#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2juf h GLY 15 N 0.00 0.83 1.64 2.98 0.00 -1.87 -1.45 103.07 105.20 2juf h GLY 15 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 47.33 46.38 2juf h GLY 15 CO 0.00 0.73 -0.49 0.83 0.00 0.00 0.00 176.54 177.61 2juf h GLU 16 N 0.63 0.39 -0.01 4.80 3.07 -2.01 -3.15 114.58 118.30 2juf h GLU 16 Ca 0.06 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 2juf h GLU 16 Cb 0.91 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.83 2juf h GLU 16 CO 0.08 0.80 -0.01 -0.92 -1.40 0.00 0.00 179.01 177.55 2juf h TYR 17 N 0.31 0.04 -0.82 4.33 3.20 -1.93 -3.23 116.97 118.86 2juf h TYR 17 Ca 0.02 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.90 2juf h TYR 17 Cb 0.98 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 2juf h TYR 17 CO 0.03 0.52 0.54 -0.39 -1.64 0.00 0.00 178.16 177.22 2juf h VAL 18 N -0.46 1.15 -0.78 1.81 -1.51 -1.37 -2.08 116.25 113.02 2juf h VAL 18 Ca 0.00 -0.36 0.14 0.00 -1.23 0.00 0.00 66.70 65.26 2juf h VAL 18 Cb 0.51 0.03 -0.05 0.00 -2.13 0.00 0.00 31.29 29.64 2juf h VAL 18 CO 0.00 0.19 0.52 -0.61 -1.23 0.00 0.00 177.57 176.44 2juf h GLN 19 N 1.04 0.48 0.18 5.19 4.15 -1.56 0.61 115.11 125.19 2juf h GLN 19 Ca 0.32 -0.03 -0.27 0.00 0.77 0.00 0.00 58.65 59.44 2juf h GLN 19 Cb -0.01 -0.11 0.02 0.00 0.21 0.00 0.00 27.48 27.60 2juf h GLN 19 CO -0.09 0.32 -1.25 1.96 -1.93 0.00 0.00 178.83 177.84 2juf h GLN 20 N 0.49 0.39 -0.16 1.69 1.08 -1.43 -3.33 115.11 113.83 2juf h GLN 20 Ca 0.38 -0.66 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2juf h GLN 20 Cb 0.78 0.25 0.00 0.00 -0.05 0.00 0.00 27.48 28.46 2juf h GLN 20 CO -0.14 1.32 0.00 -2.37 -0.95 0.00 0.00 178.83 176.69 2juf n THR 21 N -3.89 0.20 -2.41 -0.54 5.66 -0.94 -4.90 114.28 107.46 2juf n THR 21 Ca -0.18 -0.40 -0.43 0.00 -3.05 0.00 0.00 64.05 59.99 2juf n THR 21 Cb 0.96 0.58 -0.02 0.00 -1.55 0.00 0.00 70.33 70.29 2juf n THR 21 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2juf s LEU 22 N -1.67 4.23 -0.16 1.09 2.01 0.16 -5.04 118.68 119.30 2juf s LEU 22 Ca 0.34 1.78 -0.06 0.00 0.01 0.00 0.00 54.13 56.20 2juf s LEU 22 Cb 0.19 -3.55 -0.04 0.00 0.01 0.00 0.00 46.19 42.81 2juf s LEU 22 CO 0.29 -0.70 0.05 -1.10 1.01 0.00 0.00 176.35 175.90 2juf s GLN 23 N 3.00 3.76 -0.87 1.70 -1.52 -1.26 -5.04 119.66 119.43 2juf s GLN 23 Ca 0.56 -0.34 -0.25 0.00 -1.95 0.00 0.00 55.36 53.38 2juf s GLN 23 Cb -0.24 -3.13 -0.08 0.00 -0.22 0.00 0.00 33.01 29.35 2juf s GLN 23 CO 0.19 0.39 2.09 -2.14 -0.25 0.00 0.00 175.29 175.56 2juf s PRO 24 N 0.04 2.25 0.00 2.91 0.02 -1.26 -1.80 135.00 137.16 2juf s PRO 24 Ca 0.05 -0.05 0.00 0.00 0.02 0.00 0.00 61.00 61.02 2juf s PRO 24 Cb -0.12 -4.98 0.00 0.00 0.02 0.00 0.00 34.50 29.42 2juf s PRO 24 CO 0.01 -3.72 0.00 0.41 -0.33 0.00 0.00 177.00 173.37 2juf n GLY 25 N 6.84 0.34 3.84 0.52 0.00 -0.75 -5.01 105.19 110.97 2juf n GLY 25 Ca 0.42 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.12 2juf n GLY 25 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2juf s MET 26 N 0.00 4.02 0.57 1.61 0.23 -0.74 -4.85 119.30 120.14 2juf s MET 26 Ca 0.00 0.96 -0.06 0.00 -1.03 0.00 0.00 55.69 55.55 2juf s MET 26 Cb 0.00 -2.18 -0.01 0.00 -1.53 0.00 0.00 34.83 31.12 2juf s MET 26 CO 0.00 -0.17 0.89 -0.98 -2.03 0.00 0.00 175.02 172.73 2juf s ARG 27 N -3.76 3.14 0.28 3.16 1.70 -1.26 -1.29 118.95 120.92 2juf s ARG 27 Ca 0.59 0.14 0.02 0.00 -0.47 0.00 0.00 55.73 56.01 2juf s ARG 27 Cb -0.10 -2.27 -0.05 0.00 -0.57 0.00 0.00 34.95 31.97 2juf s ARG 27 CO 0.26 -0.58 0.11 0.14 -1.08 0.00 0.00 175.30 174.14 2juf s VAL 28 N -2.96 0.57 -0.01 4.99 -7.23 -0.40 -1.45 120.40 113.92 2juf s VAL 28 Ca 0.52 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.71 2juf s VAL 28 Cb -0.11 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.22 2juf s VAL 28 CO 0.46 0.00 -0.04 -0.60 -0.31 0.00 0.00 175.10 174.61 2juf s ARG 29 N -3.97 0.38 -0.44 4.82 3.00 -0.08 -1.89 118.95 120.78 2juf s ARG 29 Ca 0.37 -0.13 -0.25 0.00 -1.00 0.00 0.00 55.73 54.72 2juf s ARG 29 Cb 0.07 -0.39 0.02 0.00 0.00 0.00 0.00 34.95 34.65 2juf s ARG 29 CO 0.15 0.06 0.89 1.41 0.00 0.00 0.00 175.30 177.81 2juf s MET 30 N 0.07 3.58 0.10 5.12 -2.45 0.02 -1.90 119.30 123.85 2juf s MET 30 Ca -0.00 0.20 0.23 0.00 -1.25 0.00 0.00 55.69 54.87 2juf s MET 30 Cb -0.04 -3.90 0.17 0.00 1.25 0.00 0.00 34.83 32.31 2juf s MET 30 CO -0.00 -1.13 1.15 1.47 1.05 0.00 0.00 175.02 177.56 2juf n LEU 31 N 6.97 0.67 -4.29 4.11 -0.00 -1.25 -1.27 117.00 121.94 2juf n LEU 31 Ca 0.05 0.15 -0.22 0.00 -0.00 0.00 0.00 56.01 55.98 2juf n LEU 31 Cb 0.48 -0.13 -0.12 0.00 -0.00 0.00 0.00 43.42 43.66 2juf n LEU 31 CO 0.61 -0.04 -0.50 -0.62 -0.00 0.00 0.00 177.39 176.85 2juf s ASP 32 N -4.29 2.49 -0.25 1.45 2.15 -1.26 -4.88 116.67 112.08 2juf s ASP 32 Ca 0.04 -0.74 -0.29 0.00 0.43 0.00 0.00 52.55 51.99 2juf s ASP 32 Cb 0.13 -0.13 0.01 0.00 -0.30 0.00 0.00 42.92 42.63 2juf s ASP 32 CO 0.77 0.01 1.03 -0.62 -0.17 0.00 0.00 175.17 176.18 2juf s ASP 33 N -2.17 7.05 0.47 -0.34 2.15 -1.26 -3.89 116.67 118.68 2juf s ASP 33 Ca 0.09 1.29 0.07 0.00 0.43 0.00 0.00 52.55 54.43 2juf s ASP 33 Cb -0.08 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.01 2juf s ASP 33 CO 0.05 -0.69 0.44 -0.31 -0.17 0.00 0.00 175.17 174.48 2juf s TYR 34 N 3.25 2.27 0.13 -5.34 1.51 0.42 -4.96 117.35 114.63 2juf s TYR 34 Ca 0.43 -0.61 -0.31 0.00 -1.01 0.00 0.00 57.07 55.57 2juf s TYR 34 Cb -0.15 -2.11 -0.09 0.00 -0.11 0.00 0.00 41.96 39.50 2juf s TYR 34 CO 0.08 -0.35 1.56 0.93 -1.11 0.00 0.00 175.55 176.66 2juf h GLU 35 N 0.84 -0.47 0.00 -0.62 4.39 -1.96 -3.27 114.58 113.49 2juf h GLU 35 Ca -0.39 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.34 2juf h GLU 35 Cb 1.28 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 2juf h GLU 35 CO 0.55 -0.31 0.00 -0.85 -1.16 0.00 0.00 179.01 177.24 2juf n GLU 36 N -5.42 1.12 -5.25 2.33 0.28 -1.26 -4.98 120.64 107.46 2juf n GLU 36 Ca -0.04 -0.99 -0.32 0.00 -0.16 0.00 0.00 57.16 55.65 2juf n GLU 36 Cb 0.37 -0.96 -0.17 0.00 1.43 0.00 0.00 31.44 32.11 2juf n GLU 36 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2juf s ILE 37 N -0.51 2.06 0.16 3.84 1.09 -1.23 -4.47 121.20 122.13 2juf s ILE 37 Ca 0.00 -1.05 0.03 0.00 -1.10 0.00 0.00 60.65 58.53 2juf s ILE 37 Cb 0.00 -1.75 -0.03 0.00 -1.06 0.00 0.00 42.46 39.61 2juf s ILE 37 CO 0.00 0.57 0.29 -0.44 -0.10 0.00 0.00 174.94 175.26 2juf s SER 38 N 0.03 6.34 -0.15 3.58 0.01 -1.26 -0.44 113.70 121.81 2juf s SER 38 Ca -0.09 0.17 -0.29 0.00 1.31 0.00 0.00 55.95 57.04 2juf s SER 38 Cb -0.15 -1.91 -0.05 0.00 0.21 0.00 0.00 66.02 64.12 2juf s SER 38 CO 0.06 0.04 1.79 0.00 0.41 0.00 0.00 173.24 175.53 2juf s ALA 39 N -1.77 3.29 0.00 1.44 0.00 -1.25 -2.39 121.76 121.08 2juf s ALA 39 Ca 0.35 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2juf s ALA 39 Cb -0.11 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.14 2juf s ALA 39 CO 0.29 -1.93 0.00 0.41 0.00 0.00 0.00 175.76 174.52 2juf n GLY 40 N 4.74 1.12 3.81 0.00 0.00 -0.40 -5.00 105.19 109.46 2juf n GLY 40 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 2juf n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2juf s ASP 41 N -0.40 5.56 0.17 1.61 1.01 -1.00 -4.76 116.67 118.86 2juf s ASP 41 Ca 0.00 1.72 0.09 0.00 0.71 0.00 0.00 52.55 55.07 2juf s ASP 41 Cb 0.00 