#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 0.87 1.35 2.98 0.00 -1.86 -1.05 103.07 105.37 2juf h GLY 15 Ca 0.00 -1.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.17 2juf h GLY 15 CO 0.00 0.89 -0.52 0.83 0.00 0.00 0.00 176.54 177.75 2juf h GLU 16 N 0.62 0.69 -0.16 4.80 3.07 -2.00 -2.95 114.58 118.65 2juf h GLU 16 Ca 0.02 -0.42 0.02 0.00 -0.50 0.00 0.00 59.36 58.48 2juf h GLU 16 Cb 1.11 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 29.04 2juf h GLU 16 CO 0.11 1.04 0.04 -0.92 -1.40 0.00 0.00 179.01 177.88 2juf h TYR 17 N 0.54 0.07 -0.76 4.33 3.20 -1.94 -1.52 116.97 120.89 2juf h TYR 17 Ca 0.02 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2juf h TYR 17 Cb 1.08 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.31 2juf h TYR 17 CO 0.05 0.03 0.34 -0.39 -1.64 0.00 0.00 178.16 176.55 2juf h VAL 18 N 0.11 1.24 -0.95 1.81 -1.51 -1.24 -1.90 116.25 113.82 2juf h VAL 18 Ca 0.07 -0.72 0.03 0.00 -1.23 0.00 0.00 66.70 64.85 2juf h VAL 18 Cb 0.05 0.30 -0.05 0.00 -2.13 0.00 0.00 31.29 29.46 2juf h VAL 18 CO -0.09 0.30 0.62 -0.61 -1.23 0.00 0.00 177.57 176.57 2juf h GLN 19 N 1.09 1.17 -0.58 5.19 -0.00 -1.28 0.23 115.11 120.92 2juf h GLN 19 Ca 0.26 -0.07 -0.11 0.00 -0.00 0.00 0.00 58.65 58.73 2juf h GLN 19 Cb 0.15 -0.26 -0.02 0.00 0.00 0.00 0.00 27.48 27.35 2juf h GLN 19 CO -0.03 0.78 -0.06 1.96 0.00 0.00 0.00 178.83 181.48 2juf h GLN 20 N 1.21 1.07 -0.33 1.69 1.08 -0.57 -3.31 115.11 115.95 2juf h GLN 20 Ca 0.37 -0.37 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2juf h GLN 20 Cb -0.02 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.33 2juf h GLN 20 CO -0.12 1.07 0.00 -2.37 -0.95 0.00 0.00 178.83 176.47 2juf n THR 21 N -4.16 1.40 -2.93 -0.54 5.66 -0.78 -4.96 114.28 107.97 2juf n THR 21 Ca 0.02 -1.27 -0.43 0.00 -3.05 0.00 0.00 64.05 59.33 2juf n THR 21 Cb 0.38 0.27 -0.05 0.00 -1.55 0.00 0.00 70.33 69.38 2juf n THR 21 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2juf s LEU 22 N -1.56 4.18 0.13 1.09 2.96 0.74 -5.02 118.68 121.19 2juf s LEU 22 Ca 0.30 0.03 -0.20 0.00 -0.22 0.00 0.00 54.13 54.04 2juf s LEU 22 Cb 0.19 -3.02 -0.07 0.00 0.50 0.00 0.00 46.19 43.79 2juf s LEU 22 CO 0.14 -0.91 0.63 -1.10 -1.32 0.00 0.00 176.35 173.79 2juf s GLN 23 N 3.35 4.25 -0.95 1.98 -0.21 -1.26 -4.99 119.66 121.83 2juf s GLN 23 Ca 0.32 0.80 -0.26 0.00 0.02 0.00 0.00 55.36 56.24 2juf s GLN 