#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 0.74 0.97 2.98 0.00 -1.88 -1.33 103.07 104.55 2juf h GLY 15 Ca 0.00 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 46.52 2juf h GLY 15 CO 0.00 0.61 -0.41 0.83 0.00 0.00 0.00 176.54 177.58 2juf h GLU 16 N 0.58 0.66 -0.11 4.80 3.07 -2.00 -2.99 114.58 118.59 2juf h GLU 16 Ca 0.07 -0.42 0.00 0.00 -0.50 0.00 0.00 59.36 58.51 2juf h GLU 16 Cb 0.81 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.76 2juf h GLU 16 CO 0.07 1.04 0.07 -0.92 -1.40 0.00 0.00 179.01 177.86 2juf h TYR 17 N 0.36 0.14 -0.62 4.33 3.20 -1.94 -2.83 116.97 119.60 2juf h TYR 17 Ca 0.01 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 2juf h TYR 17 Cb 1.00 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.20 2juf h TYR 17 CO 0.09 0.10 0.16 -0.39 -1.64 0.00 0.00 178.16 176.48 2juf h VAL 18 N 0.14 1.24 -0.54 1.81 -1.51 -1.34 -2.09 116.25 113.95 2juf h VAL 18 Ca 0.04 -0.88 0.11 0.00 -1.23 0.00 0.00 66.70 64.73 2juf h VAL 18 Cb -0.00 0.59 -0.03 0.00 -2.13 0.00 0.00 31.29 29.72 2juf h VAL 18 CO -0.01 0.34 0.37 -0.61 -1.23 0.00 0.00 177.57 176.43 2juf h GLN 19 N 0.93 0.26 0.03 5.19 4.15 -1.35 0.12 115.11 124.44 2juf h GLN 19 Ca 0.20 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.60 2juf h GLN 19 Cb 0.32 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.95 2juf h GLN 19 CO -0.00 0.17 -0.01 1.96 -1.93 0.00 0.00 178.83 179.02 2juf h GLN 20 N 0.27 -0.03 -0.17 1.69 1.08 -1.19 -3.36 115.11 113.41 2juf h GLN 20 Ca 0.25 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.45 2juf h GLN 20 Cb 0.63 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 2juf h GLN 20 CO -0.05 0.68 0.00 -2.37 -0.95 0.00 0.00 178.83 176.14 2juf n THR 21 N -4.72 0.21 -2.20 -0.54 5.66 -0.85 -4.83 114.28 107.01 2juf n THR 21 Ca -0.08 -0.30 -0.43 0.00 -3.05 0.00 0.00 64.05 60.19 2juf n THR 21 Cb 0.36 0.23 -0.02 0.00 -1.55 0.00 0.00 70.33 69.34 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 -1.45 3.52 -0.04 1.09 1.98 0.39 -5.00 118.68 119.17 2juf s LEU 22 Ca 0.29 0.92 -0.22 0.00 -2.89 0.00 0.00 54.13 52.22 2juf s LEU 22 Cb 0.15 -3.42 -0.04 0.00 0.66 0.00 0.00 46.19 43.54 2juf s LEU 22 CO 0.23 -1.62 0.67 -1.58 -1.89 0.00 0.00 176.35 172.15 2juf s GLN 23 N 5.40 4.41 -0.84 1.98 0.74 -1.26 -4.98 119.66 125.10 2juf s GLN 23 Ca 0.68 0.84 -0.20 0.00 0.05 0.00 0.00 55.36 56.72 2juf s GLN 23 Cb -0.17 -3.41 -0.20 0.00 1.10 0.00 0.00 33.01 30.34 2juf s GLN 23 CO 0.32 0.18 2.23 -2.30 -0.55 0.00 0.00 175.29 175.16 2juf n PRO 24 N 3.37 0.32 0.00 1.67 -0.02 -1.26 -2.01 135.00 137.07 2juf n PRO 24 Ca -0.03 -0.66 0.00 0.00 -2.02 0.00 0.00 63.50 60.79 2juf n PRO 24 Cb 0.51 -2.80 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 2juf n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2juf n GLY 25 N 6.24 1.78 3.95 -1.23 0.00 -0.92 -5.06 105.19 109.95 2juf n GLY 25 Ca 0.50 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.09 2.52 0.25 1.61 0.23 -0.85 -4.81 119.30 118.15 2juf s MET 26 Ca 0.00 -0.45 -0.16 0.00 -1.03 0.00 0.00 55.69 54.05 2juf s MET 26 Cb 0.00 -2.35 -0.08 0.00 -1.53 0.00 0.00 34.83 30.87 2juf s MET 26 CO 0.00 -0.86 0.68 0.50 -2.03 0.00 0.00 175.02 173.31 2juf s ARG 27 N -4.95 4.08 0.21 3.16 3.52 -1.26 -1.30 118.95 122.40 2juf s ARG 27 Ca 0.57 0.68 0.04 0.00 -0.13 0.00 0.00 55.73 56.89 2juf s ARG 27 Cb -0.10 -2.70 -0.05 0.00 -1.56 0.00 0.00 34.95 30.53 2juf s ARG 27 CO 0.42 0.31 -0.03 0.08 -0.81 0.00 0.00 175.30 175.27 2juf s VAL 28 N -1.71 1.13 -0.01 7.11 1.01 -0.14 -1.05 120.40 126.75 2juf s VAL 28 Ca 0.47 -2.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.36 2juf s VAL 28 Cb -0.14 -2.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.02 2juf s VAL 28 CO 0.19 -0.43 0.08 -0.60 0.00 0.00 0.00 175.10 174.35 2juf s ARG 29 N -3.82 0.28 -0.41 2.72 3.00 0.68 -1.74 118.95 119.65 2juf s ARG 29 Ca 0.26 -0.22 -0.25 0.00 -1.00 0.00 0.00 55.73 54.52 2juf s ARG 29 Cb 0.05 0.12 0.02 0.00 0.00 0.00 0.00 34.95 35.13 2juf s ARG 29 CO 0.07 -0.06 0.90 1.41 0.00 0.00 0.00 175.30 177.62 2juf s MET 30 N -0.78 3.67 0.29 5.12 -2.45 0.85 -2.58 119.30 123.43 2juf s MET 30 Ca -0.09 0.33 0.23 0.00 -1.25 0.00 0.00 55.69 54.91 2juf s MET 30 Cb -0.05 -3.86 0.12 0.00 1.25 0.00 0.00 34.83 32.28 2juf s MET 30 CO 0.00 -1.06 1.24 1.25 1.05 0.00 0.00 175.02 177.50 2juf h LEU 31 N 10.25 0.00 -8.27 4.11 5.85 -1.85 -1.40 115.31 124.00 2juf h LEU 31 Ca -0.24 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.25 2juf h LEU 31 Cb 1.08 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 41.93 2juf h LEU 31 CO 0.99 0.00 -0.71 -0.62 -0.34 0.00 0.00 178.44 177.76 2juf s ASP 32 N -5.67 0.88 0.24 1.25 2.15 -1.20 -4.95 116.67 109.38 2juf s ASP 32 Ca 0.02 -0.78 -0.30 0.00 0.43 0.00 0.00 52.55 51.93 2juf s ASP 32 Cb 0.08 0.08 -0.09 0.00 -0.30 0.00 0.00 42.92 42.69 2juf s ASP 32 CO 0.75 -0.36 1.05 -0.62 -0.17 0.00 0.00 175.17 175.81 2juf s ASP 33 N -2.31 7.39 0.31 -0.34 2.15 -1.26 -4.07 116.67 118.55 2juf s ASP 33 Ca 0.00 2.12 0.03 0.00 0.43 0.00 0.00 52.55 55.13 2juf s ASP 33 Cb -0.02 -2.62 -0.05 0.00 -0.30 0.00 0.00 42.92 39.93 2juf s ASP 33 CO -0.03 -0.06 0.09 -0.31 -0.17 0.00 0.00 175.17 174.69 2juf s TYR 34 N -0.94 1.76 0.13 -5.34 1.51 0.22 -4.94 117.35 109.74 2juf s TYR 34 Ca 0.44 -1.11 -0.32 0.00 -1.01 0.00 0.00 57.07 55.07 2juf s TYR 34 Cb -0.29 -1.10 -0.09 0.00 -0.11 0.00 0.00 41.96 40.37 2juf s TYR 34 CO 0.37 -0.20 1.56 0.93 -1.11 0.00 0.00 175.55 177.10 2juf h GLU 35 N 2.17 -0.50 -0.00 -0.62 4.39 -1.98 -3.29 114.58 114.75 2juf h GLU 35 Ca -0.39 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.35 2juf h GLU 35 Cb 1.25 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.01 