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 2juf s ASP 41 CO 0.00 -1.32 -0.14 -1.61 0.21 0.00 0.00 175.17 172.32 2juf s GLU 42 N -4.56 1.92 0.01 8.23 2.02 -1.26 -0.80 118.70 124.26 2juf s GLU 42 Ca 0.61 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 54.30 2juf s GLU 42 Cb -0.15 -2.09 -0.00 0.00 0.10 0.00 0.00 34.13 31.99 2juf s GLU 42 CO 0.46 0.44 0.01 0.41 0.02 0.00 0.00 175.26 176.59 2juf n GLY 43 N 0.20 4.03 2.90 -1.39 0.00 -0.79 -2.90 105.19 107.24 2juf n GLY 43 Ca -0.12 -1.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.02 2juf n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2juf s GLU 44 N -2.04 0.13 -0.15 1.61 2.12 -0.56 -1.27 118.70 118.55 2juf s GLU 44 Ca 0.01 -0.10 -0.29 0.00 0.36 0.00 0.00 54.97 54.94 2juf s GLU 44 Cb 0.00 -0.09 -0.01 0.00 0.26 0.00 0.00 34.13 34.29 2juf s GLU 44 CO 0.01 0.02 1.18 0.12 -0.54 0.00 0.00 175.26 176.05 2juf s PHE 45 N -0.16 3.09 -0.16 5.30 5.36 -0.41 -1.25 117.98 129.75 2juf s PHE 45 Ca -0.01 1.21 -0.07 0.00 -0.96 0.00 0.00 56.93 57.10 2juf s PHE 45 Cb -0.01 -3.41 -0.07 0.00 -0.34 0.00 0.00 43.02 39.19 2juf s PHE 45 CO -0.00 -1.22 -0.19 0.54 -1.46 0.00 0.00 175.22 172.88 2juf n ARG 46 N 6.06 0.34 -3.50 10.12 5.12 -1.25 -1.81 116.66 131.73 2juf n ARG 46 Ca 0.12 0.14 -0.11 0.00 -1.93 0.00 0.00 57.85 56.07 2juf n ARG 46 Cb 0.46 -1.11 -0.02 0.00 -1.16 0.00 0.00 32.46 30.63 2juf n ARG 46 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2juf s GLN 47 N -2.29 1.30 0.32 5.56 0.00 -1.25 -4.92 119.66 118.38 2juf s GLN 47 Ca -0.22 -0.57 0.03 0.00 -0.00 0.00 0.00 55.36 54.60 2juf s GLN 47 Cb 0.08 0.57 -0.05 0.00 0.00 0.00 0.00 33.01 33.61 2juf s GLN 47 CO 0.29 -0.57 0.09 -1.54 0.00 0.00 0.00 175.29 173.57 2juf s SER 48 N -2.78 2.01 -0.15 12.60 1.04 -1.26 -3.82 113.70 121.34 2juf s SER 48 Ca 0.03 -1.44 -0.05 0.00 0.48 0.00 0.00 55.95 54.96 2juf s SER 48 Cb -0.01 0.13 0.07 0.00 0.10 0.00 0.00 66.02 66.31 2juf s SER 48 CO -0.11 -0.72 0.29 0.54 0.98 0.00 0.00 173.24 174.23 2juf s ASN 49 N -3.44 0.28 0.07 7.02 2.20 -1.26 -5.01 114.94 114.79 2juf s ASN 49 Ca 0.35 0.62 0.08 0.00 -0.94 0.00 0.00 52.86 52.97 2juf s ASN 49 Cb 0.07 0.82 -0.22 0.00 -2.00 0.00 0.00 41.25 39.92 2juf s ASN 49 CO 0.15 -0.24 1.08 0.78 -2.94 0.00 0.00 177.10 175.92 2juf h ASN 50 N 8.26 0.02 0.50 3.54 2.35 -2.00 -3.32 115.58 124.93 2juf h ASN 50 Ca -0.15 -0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.45 2juf h