#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3o s GLY 15 N 0.00 1.90 0.00 0.23 0.00 -1.26 -4.70 107.32 103.49 1u3o s GLY 15 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1u3o s GLY 15 CO 0.00 0.83 0.00 0.61 0.00 0.00 0.00 173.10 174.54 1u3o n GLY 16 N 4.91 0.73 2.97 0.20 0.00 -1.26 -5.09 105.19 107.66 1u3o n GLY 16 Ca -0.12 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.96 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 0.33 1.10 0.11 0.00 2.12 -0.95 -4.96 118.70 116.46 1u3o s GLU 18 Ca -0.05 -0.80 -0.30 0.00 0.36 0.00 0.00 54.97 54.18 1u3o s GLU 18 Cb -0.09 -1.14 -0.06 0.00 0.26 0.00 0.00 34.13 33.09 1u3o s GLU 18 CO 0.00 0.29 1.01 -0.51 -0.54 0.00 0.00 175.26 175.51 1u3o s LEU 19 N -1.09 4.48 0.03 2.70 1.43 -1.26 0.10 118.68 125.06 1u3o s LEU 19 Ca 0.04 1.87 -0.02 0.00 -1.03 0.00 0.00 54.13 54.98 1u3o s LEU 19 Cb -0.08 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.53 1u3o s LEU 19 CO 0.01 -0.15 0.02 0.28 0.23 0.00 0.00 176.35 176.74 1u3o s THR 20 N 0.10 0.13 -0.21 5.49 -1.32 -0.62 -4.84 115.64 114.36 1u3o s THR 20 Ca 0.49 -1.08 -0.05 0.00 -1.21 0.00 0.00 61.69 59.84 1u3o s THR 20 Cb -0.25 -0.63 -0.02 0.00 -1.51 0.00 0.00 72.50 70.09 1u3o s THR 20 CO 0.31 -0.60 -0.00 0.68 -2.21 0.00 0.00 174.62 172.80 1u3o s VAL 21 N -2.12 3.82 0.54 5.08 -7.23 -1.26 0.16 120.40 119.39 1u3o s VAL 21 Ca -0.10 -0.35 -0.21 0.00 -1.81 0.00 0.00 61.98 59.51 1u3o s VAL 21 Cb -0.05 -2.74 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 1u3o s VAL 21 CO -0.03 0.41 1.31 0.68 -0.31 0.00 0.00 175.10 177.16 1u3o s VAL 22 N 1.25 2.29 -0.05 1.32 -7.23 -1.15 -2.29 120.40 114.54 1u3o s VAL 22 Ca 0.03 0.22 0.22 0.00 -1.81 0.00 0.00 61.98 60.64 1u3o s VAL 22 Cb -0.15 -3.11 -0.33 0.00 0.56 0.00 0.00 36.38 33.35 1u3o s VAL 22 CO 0.01 -0.01 0.49 0.18 -0.31 0.00 0.00 175.10 175.46 1u3o n LEU 23 N -1.03 0.03 -3.89 1.32 4.77 -1.00 -2.29 117.00 114.91 1u3o n LEU 23 Ca 0.10 -0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.97 1u3o n LEU 23 Cb 0.46 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1u3o n LEU 23 CO 0.51 0.00 -0.21 0.00 -1.33 0.00 0.00 177.39 176.36 1u3o s GLN 24 N -3.51 0.43 0.47 3.23 -2.07 -1.26 -4.76 119.66 112.19 1u3o s GLN 24 Ca -0.08 -0.40 -0.22 0.00 -1.82 0.00 0.00 55.36 52.84 1u3o s GLN 24 Cb 0.14 0.18 -0.07 0.00 -1.09 0.00 0.00 33.01 32.16 1u3o s GLN 24 CO 0.91 -0.10 1.15 -0.51 -1.32 0.00 0.00 175.29 175.42 1u3o s ASP 25 N -1.30 6.14 0.03 12.60 1.11 -1.26 -4.08 116.67 129.91 1u3o s ASP 25 Ca -0.14 2.26 -0.07 0.00 0.18 0.00 0.00 52.55 54.78 1u3o s ASP 25 Cb -0.08 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.31 1u3o s ASP 25 CO 0.01 -0.94 0.13 0.12 1.18 0.00 0.00 175.17 175.67 1u3o s PHE 