#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 0.00 1.30 2.98 0.00 -1.86 -1.06 103.07 104.42 2juf h GLY 15 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2juf h GLY 15 CO 0.00 0.00 -0.71 -2.09 0.00 0.00 0.00 176.54 173.74 2juf h GLU 16 N 0.00 0.70 -0.14 4.80 4.81 -1.99 -2.82 114.58 119.94 2juf h GLU 16 Ca -0.00 -0.54 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 2juf h GLU 16 Cb 0.54 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2juf h GLU 16 CO 0.04 1.16 0.07 -0.92 -0.73 0.00 0.00 179.01 178.62 2juf h TYR 17 N 0.49 0.21 -0.64 0.92 3.20 -1.87 -2.66 116.97 116.62 2juf h TYR 17 Ca -0.03 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 2juf h TYR 17 Cb 1.32 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.50 2juf h TYR 17 CO 0.07 0.25 0.29 -0.39 -1.64 0.00 0.00 178.16 176.74 2juf h VAL 18 N 0.11 1.21 -0.33 1.81 -1.51 -1.31 -1.83 116.25 114.39 2juf h VAL 18 Ca 0.05 -0.61 0.10 0.00 -1.23 0.00 0.00 66.70 65.01 2juf h VAL 18 Cb 0.12 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 29.68 2juf h VAL 18 CO -0.01 0.25 0.24 -0.61 -1.23 0.00 0.00 177.57 176.21 2juf h GLN 19 N 0.90 0.00 0.05 5.19 -0.00 -1.21 0.17 115.11 120.21 2juf h GLN 19 Ca 0.22 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.78 2juf h GLN 19 Cb 0.11 0.00 0.01 0.00 0.00 0.00 0.00 27.48 27.60 2juf h GLN 19 CO -0.03 0.00 -0.37 1.96 0.00 0.00 0.00 178.83 180.40 2juf h GLN 20 N 0.00 0.16 -0.30 1.69 1.08 -1.03 -3.38 115.11 113.33 2juf h GLN 20 Ca 0.16 -0.24 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2juf h GLN 20 Cb 0.63 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.15 2juf h GLN 20 CO -0.00 1.07 0.00 -2.37 -0.95 0.00 0.00 178.83 176.58 2juf n THR 21 N -4.40 0.38 -2.97 -0.54 5.66 -0.80 -4.89 114.28 106.73 2juf n THR 21 Ca -0.11 -0.62 -0.42 0.00 -3.05 0.00 0.00 64.05 59.85 2juf n THR 21 Cb 0.61 0.85 -0.05 0.00 -1.55 0.00 0.00 70.33 70.19 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 -1.55 4.13 -0.03 1.09 2.01 -0.02 -5.05 118.68 119.25 2juf s LEU 22 Ca 0.36 0.42 -0.16 0.00 0.01 0.00 0.00 54.13 54.77 2juf s LEU 22 Cb 0.21 -3.01 -0.05 0.00 0.01 0.00 0.00 46.19 43.35 2juf s LEU 22 CO 0.30 -0.68 0.42 -1.10 1.01 0.00 0.00 176.35 176.31 2juf s GLN 23 N 3.01 4.05 -0.95 1.70 1.11 -1.26 -5.02 119.66 122.30 2juf s GLN 23 Ca 0.31 0.42 -0.25 0.00 0.01 0.00 0.00 55.36 