ASN 50 Cb 1.12 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.46 2juf h ASN 50 CO 0.14 1.02 -1.60 0.61 -1.65 0.00 0.00 177.43 175.95 2juf n GLY 51 N 1.43 -1.18 3.46 2.83 0.00 -1.26 -4.84 105.19 105.63 2juf n GLY 51 Ca -0.06 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 2juf n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2juf s ILE 52 N -3.09 4.92 0.42 -0.61 -1.09 -1.25 -5.03 121.20 115.47 2juf s ILE 52 Ca -0.05 -0.50 0.16 0.00 -2.23 0.00 0.00 60.65 58.03 2juf s ILE 52 Cb 0.10 -3.61 0.18 0.00 -1.58 0.00 0.00 42.46 37.54 2juf s ILE 52 CO 0.83 -0.09 1.96 1.55 -1.23 0.00 0.00 174.94 177.96 2juf h PRO 53 N 8.46 0.00 -6.63 2.79 0.13 -1.88 -3.41 132.00 131.46 2juf h PRO 53 Ca -0.29 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.28 2juf h PRO 53 Cb 1.14 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.19 2juf h PRO 53 CO 0.65 0.22 0.92 -1.25 -0.23 0.00 0.00 178.00 178.32 2juf s PRO 54 N -4.47 3.63 0.35 1.56 0.04 -1.26 -3.27 135.00 131.58 2juf s PRO 54 Ca -0.03 0.42 -0.23 0.00 0.04 0.00 0.00 61.00 61.20 2juf s PRO 54 Cb 0.15 -3.95 -0.10 0.00 0.04 0.00 0.00 34.50 30.64 2juf s PRO 54 CO 0.69 -1.48 0.91 0.54 0.04 0.00 0.00 177.00 177.69 2juf s VAL 55 N 4.59 4.35 -0.16 -0.36 0.11 0.70 -4.64 120.40 124.98 2juf s VAL 55 Ca 0.45 1.59 -0.16 0.00 -2.93 0.00 0.00 61.98 60.93 2juf s VAL 55 Cb -0.07 -3.83 -0.04 0.00 -1.53 0.00 0.00 36.38 30.91 2juf s VAL 55 CO 0.29 -0.03 0.41 -1.10 -3.33 0.00 0.00 175.10 171.34 2juf s GLN 56 N -2.49 4.25 -0.01 1.54 1.11 -1.25 -1.33 119.66 121.48 2juf s GLN 56 Ca 0.54 0.28 0.01 0.00 0.01 0.00 0.00 55.36 56.19 2juf s GLN 56 Cb -0.15 -3.48 0.01 0.00 -1.01 0.00 0.00 33.01 28.39 2juf s GLN 56 CO 0.19 0.08 -0.01 0.14 0.01 0.00 0.00 175.29 175.71 2juf s VAL 57 N 0.91 0.15 -0.56 1.09 -7.23 -1.04 -3.85 120.40 109.87 2juf s VAL 57 Ca 0.21 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 60.11 2juf s VAL 57 Cb -0.14 -0.19 0.03 0.00 0.56 0.00 0.00 36.38 36.64 2juf s VAL 57 CO 0.08 0.09 1.15 0.12 -0.31 0.00 0.00 175.10 176.22 2juf s PHE 58 N 0.46 2.67 -0.21 2.82 2.19 -0.38 -1.52 117.98 124.01 2juf s PHE 58 Ca -0.04 0.40 -0.20 0.00 0.33 0.00 0.00 56.93 57.42 2juf s PHE 58 Cb -0.07 -4.44 -0.03 0.00 -1.31 0.00 0.00 43.02 37.18 2juf s PHE 58 CO -0.01 -1.50 0.60 -1.58 1.83 0.00 0.00 175.22 174.56 2juf s TRP 59 N 4.73 3.36 0.49 10.12 0.52 -0.29 -1.50 118.94 136.38 2juf s TRP 59 Ca 0.42 0.87 0.20 0.00 0.02 0.00 0.00 