23 Cb -0.12 -3.14 -0.16 0.00 1.00 0.00 0.00 33.01 30.59 2juf s GLN 23 CO 0.22 0.56 2.22 -1.25 -2.12 0.00 0.00 175.29 174.92 2juf s PRO 24 N -1.38 1.57 0.00 2.91 0.04 -1.26 -3.24 135.00 133.64 2juf s PRO 24 Ca 0.34 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.31 2juf s PRO 24 Cb -0.19 -4.92 0.00 0.00 0.04 0.00 0.00 34.50 29.43 2juf s PRO 24 CO 0.21 -4.76 0.00 0.41 0.04 0.00 0.00 177.00 172.90 2juf n GLY 25 N 6.48 0.51 0.98 0.56 0.00 -1.12 -5.04 105.19 107.57 2juf n GLY 25 Ca 0.44 -0.59 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 2juf n GLY 25 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2juf n MET 26 N -0.18 0.03 0.00 1.61 0.00 -1.20 -5.03 117.12 112.36 2juf n MET 26 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 57.70 57.71 2juf n MET 26 Cb 0.07 -0.56 0.00 0.00 0.00 0.00 0.00 33.22 32.73 2juf n MET 26 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2juf n ARG 27 N -3.48 0.00 -4.50 3.17 3.00 -1.26 -4.40 116.66 109.20 2juf n ARG 27 Ca -0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.56 2juf n ARG 27 Cb 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.48 2juf n ARG 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 2juf s VAL 28 N 0.00 1.92 -0.01 5.15 -7.23 -0.93 -2.22 120.40 117.08 2juf s VAL 28 Ca 0.00 -1.91 -0.14 0.00 -1.81 0.00 0.00 61.98 58.13 2juf s VAL 28 Cb 0.00 -2.83 0.02 0.00 0.56 0.00 0.00 36.38 34.13 2juf s VAL 28 CO 0.00 0.00 0.28 -0.60 -0.31 0.00 0.00 175.10 174.47 2juf s ARG 29 N -3.81 0.65 -0.41 4.82 6.06 0.17 -1.93 118.95 124.50 2juf s ARG 29 Ca 0.31 -0.25 -0.21 0.00 -2.50 0.00 0.00 55.73 53.08 2juf s ARG 29 Cb 0.07 0.28 0.02 0.00 0.06 0.00 0.00 34.95 35.38 2juf s ARG 29 CO 0.17 -0.18 0.69 1.41 -2.50 0.00 0.00 175.30 174.89 2juf s MET 30 N -1.43 3.48 0.14 5.12 -2.45 0.86 -1.47 119.30 123.55 2juf s MET 30 Ca -0.13 -0.11 0.01 0.00 -1.25 0.00 0.00 55.69 54.20 2juf s MET 30 Cb -0.05 -3.89 -0.10 0.00 1.25 0.00 0.00 34.83 32.04 2juf s MET 30 CO 0.03 -0.93 1.31 1.25 1.05 0.00 0.00 175.02 177.73 2juf h LEU 31 N 9.70 0.28 -7.80 4.11 5.85 -1.89 -0.27 115.31 125.30 2juf h LEU 31 Ca -0.25 -0.25 -0.12 0.00 0.84 0.00 0.00 57.88 58.09 2juf h LEU 31 Cb 1.10 -0.09 -0.18 0.00 0.37 0.00 0.00 40.66 41.86 2juf h LEU 31 CO 0.89 1.10 -0.46 -0.62 -0.34 0.00 0.00 178.44 179.02 2juf s ASP 32 N -6.96 0.08 0.42 1.25 2.15 -1.26 -4.85 116.67 107.50 2juf s ASP 32 Ca -0.03 -0.40 -0.26 0.00 0.43 0.00 0.00 52.55 52.29 2juf s ASP 32 Cb 0.09 0.25 -0.09 0.00 -0.30 0.00 0.00 42.92 42.87 2juf s ASP 32 CO 0.84 -0.51 1.40 -0.62 -0.17 0.00 0.00 175.17 176.11 2juf s ASP 33 N -1.98 6.15 0.37 -0.34 2.15 -1.26 -4.49 116.67 117.26 2juf s ASP 33 Ca -0.07 2.86 0.04 0.00 0.43 0.00 0.00 52.55 55.81 2juf s ASP 33 Cb -0.02 -2.65 -0.06 0.00 -0.30 0.00 0.00 42.92 39.89 2juf s ASP 33 CO -0.03 -0.98 0.06 -0.31 -0.17 0.00 0.00 175.17 173.73 2juf s TYR 34 N -1.20 2.03 0.37 -5.34 1.51 -0.31 -4.93 117.35 109.49 2juf s TYR 34 Ca 0.57 -0.95 0.17 0.00 -1.01 0.00 0.00 57.07 55.85 2juf s TYR 34 Cb -0.42 -1.38 1.09 0.00 -0.11 0.00 0.00 41.96 41.13 2juf s TYR 34 CO 0.55 0.06 1.73 0.93 -1.11 0.00 0.00 175.55 177.71 2juf h GLU 35 N 1.95 0.38 0.00 -0.62 4.39 -1.96 -3.08 114.58 115.64 2juf h GLU 35 Ca -0.41 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2juf h GLU 35 Cb 1.25 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 2juf h GLU 35 CO 0.70 0.25 0.00 -0.85 -1.16 0.00 0.00 179.01 177.96 2juf n GLU 36 N -4.76 -0.00 -5.21 2.33 0.28 -1.26 -5.08 120.64 106.93 2juf n GLU 36 Ca 0.28 -0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.97 2juf n GLU 36 Cb 0.93 -0.50 -0.16 0.00 1.43 0.00 0.00 31.44 33.14 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 2.10 0.08 3.84 1.01 -1.17 -4.28 121.20 122.78 2juf s ILE 37 Ca 0.00 -1.16 -0.15 0.00 0.00 0.00 0.00 60.65 59.34 2juf s ILE 37 Cb 0.00 -1.74 -0.06 0.00 0.01 0.00 0.00 42.46 40.66 2juf s ILE 37 CO 0.00 0.53 0.49 -0.94 0.00 0.00 0.00 174.94 175.03 2juf s SER 38 N -0.76 6.86 -0.05 3.58 1.04 -1.26 -1.16 113.70 121.94 2juf s SER 38 Ca 0.10 1.05 -0.29 0.00 0.48 0.00 0.00 55.95 57.29 2juf s SER 38 Cb -0.10 -2.28 -0.07 0.00 0.10 0.00 0.00 66.02 63.67 2juf s SER 38 CO -0.00 0.22 1.98 0.00 0.98 0.00 0.00 173.24 176.41 2juf s ALA 39 N -1.26 3.37 0.00 5.32 0.00 -1.26 -1.63 121.76 126.30 2juf s ALA 39 Ca 0.31 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.38 2juf s ALA 39 Cb -0.16 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.06 2juf s ALA 39 CO 0.17 -1.87 0.00 0.41 0.00 0.00 0.00 175.76 174.48 2juf n GLY 40 N 4.80 0.79 3.83 0.00 0.00 -0.11 -4.96 105.19 109.54 2juf n GLY 40 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 2juf n GLY 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2juf s ASP 41 N -1.63 6.07 0.22 1.61 2.15 -0.64 -4.74 