55.85 2juf s GLN 23 Cb -0.14 -3.28 -0.11 0.00 -1.01 0.00 0.00 33.01 28.47 2juf s GLN 23 CO 0.15 0.55 2.11 -2.14 0.01 0.00 0.00 175.29 175.97 2juf s PRO 24 N -0.62 2.05 0.00 2.91 0.02 -1.26 -2.40 135.00 135.70 2juf s PRO 24 Ca 0.24 -0.25 0.00 0.00 0.02 0.00 0.00 61.00 61.01 2juf s PRO 24 Cb -0.16 -5.00 0.00 0.00 0.02 0.00 0.00 34.50 29.35 2juf s PRO 24 CO 0.12 -4.14 0.00 0.41 -0.33 0.00 0.00 177.00 173.06 2juf n GLY 25 N 6.54 -0.76 4.00 0.52 0.00 0.12 -4.89 105.19 110.72 2juf n GLY 25 Ca 0.43 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.24 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 2.13 -0.21 1.61 0.23 -1.01 -4.82 119.30 117.23 2juf s MET 26 Ca 0.00 -1.19 -0.11 0.00 -1.03 0.00 0.00 55.69 53.37 2juf s MET 26 Cb 0.00 -2.49 -0.05 0.00 -1.53 0.00 0.00 34.83 30.76 2juf s MET 26 CO 0.00 -1.03 0.16 0.50 -2.03 0.00 0.00 175.02 172.62 2juf s ARG 27 N -4.86 4.16 0.43 3.16 6.06 -1.25 -1.36 118.95 125.29 2juf s ARG 27 Ca 0.62 -0.20 0.07 0.00 -2.50 0.00 0.00 55.73 53.72 2juf s ARG 27 Cb -0.07 -3.46 -0.05 0.00 0.06 0.00 0.00 34.95 31.43 2juf s ARG 27 CO 0.41 0.21 0.14 0.14 -2.50 0.00 0.00 175.30 173.70 2juf s VAL 28 N 0.60 2.08 -0.08 7.11 -7.23 -0.54 -3.67 120.40 118.68 2juf s VAL 28 Ca 0.09 -1.78 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 2juf s VAL 28 Cb -0.12 -2.86 0.04 0.00 0.56 0.00 0.00 36.38 34.00 2juf s VAL 28 CO 0.01 0.00 0.17 -0.60 -0.31 0.00 0.00 175.10 174.36 2juf s ARG 29 N -3.88 0.09 -0.17 4.82 3.00 0.22 -2.43 118.95 120.60 2juf s ARG 29 Ca 0.36 0.46 -0.29 0.00 -1.00 0.00 0.00 55.73 55.26 2juf s ARG 29 Cb 0.05 -0.19 -0.00 0.00 0.00 0.00 0.00 34.95 34.80 2juf s ARG 29 CO 0.20 -0.21 1.08 1.41 0.00 0.00 0.00 175.30 177.78 2juf s MET 30 N 1.54 4.31 -0.09 5.12 -2.45 -1.20 -0.76 119.30 125.77 2juf s MET 30 Ca -0.06 1.44 0.16 0.00 -1.25 0.00 0.00 55.69 55.99 2juf s MET 30 Cb -0.12 -3.63 0.56 0.00 1.25 0.00 0.00 34.83 32.90 2juf s MET 30 CO -0.06 -0.54 1.47 1.47 1.05 0.00 0.00 175.02 178.41 2juf n LEU 31 N 5.91 4.01 -4.29 4.11 -0.00 -0.93 -2.39 117.00 123.43 2juf n LEU 31 Ca 0.11 -2.40 -0.16 0.00 -0.00 0.00 0.00 56.01 53.56 2juf n LEU 31 Cb 0.47 -0.47 -0.10 0.00 -0.00 0.00 0.00 43.42 43.32 2juf n LEU 31 CO 0.53 0.78 -0.22 -1.81 -0.00 0.00 0.00 177.39 176.67 2juf s ASP 32 N -1.15 1.05 -0.06 1.45 1.01 -1.25 -4.88 116.67 112.83 2juf s ASP 32 Ca 0.41 -1.48 -0.10 