#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 1.76 0.00 0.23 0.00 -1.26 -4.70 107.32 103.35 1u3o s GLY 15 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.47 1u3o s GLY 15 CO 0.00 -1.25 0.00 0.61 0.00 0.00 0.00 173.10 172.46 1u3o n GLY 16 N -0.15 1.03 2.92 0.20 0.00 -1.26 -5.10 105.19 102.83 1u3o n GLY 16 Ca -0.09 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 0.72 0.99 0.06 0.00 2.12 -0.93 -4.96 118.70 116.71 1u3o s GLU 18 Ca -0.10 -0.97 -0.30 0.00 0.36 0.00 0.00 54.97 53.96 1u3o s GLU 18 Cb -0.13 -1.09 -0.05 0.00 0.26 0.00 0.00 34.13 33.12 1u3o s GLU 18 CO 0.01 0.26 1.05 -0.51 -0.54 0.00 0.00 175.26 175.53 1u3o s LEU 19 N -1.59 4.41 0.02 2.70 1.43 -1.26 0.15 118.68 124.53 1u3o s LEU 19 Ca 0.02 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 54.97 1u3o s LEU 19 Cb -0.09 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.53 1u3o s LEU 19 CO 0.03 -0.28 -0.03 0.28 0.23 0.00 0.00 176.35 176.58 1u3o s THR 20 N 0.67 0.13 -0.04 5.49 -1.32 -0.44 -4.79 115.64 115.33 1u3o s THR 20 Ca 0.53 -0.71 0.01 0.00 -1.21 0.00 0.00 61.69 60.30 1u3o s THR 20 Cb -0.25 -0.24 -0.03 0.00 -1.51 0.00 0.00 72.50 70.47 1u3o s THR 20 CO 0.30 -0.37 -0.03 0.68 -2.21 0.00 0.00 174.62 172.98 1u3o s VAL 21 N -1.11 3.96 -0.13 5.08 -7.23 -1.26 -0.52 120.40 119.19 1u3o s VAL 21 Ca -0.12 -0.51 -0.22 0.00 -1.81 0.00 0.00 61.98 59.33 1u3o s VAL 21 Cb -0.08 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.15 1u3o s VAL 21 CO -0.01 0.51 0.66 0.68 -0.31 0.00 0.00 175.10 176.63 1u3o s VAL 22 N -0.93 5.03 -0.03 1.32 -7.23 -1.19 -1.14 120.40 116.23 1u3o s VAL 22 Ca 0.15 1.31 0.18 0.00 -1.81 0.00 0.00 61.98 61.82 1u3o s VAL 22 Cb -0.11 -3.99 0.13 0.00 0.56 0.00 0.00 36.38 32.97 1u3o s VAL 22 CO 0.05 0.18 1.60 -0.07 -0.31 0.00 0.00 175.10 176.55 1u3o h LEU 23 N 7.46 0.00 -7.87 1.32 3.38 0.51 -0.57 115.31 119.55 1u3o h LEU 23 Ca -0.36 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.45 1u3o h LEU 23 Cb 1.17 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.71 1u3o h LEU 23 CO 0.77 0.39 -0.59 0.00 0.09 0.00 0.00 178.44 179.10 1u3o s GLN 24 N -3.27 0.41 0.49 1.13 -2.07 -1.19 -4.72 119.66 110.44 1u3o s GLN 24 Ca 0.02 -0.52 -0.22 0.00 -1.82 0.00 0.00 55.36 52.83 1u3o s GLN 24 Cb 0.09 0.16 -0.06 0.00 -1.09 0.00 0.00 33.01 32.10 1u3o s GLN 24 CO 0.70 -0.09 1.20 -0.51 -1.32 0.00 0.00 