116.67 119.70 2juf s ASP 41 Ca 0.00 1.62 0.09 0.00 0.43 0.00 0.00 52.55 54.69 2juf s ASP 41 Cb 0.00 -2.51 -0.04 0.00 -0.30 0.00 0.00 42.92 40.07 2juf s ASP 41 CO 0.00 -0.97 -0.03 -1.61 -0.17 0.00 0.00 175.17 172.38 2juf s GLU 42 N -4.46 2.23 0.09 4.34 2.02 -1.26 -0.10 118.70 121.57 2juf s GLU 42 Ca 0.59 -1.32 0.00 0.00 0.02 0.00 0.00 54.97 54.27 2juf s GLU 42 Cb -0.13 -2.19 -0.00 0.00 0.10 0.00 0.00 34.13 31.91 2juf s GLU 42 CO 0.42 0.40 0.11 0.41 0.02 0.00 0.00 175.26 176.62 2juf n GLY 43 N -0.46 3.11 2.92 -1.39 0.00 -0.81 -2.35 105.19 106.22 2juf n GLY 43 Ca -0.08 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.29 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 -2.25 0.22 -0.09 1.61 2.56 -0.91 -2.20 118.70 117.64 2juf s GLU 44 Ca 0.08 -0.16 -0.30 0.00 0.00 0.00 0.00 54.97 54.60 2juf s GLU 44 Cb -0.00 -0.17 -0.04 0.00 2.00 0.00 0.00 34.13 35.92 2juf s GLU 44 CO 0.06 0.04 1.48 0.12 -0.56 0.00 0.00 175.26 176.40 2juf s PHE 45 N -0.24 2.40 -0.15 5.30 5.36 -1.26 -1.44 117.98 127.95 2juf s PHE 45 Ca -0.01 0.57 -0.06 0.00 -0.96 0.00 0.00 56.93 56.47 2juf s PHE 45 Cb -0.02 -3.73 -0.07 0.00 -0.34 0.00 0.00 43.02 38.85 2juf s PHE 45 CO -0.00 -2.88 -0.18 0.54 -1.46 0.00 0.00 175.22 171.24 2juf n ARG 46 N 6.77 0.34 -3.50 10.12 5.12 -1.24 -2.78 116.66 131.49 2juf n ARG 46 Ca 0.16 0.13 -0.12 0.00 -1.93 0.00 0.00 57.85 56.09 2juf n ARG 46 Cb 0.44 -1.11 -0.04 0.00 -1.16 0.00 0.00 32.46 30.59 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 0.96 0.40 5.56 0.00 -1.24 -4.96 119.66 118.10 2juf s GLN 47 Ca -0.21 -0.14 0.05 0.00 -0.00 0.00 0.00 55.36 55.06 2juf s GLN 47 Cb 0.08 0.45 -0.02 0.00 0.00 0.00 0.00 33.01 33.51 2juf s GLN 47 CO 0.29 -0.38 0.17 -1.54 0.00 0.00 0.00 175.29 173.83 2juf s SER 48 N -2.01 2.63 -0.02 12.60 1.04 -1.26 -2.84 113.70 123.85 2juf s SER 48 Ca -0.01 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 54.70 2juf s SER 48 Cb -0.01 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.70 2juf s SER 48 CO -0.04 -0.99 0.02 0.20 0.98 0.00 0.00 173.24 173.41 2juf s ASN 49 N -3.57 0.13 0.01 7.02 0.01 -1.26 -4.96 114.94 112.31 2juf s ASN 49 Ca 0.26 0.02 0.09 0.00 -0.71 0.00 0.00 52.86 52.51 2juf s ASN 49 Cb 0.02 -0.08 -0.23 0.00 0.41 0.00 0.00 41.25 41.37 2juf s ASN 49 CO 0.17 -0.09 0.86 0.78 -1.51 0.00 0.00 177.10 177.32 2juf h ASN 50 N 6.97 0.05 0.54 -1.22 2.35 -1.96 -3.36 115.58 