26 N -1.60 0.13 -0.02 4.23 5.36 0.73 -4.90 117.98 121.91 1u3o s PHE 26 Ca 0.65 -0.38 0.05 0.00 -0.96 0.00 0.00 56.93 56.28 1u3o s PHE 26 Cb -0.27 -0.10 -0.01 0.00 -0.34 0.00 0.00 43.02 42.30 1u3o s PHE 26 CO 0.33 -0.37 -0.16 -1.54 -1.46 0.00 0.00 175.22 172.01 1u3o s SER 27 N -2.00 1.94 0.81 6.13 1.04 -1.26 0.13 113.70 120.48 1u3o s SER 27 Ca -0.07 -0.30 -0.08 0.00 0.48 0.00 0.00 55.95 55.98 1u3o s SER 27 Cb -0.02 -0.34 0.13 0.00 0.10 0.00 0.00 66.02 65.89 1u3o s SER 27 CO -0.03 0.18 0.28 0.00 0.98 0.00 0.00 173.24 174.65 1u3o n ALA 28 N 2.87 -1.73 0.00 5.32 0.00 -1.13 -4.81 120.51 121.03 1u3o n ALA 28 Ca -0.16 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.78 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 -3.52 0.00 -2.19 0.00 0.00 -1.26 -4.92 120.51 108.61 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 0.20 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.68 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 1.45 0.00 0.00 5.04 -1.26 -5.00 115.29 115.52 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 -2.08 0.00 0.00 0.04 0.00 0.00 32.58 30.54 1u3o s HIS 30 CO 0.00 -0.89 0.57 0.43 -2.34 0.00 0.00 174.74 172.51 1u3o n SER 31 N -2.05 0.00 -2.07 9.88 7.64 -1.26 -2.06 113.62 123.70 1u3o n SER 31 Ca 0.08 0.57 -0.23 0.00 1.01 0.00 0.00 58.87 60.30 1u3o n SER 31 Cb 0.63 -0.07 0.05 0.00 -1.01 0.00 0.00 64.21 63.80 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 -1.29 6.88 -4.92 6.43 7.64 -1.26 -4.95 113.62 122.16 1u3o n SER 32 Ca 0.00 -3.31 -0.27 0.00 1.01 0.00 0.00 58.87 56.30 1u3o n SER 32 Cb 0.00 -1.04 -0.03 0.00 -1.01 0.00 0.00 64.21 62.13 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 -2.47 3.57 0.17 1.43 2.02 -0.87 -3.16 118.70 119.38 1u3o s GLU 33 Ca 0.43 -0.15 -0.13 0.00 0.02 0.00 0.00 54.97 55.14 1u3o s GLU 33 Cb 0.33 -2.71 0.01 0.00 0.10 0.00 0.00 34.13 31.87 1u3o s GLU 33 CO -0.02 0.26 0.37 -0.48 0.02 0.00 0.00 175.26 175.41 1u3o s LEU 34 N -3.61 0.64 -0.06 1.80 0.05 -1.26 -4.69 118.68 111.55 1u3o s LEU 34 Ca 0.42 -0.67 -0.19 0.00 0.05 0.00 0.00 54.13 53.73 1u3o s LEU 34 Cb -0.11 1.57 -0.05 0.00 -2.05 0.00 0.00 46.19 45.56 1u3o s LEU 34 CO 0.31 -0.93 0.53 -0.94 -0.55 0.00 0.00 176.35 174.77 1u3o s SER 35 N -2.91 6.84 0.25 1.48 1.04 -1.26 -2.83 113.70 116.31 1u3o s SER 35 Ca 0.12 1.00 0.03 0.00 0.48 0.00 0.00 55.95 57.58 1u3o s SER 35 Cb 0.02 -2.32 -0.05 0.00 0.10 0.00 0.00 66.02 63.76 1u3o s SER 35 CO -0.03 0.06 0.03 0.27 0.98 0.00 0.00 173.24 174.56 1u3o s ILE 36 N 0.15 0.94 0.02 -1.02 -5.25 0.35 -4.94 121.20 111.45 1u3o s ILE 36 Ca 0.29 -2.02 0.04 0.00 -0.99 0.00 0.00 60.65 57.97 1u3o s ILE 36 Cb -0.17 -2.50 -0.02 0.00 2.95 0.00 0.00 42.46 42.73 1u3o s ILE 36 CO 0.14 -0.19 -0.11 -1.10 -1.79 0.00 0.00 174.94 171.90 1u3o s GLN 37 N -3.91 0.76 -0.06 0.37 -0.21 -1.26 -0.19 119.66 115.15 1u3o s GLN 37 Ca 0.32 -0.59 -0.30 0.00 0.02 0.00 0.00 55.36 54.80 1u3o s GLN 37 Cb 0.07 -0.71 -0.09 0.00 1.00 0.00 0.00 33.01 33.28 1u3o s GLN 37 CO 0.11 0.18 2.03 1.55 -2.12 0.00 0.00 175.29 177.04 1u3o n VAL 38 N 2.16 0.62 0.00 1.09 3.14 -1.26 -2.57 118.33 121.51 1u3o n VAL 38 Ca -0.17 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 1u3o n VAL 38 Cb 0.56 -2.28 0.00 0.00 -1.06 0.00 0.00 33.84 31.05 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 4.89 2.08 3.94 7.55 0.00 -0.97 -4.93 105.19 117.75 1u3o n GLY 39 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 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 0.85 -0.17 1.61 -2.07 -1.06 -4.88 119.66 113.95 1u3o s GLN 40 Ca 0.00 -0.45 0.01 0.00 -1.82 0.00 0.00 55.36 53.10 1u3o s GLN 40 Cb 0.00 -1.91 0.02 0.00 -1.09 0.00 0.00 33.01 30.03 1u3o s GLN 40 CO 0.00 -2.24 -0.20 0.99 -1.32 0.00 0.00 175.29 172.52 1u3o s THR 41 N -3.78 2.00 -0.07 3.63 2.01 -1.26 -2.93 115.64 115.23 1u3o s THR 41 Ca 0.72 -0.91 -0.03 0.00 0.31 0.00 0.00 61.69 61.78 1u3o s THR 41 Cb -0.04 -1.81 0.04 0.00 0.01 0.00 0.00 72.50 70.70 1u3o s THR 41 CO 0.52 0.53 0.16 -0.69 -0.69 0.00 0.00 174.62 174.45 1u3o s VAL 42 N 1.23 -0.10 -0.08 3.82 1.01 0.12 -4.93 120.40 121.47 1u3o s VAL 42 Ca 0.03 0.22 -0.28 0.00 0.00 0.00 0.00 61.98 61.95 1u3o s VAL 42 Cb -0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 1u3o s VAL 42 CO -0.11 0.09 0.91 -1.83 0.00 0.00 0.00 175.10 174.16 1u3o s GLU 43 N 1.43 4.43 0.52 2.72 -1.05 0.70 -1.59 118.70 125.87 1u3o s GLU 43 Ca -0.07 1.23 -0.21 0.00 -0.15 0.00 0.00 54.97 55.78 1u3o s GLU 43 Cb -0.12 -3.51 -0.06 0.00 -0.44 0.00 0.00 34.13 30.00 1u3o s GLU 43 CO -0.06 -0.18 1.18 -0.48 0.95 0.00 0.00 175.26 176.66 1u3o s LEU 44 N 1.57 3.85 -0.10 1.83 -0.00 0.28 0.19 118.68 126.31 1u3o s LEU 44 Ca 0.45 2.32 -0.01 0.00 -0.00 0.00 0.00 54.13 56.89 1u3o s LEU 44 Cb -0.19 -4.42 -0.00 0.00 -0.00 0.00 0.00 46.19 41.58 1u3o s LEU 44 CO 0.19 -1.20 -0.02 -0.07 -0.00 0.00 0.00 176.35 175.25 1u3o h LEU 45 N 1.51 0.00 0.00 1.48 3.38 -1.84 -2.51 115.31 117.33 1u3o h LEU 45 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1u3o h LEU 45 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u3o h LEU 45 CO 0.58 0.51 0.00 -1.84 0.09 0.00 0.00 178.44 177.78 1u3o n GLU 46 N -4.67 3.90 -4.21 1.13 0.28 -1.26 -4.37 120.64 111.44 1u3o n GLU 46 Ca -0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.87 1u3o n GLU 46 Cb 0.03 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.80 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 1.04 1.16 -0.47 3.44 0.52 -1.26 -4.55 118.95 