#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 0.53 1.27 2.98 0.00 -1.86 -1.64 103.07 104.35 2juf h GLY 15 Ca 0.00 -0.43 -0.22 0.00 0.00 0.00 0.00 47.33 46.68 2juf h GLY 15 CO 0.00 0.39 -0.80 -2.09 0.00 0.00 0.00 176.54 174.04 2juf h GLU 16 N 0.43 0.71 -0.07 4.80 4.57 -2.00 -3.23 114.58 119.78 2juf h GLU 16 Ca 0.06 -0.60 0.02 0.00 -1.18 0.00 0.00 59.36 57.66 2juf h GLU 16 Cb 0.66 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.36 2juf h GLU 16 CO 0.05 1.21 -0.04 -0.92 -1.18 0.00 0.00 179.01 178.13 2juf h TYR 17 N 0.47 -0.09 -0.66 0.92 3.20 -1.92 -2.78 116.97 116.11 2juf h TYR 17 Ca -0.06 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 2juf h TYR 17 Cb 1.42 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.71 2juf h TYR 17 CO 0.08 -0.06 0.28 -0.39 -1.64 0.00 0.00 178.16 176.43 2juf h VAL 18 N -0.04 1.22 -0.85 1.81 -1.51 -1.43 -2.25 116.25 113.20 2juf h VAL 18 Ca 0.04 -0.68 0.11 0.00 -1.23 0.00 0.00 66.70 64.94 2juf h VAL 18 Cb 0.10 0.41 -0.08 0.00 -2.13 0.00 0.00 31.29 29.59 2juf h VAL 18 CO -0.10 0.28 0.49 -0.61 -1.23 0.00 0.00 177.57 176.40 2juf h GLN 19 N 0.95 0.76 0.00 5.19 -0.00 -1.51 0.12 115.11 120.63 2juf h GLN 19 Ca 0.23 -0.05 -0.22 0.00 -0.00 0.00 0.00 58.65 58.61 2juf h GLN 19 Cb 0.15 -0.17 -0.03 0.00 0.00 0.00 0.00 27.48 27.43 2juf h GLN 19 CO -0.02 0.51 -1.16 1.96 0.00 0.00 0.00 178.83 180.11 2juf h GLN 20 N 0.79 0.00 -0.02 1.69 1.08 -1.34 -3.30 115.11 114.01 2juf h GLN 20 Ca 0.42 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 2juf h GLN 20 Cb 0.43 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 2juf h GLN 20 CO -0.27 0.81 -0.21 -2.37 -0.95 0.00 0.00 178.83 175.84 2juf n THR 21 N -3.25 0.00 -2.69 -0.54 5.66 -0.95 -4.94 114.28 107.57 2juf n THR 21 Ca -0.04 -0.39 -0.43 0.00 -3.05 0.00 0.00 64.05 60.13 2juf n THR 21 Cb 0.95 1.33 -0.02 0.00 -1.55 0.00 0.00 70.33 71.04 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 -2.04 3.98 -0.10 1.09 2.01 0.40 -5.05 118.68 118.97 2juf s LEU 22 Ca 0.20 1.04 -0.05 0.00 0.01 0.00 0.00 54.13 55.34 2juf s LEU 22 Cb 0.17 -3.47 -0.04 0.00 0.01 0.00 0.00 46.19 42.86 2juf s LEU 22 CO 0.39 -0.80 0.09 -1.58 1.01 0.00 0.00 176.35 175.46 2juf s GLN 23 N 3.47 3.28 -0.94 1.70 0.74 -1.26 -5.01 119.66 121.64 2juf s GLN 23 Ca 0.43 -0.23 -0.25 0.00 0.05 0.00 0.00 55.36 55.36 2juf s GLN 23 Cb -0.13 -3.05 -0.08 0.00 1.10 0.00 0.00 33.01 30.85 2juf s GLN 23 CO 0.13 0.75 2.04 -1.25 -0.55 0.00 0.00 175.29 176.41 2juf s PRO 24 N -1.01 2.29 0.00 1.67 0.04 -1.26 -2.53 135.00 134.19 2juf s PRO 24 Ca 0.15 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 60.89 2juf s PRO 24 Cb -0.12 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.39 2juf s PRO 24 CO 0.04 -3.80 0.00 0.41 0.04 0.00 0.00 177.00 173.69 2juf n GLY 25 N 6.63 -0.59 3.97 0.56 0.00 0.10 -4.89 105.19 110.99 2juf n GLY 25 Ca 0.42 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 3.04 -0.14 1.61 0.23 -1.05 -4.81 119.30 118.18 2juf s MET 26 Ca 0.00 -0.78 -0.19 0.00 -1.03 0.00 0.00 55.69 53.69 2juf s MET 26 Cb 0.00 -2.68 -0.04 0.00 -1.53 0.00 0.00 34.83 30.58 2juf s MET 26 CO 0.00 -0.15 0.50 0.50 -2.03 0.00 0.00 175.02 173.84 2juf s ARG 27 N -4.39 4.31 0.42 3.16 6.06 -1.26 -1.20 118.95 126.05 2juf s ARG 27 Ca 0.48 0.46 0.07 0.00 -2.50 0.00 0.00 55.73 54.24 2juf s ARG 27 Cb -0.10 -3.47 -0.06 0.00 0.06 0.00 0.00 34.95 31.39 2juf s ARG 27 CO 0.35 0.07 0.12 0.14 -2.50 0.00 0.00 175.30 173.47 2juf s VAL 28 N 0.90 2.09 -0.18 7.11 -7.23 -0.36 -2.40 120.40 120.33 2juf s VAL 28 Ca 0.26 -1.81 -0.10 0.00 -1.81 0.00 0.00 61.98 58.51 2juf s VAL 28 Cb -0.15 -2.90 0.06 0.00 0.56 0.00 0.00 36.38 33.94 2juf s VAL 28 CO 0.10 0.00 0.44 -0.60 -0.31 0.00 0.00 175.10 174.73 2juf s ARG 29 N -3.85 0.43 -0.13 4.82 3.00 0.18 -1.78 118.95 121.63 2juf s ARG 29 Ca 0.36 0.81 -0.21 0.00 -1.00 0.00 0.00 55.73 55.68 2juf s ARG 29 Cb 0.06 0.02 -0.03 0.00 0.00 0.00 0.00 34.95 34.99 2juf s ARG 29 CO 0.20 -0.15 0.63 1.41 0.00 0.00 0.00 175.30 177.39 2juf s MET 30 N 1.29 4.33 0.00 5.12 -2.45 -0.14 -0.88 119.30 126.57 2juf s MET 30 Ca -0.08 0.69 0.21 0.00 -1.25 0.00 0.00 55.69 55.25 2juf s MET 30 Cb -0.07 -3.50 0.32 0.00 1.25 0.00 0.00 34.83 32.83 2juf s MET 30 CO -0.12 -0.04 1.29 1.47 1.05 0.00 0.00 175.02 178.67 2juf n LEU 31 N 4.29 3.14 -4.40 4.11 -0.00 -1.10 -1.05 117.00 121.99 2juf n LEU 31 Ca -0.02 -1.37 -0.20 0.00 -0.00 0.00 0.00 56.01 54.41 2juf n LEU 31 Cb 0.51 -0.17 -0.10 0.00 -0.00 0.00 0.00 43.42 43.66 2juf n LEU 31 CO 0.45 0.65 -0.37 -0.62 -0.00 0.00 0.00 177.39 177.50 2juf s ASP 32 N -1.48 2.57 -0.31 1.45 2.15 -1.26 -4.90 116.67 114.89 2juf s ASP 32 Ca 0.32 -1.17 -0.16 0.00 0.43 0.00 0.00 52.55 51.98 2juf s ASP 32 Cb 