2juf h GLU 35 CO 0.63 -0.33 -0.01 -0.85 -1.16 0.00 0.00 179.01 177.29 2juf n GLU 36 N -5.43 0.03 -5.18 2.33 0.28 -1.26 -4.99 120.64 106.43 2juf n GLU 36 Ca -0.05 -0.58 -0.32 0.00 -0.16 0.00 0.00 57.16 56.06 2juf n GLU 36 Cb 0.37 -1.00 -0.15 0.00 1.43 0.00 0.00 31.44 32.09 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 -0.30 2.36 0.12 3.84 1.09 -1.24 -4.61 121.20 122.46 2juf s ILE 37 Ca 0.03 -0.99 0.04 0.00 -1.10 0.00 0.00 60.65 58.62 2juf s ILE 37 Cb 0.02 -1.86 -0.04 0.00 -1.06 0.00 0.00 42.46 39.53 2juf s ILE 37 CO 0.04 0.58 0.13 -0.44 -0.10 0.00 0.00 174.94 175.15 2juf s SER 38 N -0.63 5.64 -0.16 3.58 0.01 -1.26 -0.61 113.70 120.27 2juf s SER 38 Ca 0.10 -0.03 -0.29 0.00 1.31 0.00 0.00 55.95 57.04 2juf s SER 38 Cb -0.10 -1.53 -0.05 0.00 0.21 0.00 0.00 66.02 64.55 2juf s SER 38 CO -0.00 0.12 1.93 0.00 0.41 0.00 0.00 173.24 175.70 2juf s ALA 39 N -1.58 3.13 0.00 1.44 0.00 -1.26 -2.36 121.76 121.14 2juf s ALA 39 Ca 0.31 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.06 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 0.23 -2.19 0.00 0.41 0.00 0.00 0.00 175.76 174.21 2juf n GLY 40 N 5.07 3.15 3.75 0.00 0.00 -0.53 -5.00 105.19 111.62 2juf n GLY 40 Ca 0.23 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.10 5.12 0.16 1.61 1.01 -1.00 -4.51 116.67 118.97 2juf s ASP 41 Ca 0.00 2.66 0.04 0.00 0.71 0.00 0.00 52.55 55.95 2juf s ASP 41 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 2juf s ASP 41 CO 0.00 -1.66 0.23 -1.61 0.21 0.00 0.00 175.17 172.34 2juf s GLU 42 N -3.08 3.23 0.20 8.23 2.02 -1.26 -0.10 118.70 127.93 2juf s GLU 42 Ca 0.75 -0.72 0.04 0.00 0.02 0.00 0.00 54.97 55.06 2juf s GLU 42 Cb -0.38 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.00 2juf s GLU 42 CO 0.43 0.50 0.17 0.41 0.02 0.00 0.00 175.26 176.79 2juf n GLY 43 N -0.56 3.34 2.87 -1.39 0.00 -0.71 -2.86 105.19 105.88 2juf n GLY 43 Ca -0.08 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 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 -2.79 0.07 -0.06 1.61 2.12 -0.83 -0.96 118.70 117.87 2juf s GLU 44 Ca 0.23 -0.00 -0.30 0.00 0.36 0.00 0.00 54.97 55.26 2juf s GLU 44 Cb 0.01 -0.10 -0.04 0.00 0.26 0.00 0.00 34.13 34.25 2juf s GLU 44 CO 0.16 -0.01 1.42 0.12 -0.54 0.00 0.00 175.26 176.42 2juf s PHE 45 N 0.14 2.63 -0.16 5.30 5.36 -0.42 -1.68 117.98 129.15 2juf s PHE 45 Ca -0.01 0.71 -0.07 0.00 -0.96 0.00 0.00 56.93 56.61 2juf s PHE 45 Cb -0.02 -3.68 -0.07 0.00 -0.34 0.00 0.00 43.02 38.91 2juf s PHE 45 CO -0.00 -2.59 -0.19 0.54 -1.46 0.00 0.00 175.22 171.52 2juf n ARG 46 N 6.17 0.34 -3.53 10.12 5.12 -1.24 -2.16 116.66 131.47 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 -1.09 -0.03 0.00 -1.16 0.00 0.00 32.46 30.61 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 0.76 0.49 5.56 0.00 -1.23 -4.85 119.66 118.10 2juf s GLN 47 