118.83 1u3o s ARG 47 Ca 0.00 -1.60 -0.28 0.00 -0.52 0.00 0.00 55.73 53.34 1u3o s ARG 47 Cb 0.00 0.11 -0.28 0.00 0.52 0.00 0.00 34.95 35.30 1u3o s ARG 47 CO 0.00 -0.31 1.79 -0.35 0.02 0.00 0.00 175.30 176.45 1u3o n PRO 48 N -0.26 0.46 -0.05 3.54 -0.04 -1.26 -4.56 135.00 132.84 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 -2.98 -0.13 0.00 -0.04 0.00 0.00 33.50 31.01 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 9.88 0.15 0.09 3.54 0.87 -1.96 -3.41 113.55 122.71 1u3o h SER 49 Ca 0.24 -0.81 -0.37 0.00 -1.23 0.00 0.00 61.79 59.62 1u3o h SER 49 Cb 0.77 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.64 1u3o h SER 49 CO 1.76 1.35 -2.22 -1.84 -0.53 0.00 0.00 176.83 175.35 1u3o n GLU 50 N -4.32 0.70 -5.02 2.24 0.28 -1.26 -4.90 120.64 108.35 1u3o n GLU 50 Ca -0.21 0.19 -0.32 0.00 -0.16 0.00 0.00 57.16 56.66 1u3o n GLU 50 Cb 0.69 -1.62 -0.16 0.00 1.43 0.00 0.00 31.44 31.79 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 -2.54 3.14 -0.35 3.44 1.70 -1.26 -5.11 118.95 117.97 1u3o s ARG 51 Ca -0.25 -0.79 -0.15 0.00 -0.47 0.00 0.00 55.73 54.07 1u3o s ARG 51 Cb 0.08 -2.44 -0.01 0.00 -0.57 0.00 0.00 34.95 32.01 1u3o s ARG 51 CO 0.71 0.23 0.34 -1.25 -1.08 0.00 0.00 175.30 174.24 1u3o s PRO 52 N 0.26 3.48 0.00 3.89 0.04 -1.26 -4.16 135.00 137.25 1u3o s PRO 52 Ca -0.13 -0.53 0.00 0.00 0.04 0.00 0.00 61.00 60.38 1u3o s PRO 52 Cb -0.16 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.55 1u3o s PRO 52 CO 0.07 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 176.97 1u3o n GLY 53 N 5.02 0.93 3.84 0.56 0.00 -1.26 -5.06 105.19 109.21 1u3o n GLY 53 Ca -0.10 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 -1.52 2.92 0.06 1.61 1.48 -1.26 0.27 118.94 122.49 1u3o s TRP 54 Ca 0.00 -0.28 -0.26 0.00 -1.06 0.00 0.00 56.10 54.50 1u3o s TRP 54 Cb 0.00 -1.73 0.07 0.00 -1.16 0.00 0.00 33.47 30.65 1u3o s TRP 54 CO 0.00 0.24 0.63 0.00 -4.06 0.00 0.00 176.95 173.76 1u3o s LEU 56 N -2.02 3.78 -0.04 0.00 1.02 -1.26 -1.15 118.68 119.01 1u3o s LEU 56 Ca -0.05 -0.32 -0.02 0.00 0.02 0.00 0.00 54.13 53.76 1u3o s LEU 56 Cb -0.01 -2.37 0.03 0.00 0.02 0.00 0.00 46.19 43.86 1u3o s LEU 56 CO -0.02 -0.22 0.06 0.68 0.02 0.00 0.00 176.35 176.87 1u3o s VAL 57 N -2.20 -0.10 0.05 -1.59 -7.23 0.12 -3.43 120.40 106.03 1u3o s VAL 57 Ca 0.38 0.40 0.07 0.00 -1.81 0.00 0.00 61.98 61.02 1u3o s VAL 57 Cb -0.07 -0.15 -0.03 0.00 0.56 0.00 0.00 36.38 36.69 1u3o s VAL 57 CO 0.27 0.17 -0.18 -0.60 -0.31 0.00 0.00 175.10 174.45 1u3o s ARG 58 N 2.04 2.03 -0.03 4.82 6.06 0.51 0.19 118.95 134.57 1u3o s ARG 58 Ca 0.03 -1.01 0.04 0.00 -2.50 0.00 0.00 55.73 52.30 1u3o s ARG 58 Cb -0.12 -2.18 -0.01 0.00 0.06 0.00 0.00 34.95 32.70 1u3o s ARG 58 CO -0.03 0.53 -0.16 -0.08 -2.50 0.00 0.00 175.30 173.06 1u3o s THR 59 N -0.97 1.35 -0.13 4.11 -1.32 0.20 -0.21 115.64 118.66 1u3o s THR 59 Ca 0.15 -0.69 0.04 0.00 -1.21 0.00 0.00 61.69 59.98 1u3o s THR 59 Cb -0.11 -1.15 -0.04 0.00 -1.51 0.00 0.00 72.50 69.69 1u3o s THR 59 CO 0.06 0.39 0.13 1.07 -2.21 0.00 0.00 174.62 174.06 1u3o n THR 60 N 3.02 0.00 1.22 5.08 5.66 -1.26 -1.95 114.28 126.05 1u3o n THR 60 Ca -0.17 -0.34 0.03 0.00 -3.05 0.00 0.00 64.05 60.52 1u3o n THR 60 Cb 0.53 0.87 0.10 0.00 -1.55 0.00 0.00 70.33 70.28 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 -1.20 1.56 -3.54 1.09 0.28 -1.26 -4.47 120.64 113.11 1u3o n GLU 61 Ca 0.00 -0.77 -0.29 0.00 -0.16 0.00 0.00 57.16 55.94 1u3o n GLU 61 Cb 0.06 -1.23 -0.14 0.00 1.43 0.00 0.00 31.44 31.56 1u3o n GLU 61 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1u3o s ARG 62 N -1.69 0.38 -0.05 3.44 3.52 -1.26 -5.13 118.95 118.16 1u3o s ARG 62 Ca 0.14 -0.87 -0.27 0.00 -0.13 0.00 0.00 55.73 54.60 1u3o s ARG 62 Cb 0.08 -1.30 -0.03 0.00 -1.56 0.00 0.00 34.95 32.13 1u3o s ARG 62 CO 0.09 -1.08 0.85 -1.12 -0.81 0.00 0.00 175.30 173.23 1u3o s SER 63 N 1.68 7.16 0.53 -2.12 0.01 -1.26 -2.34 113.70 117.36 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 -0.19 -2.49 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 1u3o s SER 63 CO -0.23 -0.22 1.03 -2.16 0.41 0.00 0.00 173.24 172.07 1u3o s PRO 64 N 1.09 3.67 1.02 12.44 0.04 -1.26 -5.13 135.00 146.88 1u3o s PRO 64 Ca 0.44 1.22 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 1u3o s PRO 64 Cb -0.19 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 1u3o s PRO 64 CO 0.22 -0.52 -0.30 -2.30 0.04 0.00 0.00 177.00 174.14 1u3o n PRO 65 N -1.44 -0.55 -3.74 0.56 -0.02 -0.99 -5.02 135.00 123.81 1u3o n PRO 65 Ca 0.08 -0.14 -0.15 0.00 -2.02 0.00 0.00 63.50 61.27 1u3o n PRO 65 Cb 0.53 -1.49 -0.15 0.00 -0.02 0.00 0.00 33.50 32.37 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 -2.96 0.03 0.11 -0.52 -0.21 -0.82 -4.94 119.66 110.35 1u3o s GLN 66 Ca 0.49 0.33 0.09 0.00 0.02 0.00 0.00 55.36 56.29 1u3o s GLN 66 Cb -0.13 -0.23 -0.04 0.00 1.00 0.00 0.00 33.01 33.61 1u3o s GLN 66 CO 0.70 -0.19 -0.19 -1.83 -2.12 0.00 0.00 175.29 171.66 1u3o s GLU 67 N 1.31 1.78 0.11 2.91 4.04 -1.26 0.58 118.70 128.17 1u3o s GLU 67 Ca -0.07 -1.17 -0.01 0.00 0.04 0.00 0.00 54.97 53.75 1u3o s GLU 67 Cb -0.12 -2.10 0.01 0.00 0.02 0.00 0.00 34.13 31.94 1u3o s GLU 67 CO -0.05 0.48 0.17 0.41 -1.84 0.00 0.00 175.26 174.43 1u3o n GLY 68 N 0.92 2.58 3.06 -3.83 0.00 0.50 -4.12 105.19 104.29 1u3o n GLY 68 Ca -0.16 -1.37 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1u3o n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u3o s LEU 69 N 0.00 1.31 0.03 0.99 1.02 -1.26 -0.70 118.68 120.07 1u3o s LEU 69 Ca 0.08 0.36 -0.28 0.00 0.02 0.00 0.00 54.13 54.31 1u3o s LEU 69 Cb -0.01 0.62 0.08 0.00 0.02 0.00 0.00 46.19 46.90 1u3o s LEU 69 CO 0.06 -0.07 0.70 0.68 0.02 0.00 0.00 176.35 177.74 1u3o s VAL 70 N 0.07 0.00 0.65 -1.59 -7.23 -0.30 -4.83 120.40 107.18 1u3o s VAL 70 Ca -0.00 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.05 1u3o s VAL 70 Cb -0.01 -1.