0.00 0.71 0.00 0.00 52.55 52.09 2juf s ASP 32 Cb 0.27 0.34 -0.05 0.00 1.01 0.00 0.00 42.92 44.49 2juf s ASP 32 CO 0.20 -0.85 0.25 1.51 0.21 0.00 0.00 175.17 176.49 2juf s ASP 33 N -3.29 6.55 0.31 0.27 -4.77 -1.26 -1.38 116.67 113.10 2juf s ASP 33 Ca 0.38 0.65 0.03 0.00 -3.30 0.00 0.00 52.55 50.31 2juf s ASP 33 Cb 0.06 -2.14 -0.04 0.00 -1.09 0.00 0.00 42.92 39.71 2juf s ASP 33 CO 0.16 0.36 0.14 -0.31 0.70 0.00 0.00 175.17 176.22 2juf s TYR 34 N -1.08 1.63 0.28 2.11 1.51 0.62 -4.99 117.35 117.43 2juf s TYR 34 Ca 0.20 -1.30 -0.00 0.00 -1.01 0.00 0.00 57.07 54.95 2juf s TYR 34 Cb -0.14 -0.93 0.63 0.00 -0.11 0.00 0.00 41.96 41.42 2juf s TYR 34 CO 0.09 -0.43 1.65 0.93 -1.11 0.00 0.00 175.55 176.68 2juf h GLU 35 N 2.19 0.21 0.00 -0.62 4.39 -1.99 -3.34 114.58 115.43 2juf h GLU 35 Ca -0.35 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.34 2juf h GLU 35 Cb 1.25 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2juf h GLU 35 CO 0.55 0.14 0.00 -0.85 -1.16 0.00 0.00 179.01 177.69 2juf n GLU 36 N -5.22 0.00 -4.48 2.33 0.28 -1.26 -5.08 120.64 107.21 2juf n GLU 36 Ca 0.19 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.89 2juf n GLU 36 Cb 0.62 -0.39 -0.12 0.00 1.43 0.00 0.00 31.44 32.98 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 0.00 2.82 0.21 3.84 1.09 -1.25 -4.60 121.20 123.30 2juf s ILE 37 Ca 0.00 -1.35 0.07 0.00 -1.10 0.00 0.00 60.65 58.27 2juf s ILE 37 Cb 0.00 -2.24 -0.05 0.00 -1.06 0.00 0.00 42.46 39.11 2juf s ILE 37 CO 0.00 0.22 -0.12 -0.44 -0.10 0.00 0.00 174.94 174.50 2juf s SER 38 N -1.79 2.43 -0.20 3.58 0.01 -1.26 -0.27 113.70 116.20 2juf s SER 38 Ca 0.16 -1.05 -0.29 0.00 1.31 0.00 0.00 55.95 56.08 2juf s SER 38 Cb -0.11 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 65.97 2juf s SER 38 CO 0.08 -0.24 1.82 0.00 0.41 0.00 0.00 173.24 175.31 2juf s ALA 39 N -3.06 3.14 0.00 1.44 0.00 -0.48 -3.05 121.76 119.76 2juf s ALA 39 Ca 0.23 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.81 2juf s ALA 39 Cb 0.01 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 19.21 2juf s ALA 39 CO 0.07 -2.17 0.00 0.41 0.00 0.00 0.00 175.76 174.06 2juf n GLY 40 N 4.99 2.91 3.80 0.00 0.00 -1.01 -4.98 105.19 110.91 2juf n GLY 40 Ca 0.22 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 2juf n GLY 40 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2juf s ASP 41 N 