118.95 2juf h ASN 50 Ca -0.40 -0.09 -0.28 0.00 -0.55 0.00 0.00 56.30 54.98 2juf h ASN 50 Cb 1.15 -0.02 0.01 0.00 0.05 0.00 0.00 38.32 39.51 2juf h ASN 50 CO 0.49 1.08 -1.26 1.23 -1.65 0.00 0.00 177.43 177.31 2juf h GLY 51 N 3.08 0.39 -7.32 2.83 0.00 -2.01 -3.41 103.07 96.62 2juf h GLY 51 Ca -0.20 -0.95 -0.72 0.00 0.00 0.00 0.00 47.33 45.45 2juf h GLY 51 CO 0.10 0.83 -0.40 -0.42 0.00 0.00 0.00 176.54 176.65 2juf s ILE 52 N -2.70 4.22 0.51 2.60 -1.09 -1.26 -5.03 121.20 118.45 2juf s ILE 52 Ca -0.05 -1.71 0.21 0.00 -2.23 0.00 0.00 60.65 56.87 2juf s ILE 52 Cb 0.07 -3.74 0.35 0.00 -1.58 0.00 0.00 42.46 37.56 2juf s ILE 52 CO 0.90 -0.72 2.03 1.55 -1.23 0.00 0.00 174.94 177.46 2juf h PRO 53 N 8.45 0.07 -6.25 2.79 0.13 -1.82 -3.37 132.00 132.00 2juf h PRO 53 Ca -0.22 -0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.34 2juf h PRO 53 Cb 1.07 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2juf h PRO 53 CO 0.84 0.05 1.25 -1.25 -0.23 0.00 0.00 178.00 178.66 2juf s PRO 54 N -5.09 3.50 0.24 1.56 0.04 -1.26 -3.95 135.00 130.04 2juf s PRO 54 Ca -0.05 1.62 -0.27 0.00 0.04 0.00 0.00 61.00 62.34 2juf s PRO 54 Cb 0.19 -4.16 -0.09 0.00 0.04 0.00 0.00 34.50 30.48 2juf s PRO 54 CO 0.72 -1.65 0.88 0.54 0.04 0.00 0.00 177.00 177.53 2juf s VAL 55 N 6.36 4.22 -0.15 -0.36 0.11 0.53 -4.58 120.40 126.54 2juf s VAL 55 Ca 0.80 1.86 -0.20 0.00 -2.93 0.00 0.00 61.98 61.51 2juf s VAL 55 Cb -0.25 -4.16 -0.03 0.00 -1.53 0.00 0.00 36.38 30.40 2juf s VAL 55 CO 0.33 0.39 0.57 -1.10 -3.33 0.00 0.00 175.10 171.96 2juf s GLN 56 N -1.45 4.29 -0.01 1.54 1.11 -1.13 -1.23 119.66 122.77 2juf s GLN 56 Ca 0.42 0.56 0.01 0.00 0.01 0.00 0.00 55.36 56.36 2juf s GLN 56 Cb -0.23 -3.51 0.01 0.00 -1.01 0.00 0.00 33.01 28.27 2juf s GLN 56 CO 0.28 -0.04 -0.01 0.14 0.01 0.00 0.00 175.29 175.66 2juf s VAL 57 N 1.24 0.16 -0.58 1.09 -7.23 -0.99 -3.63 120.40 110.47 2juf s VAL 57 Ca 0.28 -0.04 -0.27 0.00 -1.81 0.00 0.00 61.98 60.14 2juf s VAL 57 Cb -0.16 -0.18 0.03 0.00 0.56 0.00 0.00 36.38 36.64 2juf s VAL 57 CO 0.11 0.07 1.12 0.12 -0.31 0.00 0.00 175.10 176.21 2juf s PHE 58 N 0.23 2.65 -0.09 2.82 5.36 -0.52 -1.59 117.98 126.85 2juf s PHE 58 Ca -0.02 0.26 -0.17 0.00 -0.96 0.00 0.00 56.93 56.04 2juf s PHE 58 Cb -0.04 -4.38 -0.05 0.00 -0.34 0.00 0.00 43.02 38.21 2juf s PHE 58 CO -0.01 -1.53 0.44 -1.58 -1.46 0.00 0.00 175.22 171.09 2juf s TRP 59 N 4.66 3.57 