175.29 175.28 1u3o s ASP 25 N -1.46 5.88 0.04 12.60 1.01 -1.26 -4.18 116.67 129.31 1u3o s ASP 25 Ca -0.15 2.39 -0.07 0.00 0.71 0.00 0.00 52.55 55.42 1u3o s ASP 25 Cb -0.08 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.23 1u3o s ASP 25 CO 0.00 -1.12 0.14 0.12 0.21 0.00 0.00 175.17 174.52 1u3o s PHE 26 N -1.52 0.14 -0.02 4.23 5.36 0.92 -4.91 117.98 122.17 1u3o s PHE 26 Ca 0.67 -0.40 0.05 0.00 -0.96 0.00 0.00 56.93 56.29 1u3o s PHE 26 Cb -0.30 -0.09 -0.01 0.00 -0.34 0.00 0.00 43.02 42.27 1u3o s PHE 26 CO 0.36 -0.39 -0.18 -1.54 -1.46 0.00 0.00 175.22 172.02 1u3o s SER 27 N -2.09 2.12 0.72 6.13 1.04 -1.26 0.12 113.70 120.48 1u3o s SER 27 Ca -0.05 -0.33 -0.06 0.00 0.48 0.00 0.00 55.95 55.98 1u3o s SER 27 Cb -0.01 -0.35 0.09 0.00 0.10 0.00 0.00 66.02 65.85 1u3o s SER 27 CO -0.04 0.20 0.21 0.00 0.98 0.00 0.00 173.24 174.59 1u3o n ALA 28 N 2.80 -1.28 0.00 5.32 0.00 -1.14 -4.82 120.51 121.40 1u3o n ALA 28 Ca -0.16 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 52.91 1u3o n ALA 28 Cb 0.54 -0.03 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 -2.92 0.00 -2.13 0.00 0.00 -1.26 -4.92 120.51 109.29 1u3o n ALA 29 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.18 1u3o n ALA 29 Cb 0.15 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.63 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 1.70 0.11 0.00 3.76 -1.26 -5.00 115.29 114.60 1u3o s HIS 30 Ca 0.00 -0.70 -0.33 0.00 -0.15 0.00 0.00 55.06 53.88 1u3o s HIS 30 Cb 0.00 -2.16 -0.13 0.00 1.11 0.00 0.00 32.58 31.40 1u3o s HIS 30 CO 0.00 -0.85 1.57 0.77 -0.85 0.00 0.00 174.74 175.38 1u3o h SER 31 N 0.42 -1.44 -0.67 1.40 0.02 -2.01 -2.30 113.55 108.97 1u3o h SER 31 Ca -0.33 0.15 -0.41 0.00 -0.84 0.00 0.00 61.79 60.36 1u3o h SER 31 Cb 1.29 0.53 -0.20 0.00 0.14 0.00 0.00 62.40 64.16 1u3o h SER 31 CO 0.46 -0.55 0.52 -1.20 -1.14 0.00 0.00 176.83 174.92 1u3o n SER 32 N -5.49 5.36 -4.84 3.07 7.64 -1.26 -4.93 113.62 113.17 1u3o n SER 32 Ca -0.08 -3.22 -0.25 0.00 1.01 0.00 0.00 58.87 56.33 1u3o n SER 32 Cb 0.41 -0.89 -0.05 0.00 -1.01 0.00 0.00 64.21 62.67 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 -2.40 3.03 0.18 1.43 2.02 -0.87 -2.82 118.70 119.28 1u3o s GLU 33 Ca 0.41 -0.86 -0.16 0.00 0.02 0.00 0.00 54.97 54.38 1u3o s GLU 33 Cb 0.33 -2.70 0.02 0.00 0.10 0.00 0.00 34.13 31.89 1u3o s GLU 33 CO 0.03 0.47 0.46 -0.48 0.02 0.00 0.00 175.26 175.76 1u3o s LEU 34 N -3.35 0.28 -0.04 1.80 0.05 -1.26 -4.70 118.68 111.46 1u3o s LEU 34 Ca 0.32 -0.51 -0.23 0.00 0.05 0.00 0.00 54.13 53.77 1u3o s LEU 34 Cb -0.10 1.93 -0.04 0.00 -2.05 0.00 0.00 46.19 45.93 1u3o s LEU 34 CO 0.25 -0.99 0.68 -0.94 -0.55 0.00 0.00 176.35 174.81 1u3o s SER 35 N -2.87 7.01 0.25 1.48 1.04 -1.26 -2.87 113.70 116.47 1u3o s SER 35 Ca 0.09 1.21 0.04 0.00 0.48 0.00 0.00 55.95 57.77 1u3o s SER 35 Cb 0.00 -2.41 -0.05 0.00 0.10 0.00 0.00 66.02 63.66 1u3o s SER 35 CO -0.04 -0.06 -0.01 0.27 0.98 0.00 0.00 173.24 174.38 1u3o s ILE 36 N 0.50 1.17 0.08 -1.02 -5.25 0.33 -4.95 121.20 112.07 1u3o s ILE 36 Ca 0.36 -2.05 0.05 0.00 -0.99 0.00 0.00 60.65 58.03 1u3o s ILE 36 Cb -0.18 -2.42 -0.03 0.00 2.95 0.00 0.00 42.46 42.78 1u3o s ILE 36 CO 0.18 -0.28 -0.14 -1.10 -1.79 0.00 0.00 174.94 171.81 1u3o s GLN 37 N -3.84 0.87 -0.04 0.37 -0.21 -1.26 -0.06 119.66 115.48 1u3o s GLN 37 Ca 0.30 -1.03 -0.30 0.00 0.02 0.00 0.00 55.36 54.35 1u3o s GLN 37 Cb 0.06 -0.83 -0.06 0.00 1.00 0.00 0.00 33.01 33.17 1u3o s GLN 37 CO 0.10 0.18 1.79 0.54 -2.12 0.00 0.00 175.29 175.77 1u3o s VAL 38 N -1.54 3.37 0.00 1.09 0.11 -1.26 -2.86 120.40 119.32 1u3o s VAL 38 Ca 0.01 0.44 0.00 0.00 -2.93 0.00 0.00 61.98 59.50 1u3o s VAL 38 Cb -0.08 -3.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.46 1u3o s VAL 38 CO 0.02 -0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.35 1u3o n GLY 39 N 4.39 1.75 3.69 6.54 0.00 -0.22 -4.94 105.19 116.41 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 -0.11 -0.10 -0.11 1.61 -2.07 -1.13 -4.85 119.66 112.90 1u3o s GLN 40 Ca 0.00 0.12 0.03 0.00 -1.82 0.00 0.00 55.36 53.69 1u3o s GLN 40 Cb 0.00 -1.71 0.01 0.00 -1.09 0.00 0.00 33.01 30.22 1u3o s GLN 40 CO 0.00 -3.00 -0.22 0.99 -1.32 0.00 0.00 175.29 171.74 1u3o s THR 41 N -3.15 1.95 -0.14 3.63 2.01 -1.26 -3.19 115.64 115.48 1u3o s THR 41 Ca 0.68 -0.93 -0.07 0.00 0.31 0.00 0.00 61.69 61.68 1u3o s THR 41 Cb -0.13 -1.71 0.06 0.00 0.01 0.00 0.00 72.50 70.73 1u3o s THR 41 CO 0.56 0.53 0.34 -0.69 -0.69 0.00 0.00 174.62 174.66 1u3o s VAL 42 N 0.61 -0.11 -0.21 3.82 1.01 0.32 -4.98 120.40 120.87 1u3o s VAL 42 Ca -0.13 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 1u3o s VAL 42 Cb -0.17 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.71 1u3o s VAL 42 CO 0.03 0.06 1.02 -1.83 0.00 0.00 0.00 175.10 174.38 1u3o s GLU 43 N 1.52 4.29 0.59 2.72 -1.05 0.11 -1.33 118.70 125.56 1u3o s GLU 43 Ca -0.08 1.34 -0.20 0.00 -0.15 0.00 0.00 54.97 55.88 1u3o s GLU 43 Cb -0.10 -3.62 -0.03 0.00 -0.44 0.00 0.00 34.13 29.94 1u3o s GLU 43 CO -0.11 -0.56 1.31 -0.48 0.95 0.00 0.00 175.26 176.37 1u3o s LEU 44 N 2.95 3.72 -0.12 1.83 0.05 0.40 0.17 118.68 127.67 1u3o s LEU 44 Ca 0.44 2.66 -0.21 0.00 0.05 0.00 0.00 54.13 57.08 1u3o s LEU 44 Cb -0.16 -4.45 -0.18 0.00 -2.05 0.00 0.00 46.19 39.35 1u3o s LEU 44 CO 0.08 -1.74 0.59 -0.07 -0.55 0.00 0.00 176.35 174.66 1u3o h LEU 45 N 1.04 -0.01 0.00 1.48 3.38 -1.83 -2.46 115.31 116.90 1u3o h LEU 45 Ca -0.51 -0.68 -0.21 0.00 0.09 0.00 0.00 57.88 56.57 1u3o h LEU 45 Cb 1.31 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.01 1u3o h LEU 45 CO 0.55 0.81 -0.20 -1.84 0.09 0.00 0.00 178.44 177.85 1u3o n GLU 46 N -4.68 0.30 -4.58 1.13 0.28 -1.26 -4.38 120.64 107.45 1u3o n GLU 46 Ca -0.07 -1.46 -0.27 0.00 -0.16 0.00 0.00 57.16 55.20 1u3o n GLU 46 Cb 0.33 1.11 -0.11 0.00 1.43 0.00 0.00 31.44 34.20 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 -2.61 1.89 -0.52 3.44 0.52 -1.26 -4.33 118.95 116.08 1u3o s ARG 47 Ca 0.16 -2.04 -0.11 0.00 -0.52 0.00 0.00 55.73 53.21 1u3o s ARG 47 Cb 0.01 -1.57 -0.10 0.00 0.52 0.00 0.00 34.95 33.81 1u3o s ARG 47 CO 0.11 -0.02 1.70 -0.35 0.02 0.00 0.00 175.30 176.77 1u3o n PRO 48 N -0.89 1.14 0.07 3.54 -0.04 -1.26 -4.39 135.00 133.17 1u3o n PRO 48 Ca -0.05 -1.22 -0.19 0.00 -0.04 0.00 0.00 63.50 62.00 1u3o n PRO 48 Cb 0.66 -2.43 -0.15 0.00 -0.04 0.00 0.00 33.50 31.54 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 7.55 0.50 0.00 3.54 0.02 -1.95 -3.40 113.55 119.82 1u3o h SER 49 Ca 0.32 -0.70 -0.28 0.00 -0.84 0.00 0.00 61.79 60.28 1u3o h SER 49 Cb 0.29 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 1u3o h SER 49 CO 1.51 1.58 -2.06 -1.84 -1.14 0.00 0.00 176.83 174.87 1u3o n GLU 50 N -3.52 0.57 -3.85 3.45 0.28 -1.26 -4.92 120.64 111.40 1u3o n GLU 50 Ca -0.19 0.10 -0.36 0.00 -0.16 0.00 0.00 57.16 56.55 1u3o n GLU 50 Cb 1.06 -1.38 -0.13 0.00 1.43 0.00 0.00 31.44 32.42 1u3o n GLU 50 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1u3o s ARG 51 N -2.37 3.50 -0.36 3.44 1.81 -1.26 -5.08 118.95 118.62 1u3o s ARG 51 Ca -0.24 -0.56 -0.20 0.00 -1.72 0.00 0.00 55.73 53.02 1u3o s ARG 51 Cb 