0.00 6.73 0.23 1.61 -4.77 -1.17 -4.77 116.67 114.53 2juf s ASP 41 Ca 0.00 1.85 0.08 0.00 -3.30 0.00 0.00 52.55 51.18 2juf s ASP 41 Cb 0.00 -2.56 -0.05 0.00 -1.09 0.00 0.00 42.92 39.22 2juf s ASP 41 CO 0.00 -0.51 -0.13 -1.61 0.70 0.00 0.00 175.17 173.63 2juf s GLU 42 N -2.96 1.43 0.08 2.11 2.02 -1.26 -3.23 118.70 116.88 2juf s GLU 42 Ca 0.62 -1.66 0.01 0.00 0.02 0.00 0.00 54.97 53.96 2juf s GLU 42 Cb -0.15 -1.20 -0.00 0.00 0.10 0.00 0.00 34.13 32.88 2juf s GLU 42 CO 0.19 0.16 0.04 0.41 0.02 0.00 0.00 175.26 176.08 2juf n GLY 43 N -0.46 3.87 2.98 -1.39 0.00 -1.02 -2.61 105.19 106.56 2juf n GLY 43 Ca -0.07 -1.85 -0.20 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.30 0.86 -0.10 1.61 2.12 -0.70 -1.47 118.70 118.72 2juf s GLU 44 Ca 0.06 -0.26 -0.30 0.00 0.36 0.00 0.00 54.97 54.83 2juf s GLU 44 Cb 0.00 -0.81 -0.03 0.00 0.26 0.00 0.00 34.13 33.55 2juf s GLU 44 CO 0.04 0.09 1.37 0.12 -0.54 0.00 0.00 175.26 176.34 2juf s PHE 45 N 0.22 2.68 -0.17 5.30 5.36 -0.46 -1.37 117.98 129.54 2juf s PHE 45 Ca -0.03 0.81 -0.05 0.00 -0.96 0.00 0.00 56.93 56.70 2juf s PHE 45 Cb -0.08 -3.61 -0.09 0.00 -0.34 0.00 0.00 43.02 38.90 2juf s PHE 45 CO 0.00 -2.27 -0.20 0.54 -1.46 0.00 0.00 175.22 171.83 2juf n ARG 46 N 6.38 0.39 -3.66 10.12 5.12 -1.25 0.14 116.66 133.90 2juf n ARG 46 Ca 0.14 0.14 -0.10 0.00 -1.93 0.00 0.00 57.85 56.10 2juf n ARG 46 Cb 0.44 -1.20 -0.05 0.00 -1.16 0.00 0.00 32.46 30.49 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 -2.33 1.03 0.45 5.56 0.00 -1.25 -4.76 119.66 118.36 2juf s GLN 47 Ca -0.24 -0.71 0.05 0.00 -0.00 0.00 0.00 55.36 54.46 2juf s GLN 47 Cb 0.08 0.45 -0.05 0.00 0.00 0.00 0.00 33.01 33.49 2juf s GLN 47 CO 0.34 -0.39 0.02 -1.54 0.00 0.00 0.00 175.29 173.71 2juf s SER 48 N -2.74 4.01 -0.02 12.60 1.04 -1.26 -4.03 113.70 123.30 2juf s SER 48 Ca 0.02 -1.47 0.05 0.00 0.48 0.00 0.00 55.95 55.04 2juf s SER 48 Cb 0.02 -0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.10 2juf s SER 48 CO -0.11 -0.62 -0.17 0.20 0.98 0.00 0.00 173.24 173.52 2juf s ASN 49 N -3.79 2.01 0.26 7.02 0.01 -1.26 -4.98 114.94 114.20 2juf s ASN 49 Ca 0.24 -0.31 -0.04 0.00 -0.71 0.00 0.00 52.86 52.03 2juf s ASN 49 Cb 0.06 -0.30 0.30 0.00 0.41 0.00 0.00 41.25 41.72 2juf s ASN 49 CO 0.12 0.19 1.86 -0.55 -1.51 0.00 0.00 177.10 177.22 2juf h ASN 50 N 5.85 0.99 0.00 -1.22 7.08 -2.01 -3.38 115.58 