0.31 10.12 0.52 -0.34 -2.13 118.94 135.65 2juf s TRP 59 Ca 0.39 0.89 0.16 0.00 0.02 0.00 0.00 56.10 57.56 2juf s TRP 59 Cb -0.09 -2.47 0.74 0.00 -1.15 0.00 0.00 33.47 30.50 2juf s TRP 59 CO 0.23 0.30 1.80 -0.56 0.02 0.00 0.00 176.95 178.73 2juf h GLN 60 N 6.18 0.00 -0.26 4.98 3.07 -1.78 0.65 115.11 127.96 2juf h GLN 60 Ca -0.44 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.28 2juf h GLN 60 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.74 2juf h GLN 60 CO 0.72 0.38 0.07 1.03 0.09 0.00 0.00 178.83 181.12 2juf h SER 61 N 0.00 0.39 0.11 0.06 0.87 -1.91 -3.23 113.55 109.84 2juf h SER 61 Ca -0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2juf h SER 61 Cb 0.75 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2juf h SER 61 CO 0.05 0.51 -1.10 1.07 -0.53 0.00 0.00 176.83 176.83 2juf n THR 62 N -4.72 0.02 -1.11 2.23 5.66 -1.23 -4.99 114.28 110.15 2juf n THR 62 Ca -0.03 -0.11 -0.04 0.00 -3.05 0.00 0.00 64.05 60.83 2juf n THR 62 Cb 0.17 0.67 -0.02 0.00 -1.55 0.00 0.00 70.33 69.61 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 1.45 0.65 3.59 1.09 0.00 0.19 -4.99 105.19 107.18 2juf n GLY 63 Ca 0.03 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.75 1.59 -0.25 1.61 1.70 -1.03 -4.92 118.95 115.90 2juf s ARG 64 Ca 0.00 -1.28 -0.23 0.00 -0.47 0.00 0.00 55.73 53.75 2juf s ARG 64 Cb 0.00 0.47 -0.01 0.00 -0.57 0.00 0.00 34.95 34.84 2juf s ARG 64 CO 0.00 -0.66 0.74 0.99 -1.08 0.00 0.00 175.30 175.29 2juf s THR 65 N -3.92 4.90 0.16 4.99 2.01 -1.26 -1.20 115.64 121.32 2juf s THR 65 Ca 0.23 1.38 0.07 0.00 0.31 0.00 0.00 61.69 63.67 2juf s THR 65 Cb -0.01 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 2juf s THR 65 CO 0.10 -0.03 -0.14 -0.47 -0.69 0.00 0.00 174.62 173.38 2juf s TYR 66 N 2.69 1.56 -0.16 4.92 5.04 -0.62 -4.82 117.35 125.96 2juf s TYR 66 Ca 0.31 -0.57 -0.29 0.00 -2.44 0.00 0.00 57.07 54.08 2juf s TYR 66 Cb -0.15 -0.77 -0.01 0.00 0.35 0.00 0.00 41.96 41.37 2juf s TYR 66 CO 0.08 0.24 1.24 -1.58 -1.34 0.00 0.00 175.55 174.18 2juf s TRP 67 N -2.54 2.93 0.03 4.97 0.51 -1.26 -2.34 118.94 121.24 2juf s TRP 67 Ca 0.15 1.07 0.02 0.00 -2.12 0.00 0.00 56.10 55.23 2juf s TRP 67 Cb -0.03 -3.48 -0.02 0.00 -0.81 0.00 0.00 33.47 29.14 2juf s TRP 67 CO 0.05 -1.56 -0.08 0.14 -0.51 0.00 0.00 176.95 174.98 2juf s VAL 68 N 3.31 0.58 0.41 4.03 -7.23 -0.37 -4.94 120.40 116.19 2juf s VAL 68 Ca 