56.10 57.61 2juf s TRP 59 Cb -0.08 -2.77 1.32 0.00 -1.15 0.00 0.00 33.47 30.79 2juf s TRP 59 CO 0.26 -0.18 2.10 -0.56 0.02 0.00 0.00 176.95 178.59 2juf h GLN 60 N 7.55 0.00 -0.42 4.98 3.07 -1.83 0.14 115.11 128.60 2juf h GLN 60 Ca -0.31 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.40 2juf h GLN 60 Cb 1.14 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.69 2juf h GLN 60 CO 0.76 0.09 0.14 1.03 0.09 0.00 0.00 178.83 180.94 2juf h SER 61 N 0.00 0.61 -0.01 0.06 0.87 -1.93 -3.18 113.55 109.97 2juf h SER 61 Ca -0.00 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2juf h SER 61 Cb 0.18 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2juf h SER 61 CO 0.01 0.64 -0.44 1.07 -0.53 0.00 0.00 176.83 177.58 2juf n THR 62 N -4.59 0.00 -1.10 2.23 5.66 -1.18 -5.00 114.28 110.30 2juf n THR 62 Ca 0.00 -0.28 -0.04 0.00 -3.05 0.00 0.00 64.05 60.69 2juf n THR 62 Cb 0.18 1.15 -0.02 0.00 -1.55 0.00 0.00 70.33 70.09 2juf n THR 62 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2juf n GLY 63 N 1.22 0.64 3.49 1.09 0.00 0.44 -4.99 105.19 107.09 2juf n GLY 63 Ca 0.06 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 2juf n GLY 63 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2juf s ARG 64 N -1.72 1.36 -0.29 1.61 1.70 -0.96 -4.94 118.95 115.71 2juf s ARG 64 Ca 0.00 -1.02 -0.23 0.00 -0.47 0.00 0.00 55.73 54.01 2juf s ARG 64 Cb 0.00 0.47 -0.00 0.00 -0.57 0.00 0.00 34.95 34.85 2juf s ARG 64 CO 0.00 -0.56 0.75 0.99 -1.08 0.00 0.00 175.30 175.40 2juf s THR 65 N -3.93 4.84 0.18 4.99 2.01 -1.26 -1.14 115.64 121.34 2juf s THR 65 Ca 0.14 1.19 0.08 0.00 0.31 0.00 0.00 61.69 63.41 2juf s THR 65 Cb 0.00 -4.09 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2juf s THR 65 CO 0.00 -0.17 -0.17 -0.47 -0.69 0.00 0.00 174.62 173.13 2juf s TYR 66 N 2.83 1.75 -0.43 4.92 5.04 -0.58 -4.81 117.35 126.08 2juf s TYR 66 Ca 0.31 -0.51 -0.26 0.00 -2.44 0.00 0.00 57.07 54.17 2juf s TYR 66 Cb -0.15 -0.85 0.02 0.00 0.35 0.00 0.00 41.96 41.33 2juf s TYR 66 CO 0.11 0.33 0.94 -1.58 -1.34 0.00 0.00 175.55 174.01 2juf s TRP 67 N -2.37 2.97 0.07 4.97 0.51 -1.26 -2.51 118.94 121.32 2juf s TRP 67 Ca 0.18 0.54 0.05 0.00 -2.12 0.00 0.00 56.10 54.75 2juf s TRP 67 Cb -0.04 -3.90 -0.03 0.00 -0.81 0.00 0.00 33.47 28.70 2juf s TRP 67 CO 0.06 -1.02 -0.15 0.14 -0.51 0.00 0.00 176.95 175.48 2juf s VAL 68 N 3.71 1.15 0.38 4.03 -7.23 -0.44 -4.91 120.40 117.10 2juf s VAL 68 Ca 0.38 -1.30 -0.24 0.00 -1.81 0.00 0.00 61.98 59.02 2juf s VAL 68 Cb -0.10 -1.10 -0.10 0.00 0.56 0.00 0.00 36.38 35.64 2juf s VAL 68 CO 0.24 -0.19 0.98 -2.28 -0.31 0.00 0.00 175.10 173.53 2juf s HIS 69 N -1.23 3.44 0.14 2.82 2.46 -1.26 -0.22 115.29 121.44 2juf s HIS 69 Ca -0.01 1.69 -0.17 0.00 0.47 0.00 0.00 55.06 57.04 2juf s HIS 69 Cb -0.10 -2.96 -0.01 0.00 -0.13 0.00 0.00 32.58 29.38 2juf s HIS 69 CO 0.02 -0.15 1.76 -1.49 -2.47 0.00 0.00 174.74 172.42 2juf h TRP 70 N 2.57 0.48 0.00 3.88 4.06 -1.88 -1.89 115.95 123.18 2juf h TRP 70 Ca -0.48 -0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.45 2juf h TRP 70 Cb 1.20 -0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 29.20 2juf h TRP 70 CO 0.60 0.35 -0.09 1.25 -3.56 0.00 0.00 178.44 177.00 2juf h HIS 71 N 0.47 0.00 -0.63 0.49 2.76 -1.86 -2.14 115.15 114.24 2juf h HIS 71 Ca 0.13 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 2juf h HIS 71 Cb 0.02 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.98 2juf h HIS 71 CO -0.03 0.09 0.00 -1.33 -1.30 0.00 0.00 177.93 175.35 2juf n MET 72 N -3.31 3.36 -4.63 5.26 2.81 -0.92 -4.81 117.12 114.90 2juf n MET 72 Ca -0.01 -2.76 -0.33 0.00 -1.81 0.00 0.00 57.70 52.80 2juf n MET 72 Cb 0.29 -1.75 -0.16 0.00 -0.71 0.00 0.00 33.22 30.89 2juf n MET 72 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2juf s LEU 73 N -1.59 2.33 0.10 4.03 1.98 -0.76 -3.92 118.68 120.85 2juf s LEU 73 Ca 0.48 -0.52 0.03 0.00 -2.89 0.00 0.00 54.13 51.23 2juf s LEU 73 Cb 0.29 -1.51 -0.04 0.00 0.66 0.00 0.00 46.19 45.59 2juf s LEU 73 CO 0.26 0.09 0.09 -0.70 -1.89 0.00 0.00 176.35 174.20 2juf s GLU 74 N 0.77 2.89 -0.26 1.98 2.56 -0.80 -4.94 118.70 120.90 2juf s GLU 74 Ca -0.07 -0.72 -0.05 0.00 0.00 0.00 0.00 54.97 54.13 2juf s GLU 74 Cb -0.16 -2.72 0.01 0.00 2.00 0.00 0.00 34.13 33.27 2juf s GLU 74 CO 0.00 0.55 0.01 0.96 -0.56 0.00 0.00 175.26 176.22 2juf s ILE 75 N -1.46 3.51 -2.67 -3.70 -4.36 -1.26 -0.90 121.20 110.36 2juf s ILE 75 Ca 0.30 -0.74 0.23 0.00 -0.26 0.00 0.00 60.65 60.18 2juf s ILE 75 Cb -0.12 -2.76 0.14 0.00 1.25 0.00 0.00 42.46 40.97 2juf s ILE 75 CO 0.22 0.19 1.19 -0.11 0.24 0.00 0.00 174.94 176.68 2juf n LEU 76 N 4.79 2.70 0.00 0.37 7.94 -1.18 -4.86 117.00 126.76 2juf n LEU 76 Ca -0.16 -0.94 0.04 0.00 -1.11 0.00 0.00 56.01 53.84 2juf n LEU 76 Cb 0.48 0.00 0.25 0.00 0.53 0.00 0.00 43.42 44.68 2juf n LEU 76 CO 0.29 0.46 0.48 0.61 -1.11 0.00 0.00 177.39 178.12