0.20 -0.13 -0.02 0.00 -0.30 0.00 0.00 42.92 42.66 2juf s ASP 32 CO 0.28 -0.34 0.39 -1.81 -0.17 0.00 0.00 175.17 173.52 2juf s ASP 33 N -3.40 6.23 0.42 -0.34 1.01 -1.26 -2.87 116.67 116.46 2juf s ASP 33 Ca 0.28 0.01 0.07 0.00 0.71 0.00 0.00 52.55 53.62 2juf s ASP 33 Cb 0.03 -2.21 -0.04 0.00 1.01 0.00 0.00 42.92 41.71 2juf s ASP 33 CO 0.10 -0.30 0.26 -0.47 0.21 0.00 0.00 175.17 174.97 2juf s TYR 34 N 2.11 2.59 0.21 4.23 6.14 0.32 -4.97 117.35 127.97 2juf s TYR 34 Ca 0.14 -0.57 -0.21 0.00 0.64 0.00 0.00 57.07 57.08 2juf s TYR 34 Cb -0.16 -2.03 0.16 0.00 0.42 0.00 0.00 41.96 40.35 2juf s TYR 34 CO 0.11 0.04 1.55 0.93 0.64 0.00 0.00 175.55 178.82 2juf h GLU 35 N 1.24 -0.03 0.00 4.97 4.39 -1.97 -3.16 114.58 120.01 2juf h GLU 35 Ca -0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.28 2juf h GLU 35 Cb 1.26 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 2juf h GLU 35 CO 0.65 -0.02 0.00 -0.85 -1.16 0.00 0.00 179.01 177.63 2juf n GLU 36 N -5.43 0.17 -4.02 2.33 0.28 -1.26 -4.95 120.64 107.77 2juf n GLU 36 Ca 0.08 -0.61 -0.31 0.00 -0.16 0.00 0.00 57.16 56.15 2juf n GLU 36 Cb 0.37 -0.85 -0.15 0.00 1.43 0.00 0.00 31.44 32.25 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 -0.21 2.32 0.45 3.84 1.09 -1.20 -4.52 121.20 122.97 2juf s ILE 37 Ca 0.00 -2.22 -0.20 0.00 -1.10 0.00 0.00 60.65 57.13 2juf s ILE 37 Cb 0.00 -2.65 -0.10 0.00 -1.06 0.00 0.00 42.46 38.65 2juf s ILE 37 CO 0.00 -0.51 0.97 -0.55 -0.10 0.00 0.00 174.94 174.75 2juf s SER 38 N 0.97 6.75 -0.09 3.58 0.15 -1.26 -0.53 113.70 123.28 2juf s SER 38 Ca 0.08 1.73 -0.29 0.00 0.70 0.00 0.00 55.95 58.17 2juf s SER 38 Cb -0.19 -2.54 -0.07 0.00 -1.71 0.00 0.00 66.02 61.51 2juf s SER 38 CO -0.07 -0.49 2.05 0.00 1.20 0.00 0.00 173.24 175.92 2juf s ALA 39 N -2.19 3.20 0.00 5.45 0.00 -1.14 -2.13 121.76 124.96 2juf s ALA 39 Ca 0.63 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.63 2juf s ALA 39 Cb -0.11 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.07 2juf s ALA 39 CO 0.17 -2.11 0.00 0.41 0.00 0.00 0.00 175.76 174.23 2juf n GLY 40 N 5.05 1.39 3.80 0.00 0.00 -0.21 -4.97 105.19 110.25 2juf n GLY 40 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.22 5.72 0.26 1.61 2.15 -0.90 -4.80 116.67 119.48 2juf s ASP 41 Ca 0.00 1.87 0.10 0.00 0.43 0.00 0.00 52.55 54.95 2juf s ASP 41 Cb 0.00 -2.54 -0.04 0.00 -0.30 0.00 0.00 42.92 40.04 2juf s ASP 41 CO 0.00 -1.21 -0.06 -1.61 -0.17 0.00 0.00 175.17 172.11 2juf s GLU 42 N -3.99 2.11 0.06 4.34 2.02 -1.26 -0.96 118.70 121.02 2juf s GLU 42 Ca 0.65 -1.48 -0.01 0.00 0.02 0.00 0.00 54.97 54.14 2juf s GLU 42 Cb -0.17 -2.07 0.00 0.00 0.10 0.00 0.00 34.13 32.00 2juf s GLU 42 CO 0.36 0.37 0.10 0.41 0.02 0.00 0.00 175.26 176.51 2juf n GLY 43 N -0.71 2.64 3.01 -1.39 0.00 -0.73 -2.09 105.19 105.91 2juf n GLY 43 Ca -0.07 -1.31 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 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 -2.10 0.54 -0.17 1.61 2.12 -0.62 -1.22 118.70 118.86 2juf s GLU 44 Ca 0.04 -0.38 -0.29 0.00 0.36 0.00 0.00 54.97 54.70 2juf s GLU 44 Cb -0.00 -0.48 -0.00 0.00 0.26 0.00 0.00 34.13 33.91 2juf s GLU 44 CO 0.03 0.12 1.02 0.12 -0.54 0.00 0.00 175.26 176.02 2juf s PHE 45 N -0.47 3.42 -0.16 5.30 5.36 -0.34 -1.59 117.98 129.50 2juf s PHE 45 Ca -0.00 1.53 -0.04 0.00 -0.96 0.00 0.00 56.93 57.45 2juf s PHE 45 Cb -0.05 -3.23 -0.08 0.00 -0.34 0.00 0.00 43.02 39.32 2juf s PHE 45 CO 0.00 -0.36 -0.18 0.54 -1.46 0.00 0.00 175.22 173.76 2juf n ARG 46 N 5.69 0.36 -3.70 10.12 5.12 -1.25 0.03 116.66 133.02 2juf n ARG 46 Ca 0.10 0.12 -0.11 0.00 -1.93 0.00 0.00 57.85 56.04 2juf n ARG 46 Cb 0.47 -1.17 -0.06 0.00 -1.16 0.00 0.00 32.46 30.54 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 -2.30 0.93 0.24 5.56 0.00 -1.25 -4.79 119.66 118.06 2juf s GLN 47 Ca -0.22 -0.59 0.11 0.00 -0.00 0.00 0.00 55.36 54.66 2juf s GLN 47 Cb 0.07 0.41 -0.05 0.00 0.00 0.00 0.00 33.01 33.44 2juf s GLN 47 CO 0.31 -0.33 -0.17 -1.54 0.00 0.00 0.00 175.29 173.56 2juf s SER 48 N -2.40 3.76 -0.22 12.60 1.04 -1.26 -4.08 113.70 123.13 2juf s SER 48 Ca -0.01 -0.88 -0.07 0.00 0.48 0.00 0.00 55.95 55.47 2juf s SER 48 Cb 0.01 -0.41 0.11 0.00 0.10 0.00 0.00 66.02 65.82 2juf s SER 48 CO -0.07 0.06 0.46 0.54 0.98 0.00 0.00 173.24 175.21 2juf s ASN 49 N -3.22 -0.39 -0.02 7.02 4.22 -1.26 -5.01 114.94 116.28 2juf s ASN 49 Ca 0.27 0.99 0.21 0.00 -2.14 0.00 0.00 52.86 52.20 2juf s ASN 49 Cb -0.06 1.52 -0.29 0.00 1.28 0.00 0.00 41.25 43.69 2juf s ASN 49 CO 0.14 -0.24 0.66 0.59 -2.04 0.00 0.00 177.10 176.21 2juf n ASN 50 N 5.40 0.46 0.17 3.54 3.02 -1.26 -3.63 115.26 122.96 2juf n ASN 50 Ca -0.08 -0.44 0.12 0.00 -0.03 0.00 0.00 54.58 54.15 2juf n ASN 50 Cb 0.49 1.55 