0.06 -3.14 0.00 0.00 -0.45 0.00 0.00 34.95 31.42 1u3o s ARG 51 CO 0.45 -0.19 0.60 -1.25 -0.68 0.00 0.00 175.30 174.23 1u3o s PRO 52 N 1.53 3.64 0.00 3.54 0.04 -1.26 -3.90 135.00 138.58 1u3o s PRO 52 Ca 0.06 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.06 1u3o s PRO 52 Cb -0.15 -3.82 0.00 0.00 0.04 0.00 0.00 34.50 30.58 1u3o s PRO 52 CO -0.00 -0.72 0.00 0.41 0.04 0.00 0.00 177.00 176.72 1u3o n GLY 53 N 4.73 0.83 3.79 0.56 0.00 -1.26 -5.05 105.19 108.79 1u3o n GLY 53 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 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 2.88 0.06 1.61 1.48 -1.25 0.19 118.94 121.91 1u3o s TRP 54 Ca 0.00 -0.27 -0.24 0.00 -1.06 0.00 0.00 56.10 54.53 1u3o s TRP 54 Cb 0.00 -1.61 0.06 0.00 -1.16 0.00 0.00 33.47 30.76 1u3o s TRP 54 CO 0.00 0.34 0.57 0.00 -4.06 0.00 0.00 176.95 173.80 1u3o s LEU 56 N -2.09 3.14 -0.04 0.00 1.02 -1.26 -1.02 118.68 118.43 1u3o s LEU 56 Ca -0.04 -0.75 -0.02 0.00 0.02 0.00 0.00 54.13 53.34 1u3o s LEU 56 Cb -0.00 -1.63 0.03 0.00 0.02 0.00 0.00 46.19 44.61 1u3o s LEU 56 CO -0.03 -0.10 0.05 0.68 0.02 0.00 0.00 176.35 176.97 1u3o s VAL 57 N -2.39 -0.05 0.05 -1.59 -7.23 -0.75 -3.41 120.40 105.03 1u3o s VAL 57 Ca 0.33 0.37 0.09 0.00 -1.81 0.00 0.00 61.98 60.96 1u3o s VAL 57 Cb -0.04 -0.18 -0.03 0.00 0.56 0.00 0.00 36.38 36.69 1u3o s VAL 57 CO 0.20 0.18 -0.23 -0.60 -0.31 0.00 0.00 175.10 174.34 1u3o s ARG 58 N 1.99 1.87 -0.04 4.82 6.06 0.44 0.20 118.95 134.28 1u3o s ARG 58 Ca 0.03 -1.09 0.04 0.00 -2.50 0.00 0.00 55.73 52.21 1u3o s ARG 58 Cb -0.12 -2.06 -0.00 0.00 0.06 0.00 0.00 34.95 32.82 1u3o s ARG 58 CO -0.03 0.52 -0.16 -0.08 -2.50 0.00 0.00 175.30 173.04 1u3o s THR 59 N -0.89 1.36 -0.12 4.11 -1.32 0.23 0.09 115.64 119.09 1u3o s THR 59 Ca 0.13 -0.67 0.05 0.00 -1.21 0.00 0.00 61.69 59.99 1u3o s THR 59 Cb -0.10 -1.17 -0.06 0.00 -1.51 0.00 0.00 72.50 69.66 1u3o s THR 59 CO 0.04 0.39 0.15 0.35 -2.21 0.00 0.00 174.62 173.35 1u3o n THR 60 N 3.19 0.00 0.68 5.08 -2.24 -1.26 -1.99 114.28 117.73 1u3o n THR 60 Ca -0.18 -0.27 0.04 0.00 -2.27 0.00 0.00 64.05 61.37 1u3o n THR 60 Cb 0.53 0.73 0.14 0.00 -2.10 0.00 0.00 70.33 69.64 1u3o n THR 60 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1u3o n GLU 61 N -1.35 2.09 -3.56 -0.78 1.02 -1.26 -4.51 120.64 112.28 1u3o n GLU 61 Ca 0.00 -1.15 -0.29 0.00 -0.02 0.00 0.00 57.16 55.70 