0.54 -0.93 -0.22 0.00 -1.81 0.00 0.00 61.98 59.56 2juf s VAL 68 Cb -0.22 -0.60 -0.10 0.00 0.56 0.00 0.00 36.38 36.02 2juf s VAL 68 CO 0.15 -0.26 0.97 -2.28 -0.31 0.00 0.00 175.10 173.37 2juf s HIS 69 N -1.11 3.36 0.15 2.82 2.46 -1.26 -0.34 115.29 121.37 2juf s HIS 69 Ca -0.07 1.65 -0.18 0.00 0.47 0.00 0.00 55.06 56.93 2juf s HIS 69 Cb -0.08 -2.92 0.04 0.00 -0.13 0.00 0.00 32.58 29.48 2juf s HIS 69 CO 0.00 -0.16 1.70 -1.49 -2.47 0.00 0.00 174.74 172.31 2juf h TRP 70 N 2.24 -0.10 0.00 3.88 4.06 -1.87 -1.92 115.95 122.23 2juf h TRP 70 Ca -0.48 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.49 2juf h TRP 70 Cb 1.19 0.09 0.00 0.00 -1.00 0.00 0.00 29.16 29.44 2juf h TRP 70 CO 0.61 -0.10 0.00 1.58 -3.56 0.00 0.00 178.44 176.97 2juf n HIS 71 N -5.22 0.58 -0.53 0.49 -0.00 -1.26 -2.09 115.22 107.18 2juf n HIS 71 Ca 0.00 0.20 0.08 0.00 0.46 0.00 0.00 57.72 58.46 2juf n HIS 71 Cb 0.17 -0.82 0.26 0.00 -0.12 0.00 0.00 29.99 29.48 2juf n HIS 71 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 2juf n MET 72 N -2.00 3.17 -4.95 1.57 2.81 -0.84 -4.77 117.12 112.10 2juf n MET 72 Ca 0.04 -2.56 -0.33 0.00 -1.81 0.00 0.00 57.70 53.05 2juf n MET 72 Cb 0.30 -1.63 -0.15 0.00 -0.71 0.00 0.00 33.22 31.03 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 -1.70 2.49 -0.07 4.03 2.96 -0.78 -3.40 118.68 122.20 2juf s LEU 73 Ca 0.39 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.88 2juf s LEU 73 Cb 0.25 -1.53 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 2juf s LEU 73 CO 0.18 0.19 0.02 -0.70 -1.32 0.00 0.00 176.35 174.72 2juf s GLU 74 N 0.21 3.01 0.09 1.98 2.56 -0.54 -4.87 118.70 121.14 2juf s GLU 74 Ca -0.11 -0.41 0.08 0.00 0.00 0.00 0.00 54.97 54.54 2juf s GLU 74 Cb -0.16 -2.83 -0.04 0.00 2.00 0.00 0.00 34.13 33.11 2juf s GLU 74 CO 0.06 0.70 -0.16 0.96 -0.56 0.00 0.00 175.26 176.26 2juf s ILE 75 N -0.94 2.96 -0.18 -3.70 -4.36 -1.26 0.41 121.20 114.12 2juf s ILE 75 Ca 0.15 -1.34 0.14 0.00 -0.26 0.00 0.00 60.65 59.34 2juf s ILE 75 Cb -0.11 -2.33 0.34 0.00 1.25 0.00 0.00 42.46 41.60 2juf s ILE 75 CO 0.04 0.18 1.25 0.00 0.24 0.00 0.00 174.94 176.65 2juf n LEU 76 N 1.01 -0.24 0.00 0.37 -0.00 -0.94 -4.93 117.00 112.27 2juf n LEU 76 Ca -0.15 -2.68 0.11 0.00 -0.00 0.00 0.00 56.01 53.29 2juf n LEU 76 Cb 0.52 0.15 0.65 0.00 -0.00 0.00 0.00 43.42 44.74 2juf n LEU 76 CO 0.29 1.31 0.84 0.61 -0.00 0.00 0.00 177.39 180.43