0.10 0.00 -0.61 0.00 0.00 39.78 41.32 2juf n ASN 50 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2juf h GLY 51 N 4.40 0.00 -7.53 7.41 0.00 -2.02 -3.42 103.07 101.90 2juf h GLY 51 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 2juf h GLY 51 CO 0.00 0.00 -0.57 -0.42 0.00 0.00 0.00 176.54 175.55 2juf s ILE 52 N -3.27 3.09 0.49 2.60 1.09 -1.24 -5.03 121.20 118.94 2juf s ILE 52 Ca 0.04 -2.23 0.17 0.00 -1.10 0.00 0.00 60.65 57.52 2juf s ILE 52 Cb 0.07 -3.14 0.31 0.00 -1.06 0.00 0.00 42.46 38.64 2juf s ILE 52 CO 0.72 -0.69 2.08 1.55 -0.10 0.00 0.00 174.94 178.50 2juf h PRO 53 N 7.83 0.13 -6.30 2.79 0.13 -1.83 -3.35 132.00 131.40 2juf h PRO 53 Ca -0.10 -0.01 -0.55 0.00 -0.87 0.00 0.00 66.00 64.48 2juf h PRO 53 Cb 1.03 -0.03 -0.08 0.00 0.13 0.00 0.00 31.00 32.05 2juf h PRO 53 CO 0.66 0.09 1.14 -1.25 -0.23 0.00 0.00 178.00 178.41 2juf s PRO 54 N -5.16 3.23 0.47 1.56 0.04 -1.26 -3.28 135.00 130.60 2juf s PRO 54 Ca -0.06 -0.35 -0.14 0.00 0.04 0.00 0.00 61.00 60.49 2juf s PRO 54 Cb 0.18 -4.39 -0.07 0.00 0.04 0.00 0.00 34.50 30.26 2juf s PRO 54 CO 0.70 -2.19 0.90 0.54 0.04 0.00 0.00 177.00 176.99 2juf s VAL 55 N 5.78 4.64 -0.16 -0.36 0.11 0.86 -4.29 120.40 126.97 2juf s VAL 55 Ca 0.38 0.98 -0.15 0.00 -2.93 0.00 0.00 61.98 60.26 2juf s VAL 55 Cb -0.07 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 31.01 2juf s VAL 55 CO 0.11 -0.62 0.36 -1.10 -3.33 0.00 0.00 175.10 170.52 2juf s GLN 56 N -3.97 4.25 -0.01 1.54 1.11 -1.26 -1.32 119.66 120.02 2juf s GLN 56 Ca 0.56 0.19 -0.01 0.00 0.01 0.00 0.00 55.36 56.11 2juf s GLN 56 Cb -0.10 -3.46 0.00 0.00 -1.01 0.00 0.00 33.01 28.44 2juf s GLN 56 CO 0.31 0.15 0.02 0.14 0.01 0.00 0.00 175.29 175.92 2juf s VAL 57 N 0.72 0.00 -0.55 1.09 -7.23 -1.12 -3.92 120.40 109.40 2juf s VAL 57 Ca 0.19 -0.04 -0.27 0.00 -1.81 0.00 0.00 61.98 60.05 2juf s VAL 57 Cb -0.14 -0.05 0.03 0.00 0.56 0.00 0.00 36.38 36.78 2juf s VAL 57 CO 0.06 -0.02 1.11 0.12 -0.31 0.00 0.00 175.10 176.06 2juf s PHE 58 N -0.05 2.70 -0.07 2.82 2.19 -0.62 -1.92 117.98 123.02 2juf s PHE 58 Ca -0.01 0.35 -0.21 0.00 0.33 0.00 0.00 56.93 57.40 2juf s PHE 58 Cb -0.01 -4.37 -0.04 0.00 -1.31 0.00 0.00 43.02 37.29 2juf s PHE 58 CO 0.00 -1.46 0.61 -1.58 1.83 0.00 0.00 175.22 174.62 2juf s TRP 59 N 4.58 3.58 0.27 10.12 0.52 -0.07 -1.59 118.94 136.35 2juf s TRP 59 Ca 0.40 1.12 