Ca -0.22 -0.09 0.02 0.00 -0.00 0.00 0.00 55.36 55.07 2juf s GLN 47 Cb 0.08 0.35 -0.01 0.00 0.00 0.00 0.00 33.01 33.43 2juf s GLN 47 CO 0.28 -0.29 0.04 -1.54 0.00 0.00 0.00 175.29 173.79 2juf s SER 48 N -1.86 3.78 -0.08 12.60 1.04 -1.26 -3.02 113.70 124.89 2juf s SER 48 Ca 0.01 -1.70 -0.01 0.00 0.48 0.00 0.00 55.95 54.73 2juf s SER 48 Cb -0.01 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 2juf s SER 48 CO -0.03 -0.93 -0.02 0.20 0.98 0.00 0.00 173.24 173.44 2juf s ASN 49 N -3.82 5.08 0.63 7.02 0.01 -1.26 -4.96 114.94 117.65 2juf s ASN 49 Ca 0.08 0.10 0.27 0.00 -0.71 0.00 0.00 52.86 52.60 2juf s ASN 49 Cb 0.01 -1.39 1.42 0.00 0.41 0.00 0.00 41.25 41.70 2juf s ASN 49 CO 0.05 0.37 1.82 -0.55 -1.51 0.00 0.00 177.10 177.28 2juf h ASN 50 N 5.17 0.00 0.00 -1.22 -0.00 -2.01 -3.18 115.58 114.33 2juf h ASN 50 Ca -0.50 0.00 -0.04 0.00 -0.00 0.00 0.00 56.30 55.76 2juf h ASN 50 Cb 1.19 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.47 2juf h ASN 50 CO 0.54 0.00 -0.09 0.61 -0.00 0.00 0.00 177.43 178.49 2juf n GLY 51 N -1.37 -0.17 3.29 9.14 0.00 -1.26 -5.14 105.19 109.68 2juf n GLY 51 Ca 0.03 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 2.55 0.27 -0.61 -1.09 -1.21 -5.08 121.20 116.03 2juf s ILE 52 Ca 0.00 -0.84 -0.01 0.00 -2.23 0.00 0.00 60.65 57.56 2juf s ILE 52 Cb 0.01 -2.03 0.26 0.00 -1.58 0.00 0.00 42.46 39.12 2juf s ILE 52 CO -0.00 0.54 1.84 1.55 -1.23 0.00 0.00 174.94 177.64 2juf h PRO 53 N 6.70 0.95 -5.99 2.79 0.13 -1.93 -3.40 132.00 131.24 2juf h PRO 53 Ca -0.22 -0.06 -0.51 0.00 -0.87 0.00 0.00 66.00 64.34 2juf h PRO 53 Cb 1.23 -0.21 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 2juf h PRO 53 CO 0.51 0.63 1.36 -1.25 -0.23 0.00 0.00 178.00 179.02 2juf s PRO 54 N -6.00 2.69 -0.01 1.56 0.04 -1.25 -3.75 135.00 128.28 2juf s PRO 54 Ca -0.12 0.79 -0.13 0.00 0.04 0.00 0.00 61.00 61.57 2juf s PRO 54 Cb 0.21 -4.37 -0.05 0.00 0.04 0.00 0.00 34.50 30.32 2juf s PRO 54 CO 0.80 -2.65 0.37 0.54 0.04 0.00 0.00 177.00 176.10 2juf s VAL 55 N 9.00 5.11 -0.23 -0.36 0.11 -0.14 -4.51 120.40 129.37 2juf s VAL 55 Ca 0.71 0.70 -0.17 0.00 -2.93 0.00 0.00 61.98 60.30 2juf s VAL 55 Cb -0.14 -3.66 -0.03 0.00 -1.53 0.00 0.00 36.38 31.02 2juf s VAL 55 CO 0.23 0.56 0.44 -1.10 -3.33 0.00 0.00 175.10 171.90 2juf s GLN 56 N -1.16 4.12 -0.00 1.54 1.11 -1.17 -1.63 119.66 122.48 2juf s GLN 56 Ca 0.23 0.24 0.03 0.00 0.01 0.00 0.00 55.36 55.87 2juf s GLN 56 Cb -0.16 -3.59 -0.01 0.00 -1.01 0.00 0.00 33.01 28.24 2juf s GLN 56 CO 0.12 -0.18 -0.10 0.14 0.01 0.00 0.00 175.29 175.29 2juf s VAL 57 N 1.75 0.75 -0.52 1.09 -7.23 -1.18 -3.52 120.40 111.55 2juf s VAL 57 Ca 0.20 -0.45 -0.29 0.00 -1.81 0.00 0.00 61.98 59.63 2juf s VAL 57 Cb -0.15 -0.64 0.03 0.00 0.56 0.00 0.00 36.38 36.18 2juf s VAL 57 CO 0.09 0.18 1.20 0.12 -0.31 0.00 0.00 175.10 176.38 2juf s PHE 