122.89 2juf h ASN 50 Ca -0.36 -0.11 -0.08 0.00 -3.08 0.00 0.00 56.30 52.68 2juf h ASN 50 Cb 1.16 -0.25 -0.08 0.00 -2.08 0.00 0.00 38.32 37.07 2juf h ASN 50 CO 0.48 0.83 -0.17 0.61 -2.08 0.00 0.00 177.43 177.11 2juf n GLY 51 N -1.07 0.56 3.42 9.14 0.00 -1.26 -5.09 105.19 110.88 2juf n GLY 51 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 5.07 0.30 -0.61 -1.09 -1.26 -5.02 121.20 118.58 2juf s ILE 52 Ca 0.00 -0.84 0.02 0.00 -2.23 0.00 0.00 60.65 57.60 2juf s ILE 52 Cb 0.00 -3.89 0.29 0.00 -1.58 0.00 0.00 42.46 37.28 2juf s ILE 52 CO 0.00 -0.38 1.86 1.55 -1.23 0.00 0.00 174.94 176.74 2juf h PRO 53 N 8.61 0.94 -6.13 2.79 0.13 -1.95 -3.36 132.00 133.03 2juf h PRO 53 Ca -0.27 -0.06 -0.51 0.00 -0.87 0.00 0.00 66.00 64.30 2juf h PRO 53 Cb 1.11 -0.21 -0.06 0.00 0.13 0.00 0.00 31.00 31.97 2juf h PRO 53 CO 0.76 0.62 1.18 -1.25 -0.23 0.00 0.00 178.00 179.08 2juf s PRO 54 N -5.91 3.00 0.29 1.56 0.04 -1.26 -3.39 135.00 129.34 2juf s PRO 54 Ca -0.12 -0.10 -0.07 0.00 0.04 0.00 0.00 61.00 60.75 2juf s PRO 54 Cb 0.22 -4.51 -0.06 0.00 0.04 0.00 0.00 34.50 30.19 2juf s PRO 54 CO 0.80 -2.47 0.59 0.54 0.04 0.00 0.00 177.00 176.50 2juf s VAL 55 N 7.15 4.95 -0.17 -0.36 0.11 0.97 -4.63 120.40 128.42 2juf s VAL 55 Ca 0.51 0.29 -0.13 0.00 -2.93 0.00 0.00 61.98 59.71 2juf s VAL 55 Cb -0.08 -3.70 -0.05 0.00 -1.53 0.00 0.00 36.38 31.02 2juf s VAL 55 CO 0.12 -0.28 0.27 -1.10 -3.33 0.00 0.00 175.10 170.77 2juf s GLN 56 N -3.39 4.25 0.00 1.54 1.11 -1.26 -1.59 119.66 120.33 2juf s GLN 56 Ca 0.46 0.04 0.00 0.00 0.01 0.00 0.00 55.36 55.88 2juf s GLN 56 Cb -0.11 -3.43 -0.00 0.00 -1.01 0.00 0.00 33.01 28.46 2juf s GLN 56 CO 0.27 0.24 -0.01 0.14 0.01 0.00 0.00 175.29 175.95 2juf s VAL 57 N 0.48 0.04 -0.55 1.09 -7.23 -1.19 -3.77 120.40 109.26 2juf s VAL 57 Ca 0.15 -0.17 -0.28 0.00 -1.81 0.00 0.00 61.98 59.87 2juf s VAL 57 Cb -0.13 -0.07 0.03 0.00 0.56 0.00 0.00 36.38 36.78 2juf s VAL 57 CO 0.03 -0.09 1.13 0.12 -0.31 0.00 0.00 175.10 175.98 2juf s PHE 58 N -0.26 2.70 -0.05 2.82 5.36 -0.47 -2.30 117.98 125.77 2juf s PHE 58 Ca -0.03 0.42 -0.18 0.00 -0.96 0.00 0.00 56.93 56.18 2juf s PHE 58 Cb -0.02 -4.40 -0.05 0.00 -0.34 0.00 0.00 43.02 38.21 2juf s PHE 58 CO -0.00 -1.45 0.51 -1.58 -1.46 0.00 0.00 175.22 171.24 2juf s TRP 59 N 4.63 3.62 0.38 10.12 0.52 -0.56 -1.71 118.94 135.93 2juf s TRP 59 Ca 0.42 1.03 0.05 0.00 0.02 