0.19 0.00 0.02 0.00 0.00 56.10 57.84 2juf s TRP 59 Cb -0.09 -2.68 0.86 0.00 -1.15 0.00 0.00 33.47 30.41 2juf s TRP 59 CO 0.25 0.17 1.83 -0.56 0.02 0.00 0.00 176.95 178.65 2juf h GLN 60 N 6.53 0.00 -0.26 4.98 3.07 -1.74 -0.02 115.11 127.67 2juf h GLN 60 Ca -0.42 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.24 2juf h GLN 60 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.75 2juf h GLN 60 CO 0.74 0.32 -0.17 1.03 0.09 0.00 0.00 178.83 180.84 2juf h SER 61 N 0.00 0.59 0.25 0.06 0.87 -1.92 -3.33 113.55 110.07 2juf h SER 61 Ca -0.00 -0.43 -0.33 0.00 -1.23 0.00 0.00 61.79 59.79 2juf h SER 61 Cb 0.72 -0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 62.46 2juf h SER 61 CO 0.04 0.90 -2.04 1.07 -0.53 0.00 0.00 176.83 176.27 2juf n THR 62 N -4.42 1.51 -0.63 2.23 5.66 -1.22 -5.02 114.28 112.39 2juf n THR 62 Ca -0.04 -0.82 0.00 0.00 -3.05 0.00 0.00 64.05 60.14 2juf n THR 62 Cb 0.39 -0.79 0.00 0.00 -1.55 0.00 0.00 70.33 68.38 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 1.66 0.90 3.66 1.09 0.00 -0.03 -5.07 105.19 107.40 2juf n GLY 63 Ca -0.25 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.45 1.99 0.22 1.61 1.70 -1.18 -4.96 118.95 116.88 2juf s ARG 64 Ca 0.00 -1.51 -0.24 0.00 -0.47 0.00 0.00 55.73 53.51 2juf s ARG 64 Cb 0.00 0.53 -0.08 0.00 -0.57 0.00 0.00 34.95 34.83 2juf s ARG 64 CO 0.00 -0.88 0.80 0.95 -1.08 0.00 0.00 175.30 175.09 2juf s THR 65 N -2.94 4.39 0.04 4.99 -4.23 -1.26 -0.89 115.64 115.73 2juf s THR 65 Ca 0.22 1.61 -0.07 0.00 -1.18 0.00 0.00 61.69 62.27 2juf s THR 65 Cb -0.03 -4.03 -0.00 0.00 1.34 0.00 0.00 72.50 69.78 2juf s THR 65 CO 0.14 0.34 0.14 -0.47 -0.54 0.00 0.00 174.62 174.23 2juf s TYR 66 N -1.37 0.14 -0.34 3.99 5.04 -0.81 -4.90 117.35 119.11 2juf s TYR 66 Ca 0.41 -0.40 -0.27 0.00 -2.44 0.00 0.00 57.07 54.36 2juf s TYR 66 Cb -0.20 -0.09 0.01 0.00 0.35 0.00 0.00 41.96 42.03 2juf s TYR 66 CO 0.24 -0.39 1.00 -1.58 -1.34 0.00 0.00 175.55 173.48 2juf s TRP 67 N -2.58 3.12 0.02 4.97 0.51 -1.26 -2.78 118.94 120.94 2juf s TRP 67 Ca -0.05 1.01 0.01 0.00 -2.12 0.00 0.00 56.10 54.95 2juf s TRP 67 Cb -0.01 -3.65 -0.01 0.00 -0.81 0.00 0.00 33.47 28.99 2juf s TRP 67 CO -0.04 -0.78 -0.04 0.14 -0.51 0.00 0.00 176.95 175.72 2juf s VAL 68 N 3.55 0.30 0.48 4.03 -7.23 -0.43 -4.84 120.40 116.25 2juf s VAL 68 Ca 0.42 -0.58 -0.22 0.00 -1.81 0.00 0.00 61.98 59.79 2juf s VAL 68 Cb -0.12 -0.34 -0.07 0.00 0.56 0.00 0.00 36.38 36.41 2juf s VAL 68 CO 0.17 -0.19 1.16 -2.28 -0.31 0.00 0.00 175.10 173.65 2juf s HIS 69 N -0.76 2.82 0.16 2.82 2.46 -1.26 -0.10 115.29 121.44 2juf s HIS 69 Ca -0.06 1.53 -0.15 0.00 0.47 0.00 0.00 55.06 56.85 2juf s HIS 69 Cb -0.06 -3.37 0.05 0.00 -0.13 0.00 0.00 32.58 29.06 2juf s HIS 69 CO -0.00 -1.56 1.81 -1.49 -2.47 0.00 0.00 174.74 171.03 2juf h TRP 70 N 1.87 0.52 0.00 3.88 4.06 -1.87 -1.78 115.95 122.63 2juf h TRP 70 Ca -0.50 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.45 2juf h TRP 70 Cb 1.25 -0.17 -0.00 0.00 -1.00 0.00 0.00 29.16 29.24 2juf h TRP 70 CO 0.53 0.32 -0.08 1.25 -3.56 0.00 0.00 178.44 176.89 2juf h HIS 71 N 0.56 0.00 0.00 0.49 2.76 -1.87 -1.37 115.15 115.72 2juf h HIS 71 Ca 0.17 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 2juf h HIS 71 Cb -0.03 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.93 2juf h HIS 71 CO -0.06 0.08 -0.71 -1.33 -1.30 0.00 0.00 177.93 174.61 2juf n MET 72 N -3.46 0.25 -3.18 5.26 2.81 -0.87 -4.77 117.12 113.16 2juf n MET 72 Ca -0.02 0.05 -0.40 0.00 -1.81 0.00 0.00 57.70 55.53 2juf n MET 72 Cb 0.23 -1.64 -0.07 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 -3.99 4.10 -0.12 4.03 0.20 -0.52 -2.73 118.68 119.65 2juf s LEU 73 Ca 0.06 0.68 0.02 0.00 0.69 0.00 0.00 54.13 55.58 2juf s LEU 73 Cb 0.14 -2.77 0.01 0.00 -0.43 0.00 0.00 46.19 43.14 2juf s LEU 73 CO 0.74 -0.27 -0.18 -0.70 -0.29 0.00 0.00 176.35 175.65 2juf s GLU 74 N 2.07 2.54 -0.29 1.98 2.12 -0.06 -4.93 118.70 122.13 2juf s GLU 74 Ca 0.25 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.79 2juf s GLU 74 Cb -0.16 -2.11 -0.04 0.00 0.26 0.00 0.00 34.13 32.09 2juf s GLU 74 CO 0.09 -0.04 0.20 0.96 -0.54 0.00 0.00 175.26 175.93 2juf s ILE 75 N 0.92 5.26 -1.39 -3.70 -4.36 -1.26 0.50 121.20 117.16 2juf s ILE 75 Ca -0.07 0.05 0.16 0.00 -0.26 0.00 0.00 60.65 60.53 2juf s ILE 75 Cb -0.15 -3.56 0.42 0.00 1.25 0.00 0.00 42.46 40.42 2juf s ILE 75 CO -0.02 0.18 1.34 0.18 0.24 0.00 0.00 174.94 176.87 2juf n LEU 76 N 5.07 3.27 -0.10 0.37 4.32 -1.25 -5.01 117.00 123.67 2juf n LEU 76 Ca -0.14 -1.92 0.16 0.00 -0.02 0.00 0.00 56.01 54.09 2juf n LEU 76 Cb 0.51 -0.31 0.86 0.00 -1.62 0.00 0.00 43.42 42.87 2juf n LEU 76 CO 0.34 0.80 1.06 0.61 -1.22 0.00 0.00 177.39 178.98