1u3o n GLU 61 Cb 0.09 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.87 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 -1.65 0.43 -0.10 3.49 3.52 -1.26 -5.12 118.95 118.25 1u3o s ARG 62 Ca 0.21 -0.91 -0.27 0.00 -0.13 0.00 0.00 55.73 54.63 1u3o s ARG 62 Cb 0.13 -1.40 -0.02 0.00 -1.56 0.00 0.00 34.95 32.10 1u3o s ARG 62 CO 0.10 -1.07 0.89 -1.54 -0.81 0.00 0.00 175.30 172.87 1u3o s SER 63 N 1.66 7.12 0.46 -2.12 1.04 -1.26 -1.97 113.70 118.62 1u3o s SER 63 Ca 0.12 1.37 -0.20 0.00 0.48 0.00 0.00 55.95 57.72 1u3o s SER 63 Cb -0.19 -2.50 -0.10 0.00 0.10 0.00 0.00 66.02 63.34 1u3o s SER 63 CO -0.23 -0.34 0.97 -2.16 0.98 0.00 0.00 173.24 172.46 1u3o s PRO 64 N 1.68 4.10 1.01 4.02 0.04 -1.26 -5.13 135.00 139.46 1u3o s PRO 64 Ca 0.43 1.11 -0.21 0.00 0.04 0.00 0.00 61.00 62.38 1u3o s PRO 64 Cb -0.18 -2.16 -0.11 0.00 0.04 0.00 0.00 34.50 32.10 1u3o s PRO 64 CO 0.18 -0.15 -0.84 -0.35 0.04 0.00 0.00 177.00 175.88 1u3o n PRO 65 N -0.92 -0.29 -3.74 0.56 -0.04 -0.83 -5.02 135.00 124.71 1u3o n PRO 65 Ca 0.07 -0.08 -0.12 0.00 -0.04 0.00 0.00 63.50 63.33 1u3o n PRO 65 Cb 0.54 -1.21 -0.12 0.00 -0.04 0.00 0.00 33.50 32.66 1u3o n PRO 65 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1u3o s GLN 66 N -2.43 0.26 0.12 0.54 0.74 -0.84 -4.94 119.66 113.11 1u3o s GLN 66 Ca 0.43 0.51 0.11 0.00 0.05 0.00 0.00 55.36 56.46 1u3o s GLN 66 Cb -0.06 -0.03 -0.04 0.00 1.10 0.00 0.00 33.01 33.99 1u3o s GLN 66 CO 0.72 -0.12 -0.27 -1.83 -0.55 0.00 0.00 175.29 173.23 1u3o s GLU 67 N 0.93 1.42 0.33 1.67 -1.05 -1.26 0.77 118.70 121.51 1u3o s GLU 67 Ca -0.06 -1.33 0.04 0.00 -0.15 0.00 0.00 54.97 53.47 1u3o s GLU 67 Cb -0.08 -1.89 -0.02 0.00 -0.44 0.00 0.00 34.13 31.70 1u3o s GLU 67 CO -0.06 0.45 0.32 0.20 0.95 0.00 0.00 175.26 177.12 1u3o s GLY 68 N -2.00 2.07 -0.10 -3.83 0.00 0.53 -3.75 107.32 100.24 1u3o s GLY 68 Ca 0.14 -1.92 -0.06 0.00 0.00 0.00 0.00 44.72 42.89 1u3o s GLY 68 CO 0.06 -1.35 0.23 1.08 0.00 0.00 0.00 173.10 173.12 1u3o s LEU 69 N -3.33 0.60 0.30 0.66 1.02 -1.25 -1.80 118.68 114.88 1u3o s LEU 69 Ca 0.38 0.48 -0.20 0.00 0.02 0.00 0.00 54.13 54.82 1u3o s LEU 69 Cb 0.02 0.70 0.03 0.00 0.02 0.00 0.00 46.19 46.96 1u3o s LEU 69 CO 0.25 -0.15 0.75 0.68 0.02 0.00 0.00 176.35 177.90 1u3o s VAL 70 N 1.01 0.00 0.37 -1.59 -7.23 -0.19 -4.88 120.40 107.89 1u3o s VAL 70 Ca -0.07 -0.99 -0.11 0.00 -1.81 0.00 0.00 61.98 59.00 1u3o s VAL 70 Cb -0.09 -2.23 -0.07 0.00 0.56 0.00 0.00 36.38 34.56 1u3o s VAL 70 CO -0.06 0.00 0.74 -2.16 -0.31 0.00 0.00 175.10 173.31 1u3o s PRO 71 N -3.49 3.82 0.59 4.82 0.04 -1.26 0.17 135.00 139.69 1u3o s PRO 71 Ca 0.12 0.48 0.30 0.00 0.04 0.00 0.00 61.00 61.94 1u3o s PRO 71 Cb -0.06 -2.42 1.35 0.00 0.04 0.00 0.00 34.50 33.41 1u3o s PRO 71 CO 0.08 0.03 1.71 1.03 0.04 0.00 0.00 177.00 179.89 1u3o h SER 72 N 1.55 0.00 -0.31 6.66 0.87 0.19 0.47 113.55 122.98 1u3o h SER 72 Ca -0.47 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.12 1u3o h SER 72 Cb 1.18 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 0.21 -1.28 -0.53 0.00 0.00 176.83 175.87 1u3o h SER 73 N 0.00 0.25 -0.02 6.23 0.87 -1.90 -0.94 113.55 118.04 1u3o h SER 73 Ca 0.36 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1u3o h SER 73 Cb 1.88 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.78 1u3o h SER 73 CO -0.00 0.17 -0.40 0.35 -0.53 0.00 0.00 176.83 176.42 1u3o n THR 74 N -4.49 0.00 -4.64 2.23 -2.24 0.16 -4.49 114.28 100.82 1u3o n THR 74 Ca 0.03 -0.30 -0.28 0.00 -2.27 0.00 0.00 64.05 61.23 1u3o n THR 74 Cb 0.17 1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 69.62 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 0.13 0.00 -4.74 3.22 4.32 -0.36 0.10 117.00 119.68 1u3o n LEU 75 Ca 0.09 -2.75 -0.37 0.00 -0.02 0.00 0.00 56.01 52.97 1u3o n LEU 75 Cb 0.47 0.34 0.06 0.00 -1.62 0.00 0.00 43.42 42.66 1u3o n LEU 75 CO 0.26 -0.39 0.89 0.00 -1.22 0.00 0.00 177.39 176.92 1u3o s ILE 77 N -1.45 0.84 -0.80 0.00 -0.00 -1.26 -4.83 121.20 113.70 1u3o s ILE 77 Ca 0.81 -1.44 0.01 0.00 -0.00 0.00 0.00 60.65 60.03 1u3o s ILE 77 Cb -0.36 -1.12 0.20 0.00 -0.00 0.00 0.00 42.46 41.18 1u3o s ILE 77 CO 0.38 -0.47 0.65 -0.94 -0.00 0.00 0.00 174.94 174.56 1u3o s SER 78 N -2.11 5.49 -0.35 4.36 1.04 -1.26 -4.86 113.70 116.00 1u3o s SER 78 Ca 0.00 -3.72 0.07 0.00 0.48 0.00 0.00 55.95 52.78 1u3o s SER 78 Cb -0.06 -1.80 0.54 0.00 0.10 0.00 0.00 66.02 64.80 1u3o s SER 78 CO 0.00 -0.16 1.59 1.41 0.98 0.00 0.00 173.24 177.06 1u3o n HIS 79 N 2.27 1.78 1.52 5.02 8.25 -1.26 -5.27 115.22 127.54 1u3o n HIS 79 Ca 0.20 -1.82 0.12 0.00 -0.26 0.00 0.00 57.72 55.96 1u3o n HIS 79 Cb 0.36 -0.65 0.72 0.00 1.12 0.00 0.00 29.99 31.54 1u3o n HIS 79 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43