0.00 0.00 56.10 57.63 2juf s TRP 59 Cb -0.08 -2.53 0.76 0.00 -1.15 0.00 0.00 33.47 30.47 2juf s TRP 59 CO 0.26 0.33 2.03 -0.56 0.02 0.00 0.00 176.95 179.03 2juf h GLN 60 N 5.92 0.68 -0.27 4.98 3.07 -1.84 0.60 115.11 128.24 2juf h GLN 60 Ca -0.45 -0.04 -0.05 0.00 0.09 0.00 0.00 58.65 58.20 2juf h GLN 60 Cb 1.20 -0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.59 2juf h GLN 60 CO 0.71 0.45 -0.03 0.66 0.09 0.00 0.00 178.83 180.70 2juf h SER 61 N 0.70 0.50 -0.00 0.06 4.64 -1.90 -3.28 113.55 114.25 2juf h SER 61 Ca 0.21 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2juf h SER 61 Cb -0.02 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2juf h SER 61 CO -0.05 0.71 -0.71 1.07 -0.87 0.00 0.00 176.83 176.98 2juf n THR 62 N -4.57 0.00 -1.52 2.95 5.66 -1.22 -5.00 114.28 110.58 2juf n THR 62 Ca -0.03 -0.14 -0.13 0.00 -3.05 0.00 0.00 64.05 60.69 2juf n THR 62 Cb 0.28 1.02 -0.05 0.00 -1.55 0.00 0.00 70.33 70.03 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 1.36 1.14 3.59 1.09 0.00 0.20 -4.97 105.19 107.60 2juf n GLY 63 Ca 0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.36 1.88 -0.06 1.61 1.70 -1.22 -4.93 118.95 114.57 2juf s ARG 64 Ca 0.00 -1.54 -0.25 0.00 -0.47 0.00 0.00 55.73 53.47 2juf s ARG 64 Cb 0.00 0.49 -0.03 0.00 -0.57 0.00 0.00 34.95 34.84 2juf s ARG 64 CO 0.00 -0.81 0.76 0.95 -1.08 0.00 0.00 175.30 175.12 2juf s THR 65 N -3.17 5.00 0.15 4.99 -4.23 -1.26 -1.50 115.64 115.63 2juf s THR 65 Ca 0.25 1.57 0.05 0.00 -1.18 0.00 0.00 61.69 62.38 2juf s THR 65 Cb -0.02 -4.10 -0.04 0.00 1.34 0.00 0.00 72.50 69.68 2juf s THR 65 CO 0.15 0.22 -0.12 -0.47 -0.54 0.00 0.00 174.62 173.86 2juf s TYR 66 N 0.92 1.38 -0.60 3.99 5.04 -0.97 -4.88 117.35 122.22 2juf s TYR 66 Ca 0.40 -0.67 -0.27 0.00 -2.44 0.00 0.00 57.07 54.09 2juf s TYR 66 Cb -0.18 -0.69 0.03 0.00 0.35 0.00 0.00 41.96 41.47 2juf s TYR 66 CO 0.20 0.15 1.15 -1.58 -1.34 0.00 0.00 175.55 174.12 2juf s TRP 67 N -2.94 2.59 0.17 4.97 0.51 -1.26 -3.19 118.94 119.80 2juf s TRP 67 Ca 0.15 0.22 0.08 0.00 -2.12 0.00 0.00 56.10 54.43 2juf s TRP 67 Cb -0.00 -4.44 -0.04 0.00 -0.81 0.00 0.00 33.47 28.18 2juf s TRP 67 CO 0.02 -1.62 -0.16 0.14 -0.51 0.00 0.00 176.95 174.82 2juf s VAL 68 N 4.85 1.72 0.30 4.03 -7.23 -0.62 -4.87 120.40 118.58 2juf s VAL 68 Ca 0.38 -1.99 -0.18 0.00 -1.81 0.00 0.00 61.98 58.37 2juf s VAL 68 Cb -0.09 -1.87 -0.09 0.00 0.56 0.00 0.00 36.38 34.89 2juf s VAL 68 CO 0.22 -0.43 0.78 -2.28 -0.31 0.00 0.00 175.10 173.08 2juf s HIS 69 N -2.39 3.49 0.14 2.82 2.46 -1.26 -0.02 115.29 120.53 2juf s HIS 69 Ca 0.17 1.38 -0.18 0.00 0.47 0.00 0.00 55.06 56.91 2juf s HIS 69 Cb -0.04 -2.64 -0.03 0.00 -0.13 0.00 0.00 32.58 29.74 2juf s HIS 69 CO 0.06 0.16 1.80 -1.49 -2.47 0.00 0.00 174.74 172.80 2juf h TRP 70 N 2.71 0.38 0.00 3.88 4.06 -1.89 -2.47 115.95 122.62 2juf h TRP 70 Ca -0.48 0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.44 2juf h TRP 70 Cb 1.18 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 29.21 2juf h TRP 70 CO 0.62 0.24 -0.19 1.25 -3.56 0.00 0.00 178.44 176.81 2juf h HIS 71 N 0.41 0.00 -0.02 0.49 2.76 -1.87 -2.93 115.15 113.99 2juf h HIS 71 Ca 0.11 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2juf h HIS 71 Cb -0.04 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.92 2juf h HIS 71 CO -0.06 0.19 -0.18 -1.33 -1.30 0.00 0.00 177.93 175.24 2juf n MET 72 N -3.72 1.52 -4.21 5.26 2.81 -0.96 -4.78 117.12 113.04 2juf n MET 72 Ca -0.02 -1.11 -0.24 0.00 -1.81 0.00 0.00 57.70 54.53 2juf n MET 72 Cb 0.30 -1.48 -0.07 0.00 -0.71 0.00 0.00 33.22 31.27 2juf n MET 72 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 2juf s LEU 73 N -2.24 3.42 -0.01 4.03 0.05 -1.00 -2.18 118.68 120.75 2juf s LEU 73 Ca 0.27 -0.43 0.01 0.00 0.05 0.00 0.00 54.13 54.03 2juf s LEU 73 Cb 0.20 -2.00 0.01 0.00 -2.05 0.00 0.00 46.19 42.34 2juf s LEU 73 CO 0.43 0.03 -0.02 -0.70 -0.55 0.00 0.00 176.35 175.54 2juf s GLU 74 N -3.41 0.21 -0.41 1.48 2.12 0.06 -4.92 118.70 113.83 2juf s GLU 74 Ca 0.30 -0.04 -0.25 0.00 0.36 0.00 0.00 54.97 55.35 2juf s GLU 74 Cb -0.08 -0.26 0.02 0.00 0.26 0.00 0.00 34.13 34.07 2juf s GLU 74 CO 0.21 -0.00 0.88 0.96 -0.54 0.00 0.00 175.26 176.76 2juf s ILE 75 N 0.25 4.58 -0.11 -3.70 -4.36 -1.26 0.71 121.20 117.31 2juf s ILE 75 Ca -0.02 0.86 0.01 0.00 -0.26 0.00 0.00 60.65 61.24 2juf s ILE 75 Cb -0.05 -4.34 0.02 0.00 1.25 0.00 0.00 42.46 39.34 2juf s ILE 75 CO -0.01 -0.65 0.86 -0.11 0.24 0.00 0.00 174.94 175.28 2juf n LEU 76 N 6.84 1.76 0.00 0.37 7.94 -1.25 -4.98 117.00 127.69 2juf n LEU 76 Ca 0.05 -1.67 0.00 0.00 -1.11 0.00 0.00 56.01 53.28 2juf n LEU 76 Cb 0.48 -0.02 0.00 0.00 0.53 0.00 0.00 43.42 44.42 2juf n LEU 76 CO 0.60 0.44 0.13 0.61 -1.11 0.00 0.00 177.39 178.05