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.91 1u3o s VAL 70 CO 0.00 0.00 1.05 -2.84 -0.31 0.00 0.00 175.10 173.00 1u3o s PRO 71 N -2.37 3.17 0.59 4.82 0.02 -1.26 -0.82 135.00 139.14 1u3o s PRO 71 Ca -0.04 0.96 0.34 0.00 0.02 0.00 0.00 61.00 62.28 1u3o s PRO 71 Cb -0.01 -2.02 1.30 0.00 0.02 0.00 0.00 34.50 33.79 1u3o s PRO 71 CO -0.02 -0.91 1.55 1.03 -0.33 0.00 0.00 177.00 178.32 1u3o h SER 72 N -0.36 0.00 -0.90 2.53 0.87 0.35 0.37 113.55 116.41 1u3o h SER 72 Ca -0.44 0.00 0.12 0.00 -1.23 0.00 0.00 61.79 60.24 1u3o h SER 72 Cb 1.21 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 63.10 1u3o h SER 72 CO 0.58 0.00 0.58 0.77 -0.53 0.00 0.00 176.83 178.23 1u3o h SER 73 N 0.00 0.75 -0.60 6.23 4.64 -1.90 0.15 113.55 122.82 1u3o h SER 73 Ca 0.55 0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.86 1u3o h SER 73 Cb 2.69 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 64.63 1u3o h SER 73 CO -0.01 0.41 0.05 0.35 -0.87 0.00 0.00 176.83 176.77 1u3o n THR 74 N -4.56 2.78 -3.95 2.95 -2.24 0.13 -4.25 114.28 105.15 1u3o n THR 74 Ca 0.17 -1.43 -0.10 0.00 -2.27 0.00 0.00 64.05 60.42 1u3o n THR 74 Cb 0.38 -0.30 -0.12 0.00 -2.10 0.00 0.00 70.33 68.20 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 -2.78 2.15 0.13 3.22 1.43 0.54 -2.37 118.68 121.00 1u3o s LEU 75 Ca 0.54 -0.35 -0.35 0.00 -1.03 0.00 0.00 54.13 52.94 1u3o s LEU 75 Cb 0.42 0.09 -0.16 0.00 0.03 0.00 0.00 46.19 46.57 1u3o s LEU 75 CO 0.15 -0.22 1.37 0.00 0.23 0.00 0.00 176.35 177.88 1u3o n ILE 77 N 2.50 0.00 -0.08 0.00 -5.35 -1.26 -4.97 119.36 110.20 1u3o n ILE 77 Ca 0.17 -2.00 -0.21 0.00 -0.27 0.00 0.00 62.75 60.44 1u3o n ILE 77 Cb 0.23 0.41 -0.12 0.00 -1.74 0.00 0.00 39.64 38.42 1u3o n ILE 77 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1u3o n SER 78 N -1.27 2.01 -1.47 7.28 7.64 -1.26 -5.11 113.62 121.44 1u3o n SER 78 Ca -0.17 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1u3o n SER 78 Cb 0.53 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 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 -3.61 -4.06 0.80 1.43 -0.00 -1.26 -5.36 115.22 103.16 1u3o n HIS 79 Ca -0.41 2.16 0.10 0.00 0.46 0.00 0.00 57.72 60.03 1u3o n HIS 79 Cb 0.96 -3.33 0.08 0.00 -0.12 0.00 0.00 29.99 27.58 1u3o n HIS 79 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25