.96 3.63 0.58 4.82 0.04 -1.26 0.25 135.00 140.09 1u3o s PRO 71 Ca 0.14 0.18 0.32 0.00 0.04 0.00 0.00 61.00 61.67 1u3o s PRO 71 Cb -0.05 -2.47 1.39 0.00 0.04 0.00 0.00 34.50 33.40 1u3o s PRO 71 CO 0.09 -0.02 1.72 1.03 0.04 0.00 0.00 177.00 179.86 1u3o h SER 72 N 0.92 0.00 -0.16 6.66 0.87 0.24 0.47 113.55 122.56 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 1.20 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 0.11 -1.28 -0.53 0.00 0.00 176.83 175.76 1u3o h SER 73 N 0.00 0.01 -0.23 6.23 0.87 -1.93 -1.04 113.55 117.46 1u3o h SER 73 Ca 0.41 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.97 1u3o h SER 73 Cb 2.02 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.98 1u3o h SER 73 CO -0.00 0.01 0.00 0.35 -0.53 0.00 0.00 176.83 176.65 1u3o n THR 74 N -4.49 0.48 -4.04 2.23 -2.24 0.16 -4.36 114.28 102.02 1u3o n THR 74 Ca 0.01 -0.74 -0.17 0.00 -2.27 0.00 0.00 64.05 60.88 1u3o n THR 74 Cb 0.23 0.92 -0.16 0.00 -2.10 0.00 0.00 70.33 69.23 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 -1.11 1.47 0.16 3.22 1.02 -0.39 -1.17 118.68 121.88 1u3o s LEU 75 Ca 0.24 -0.06 -0.33 0.00 0.02 0.00 0.00 54.13 53.99 1u3o s LEU 75 Cb 0.14 -0.27 -0.13 0.00 0.02 0.00 0.00 46.19 45.95 1u3o s LEU 75 CO 0.19 -0.04 1.67 0.00 0.02 0.00 0.00 176.35 178.19 1u3o s ILE 77 N 1.38 0.49 0.13 0.00 -0.00 -1.26 -4.68 121.20 117.25 1u3o s ILE 77 Ca 0.79 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 59.44 1u3o s ILE 77 Cb -0.61 -2.62 0.00 0.00 -0.00 0.00 0.00 42.46 39.24 1u3o s ILE 77 CO 0.37 0.00 0.00 -1.20 -0.00 0.00 0.00 174.94 174.11 1u3o n SER 78 N -0.47 -6.72 -2.19 4.36 7.64 -1.26 -4.81 113.62 110.18 1u3o n SER 78 Ca 0.00 0.60 -0.02 0.00 1.01 0.00 0.00 58.87 60.46 1u3o n SER 78 Cb 0.66 -1.70 0.06 0.00 -1.01 0.00 0.00 64.21 62.22 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 -2.79 -0.78 0.94 1.43 -0.00 -1.26 -5.21 115.22 107.56 1u3o n HIS 79 Ca 0.00 -1.39 0.08 0.00 0.46 0.00 0.00 57.72 56.87 1u3o n HIS 79 Cb 0.26 0.82 0.45 0.00 -0.12 0.00 0.00 29.99 31.40 1u3o n HIS 79 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23