58 N -0.29 2.66 -0.10 2.82 2.19 -0.68 -2.50 117.98 122.09 2juf s PHE 58 Ca 0.03 0.57 -0.18 0.00 0.33 0.00 0.00 56.93 57.68 2juf s PHE 58 Cb -0.04 -4.46 -0.04 0.00 -1.31 0.00 0.00 43.02 37.16 2juf s PHE 58 CO -0.00 -1.51 0.48 -1.58 1.83 0.00 0.00 175.22 174.45 2juf s TRP 59 N 4.85 3.55 0.47 10.12 0.52 -0.21 -1.95 118.94 136.29 2juf s TRP 59 Ca 0.47 0.93 0.13 0.00 0.02 0.00 0.00 56.10 57.65 2juf s TRP 59 Cb -0.08 -2.54 1.10 0.00 -1.15 0.00 0.00 33.47 30.81 2juf s TRP 59 CO 0.29 0.23 2.09 -0.56 0.02 0.00 0.00 176.95 179.02 2juf h GLN 60 N 6.44 0.24 -0.23 4.98 3.07 -1.84 -0.30 115.11 127.47 2juf h GLN 60 Ca -0.42 -0.01 -0.05 0.00 0.09 0.00 0.00 58.65 58.25 2juf h GLN 60 Cb 1.18 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 28.68 2juf h GLN 60 CO 0.74 0.16 -0.06 1.03 0.09 0.00 0.00 178.83 180.78 2juf h SER 61 N 0.25 0.46 0.22 0.06 0.87 -1.92 -3.27 113.55 110.21 2juf h SER 61 Ca 0.09 -0.37 -0.04 0.00 -1.23 0.00 0.00 61.79 60.24 2juf h SER 61 Cb 0.08 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2juf h SER 61 CO -0.02 0.72 -1.83 1.07 -0.53 0.00 0.00 176.83 176.25 2juf n THR 62 N -4.57 0.31 -0.96 2.23 5.66 -1.21 -5.00 114.28 110.73 2juf n THR 62 Ca -0.04 -0.55 0.00 0.00 -3.05 0.00 0.00 64.05 60.41 2juf n THR 62 Cb 0.30 -0.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.94 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 1.30 0.42 2.49 1.09 0.00 -0.13 -5.02 105.19 105.34 2juf n GLY 63 Ca -0.06 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 2juf n GLY 63 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2juf n ARG 64 N -2.96 0.59 -3.12 1.61 1.85 -1.19 -4.95 116.66 108.50 2juf n ARG 64 Ca 0.00 -1.89 -0.36 0.00 -1.00 0.00 0.00 57.85 54.60 2juf n ARG 64 Cb 0.00 1.95 -0.06 0.00 -1.05 0.00 0.00 32.46 33.30 2juf n ARG 64 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2juf s THR 65 N -2.61 4.59 0.03 8.89 -4.23 -1.26 -1.04 115.64 120.01 2juf s THR 65 Ca 0.18 1.26 -0.00 0.00 -1.18 0.00 0.00 61.69 61.95 2juf s THR 65 Cb -0.02 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 2juf s THR 65 CO 0.13 0.22 -0.03 -0.47 -0.54 0.00 0.00 174.62 173.93 2juf s TYR 66 N -1.50 0.38 -0.43 3.99 5.04 -1.04 -4.88 117.35 118.90 2juf s TYR 66 Ca 0.42 -0.77 -0.28 0.00 -2.44 0.00 0.00 57.07 54.00 2juf s TYR 66 Cb -0.17 -0.28 0.02 0.00 0.35 0.00 0.00 41.96 41.89 2juf s TYR 66 CO 0.21 -0.27 1.06 -1.58 -1.34 0.00 0.00 175.55 173.63 2juf s TRP 67 N -2.56 2.94 0.21 4.97 0.51 -1.26 -3.07 118.94 120.68 2juf s TRP 67 Ca -0.06 0.77 0.08 0.00 -2.12 0.00 0.00 56.10 54.77 2juf s TRP 67 Cb -0.02 -4.10 -0.05 0.00 -0.81 0.00 0.00 33.47 28.50 2juf s TRP 67 CO -0.05 -1.08 -0.15 0.14 -0.51 0.00 0.00 176.95 175.30 2juf s VAL 68 N 4.04 1.80 0.17 4.03 -7.23 -0.65 -4.90 120.40 117.67 2juf s VAL 68 Ca 0.44 -2.23 -0.12 0.00 -1.81 0.00 0.00 61.98 58.27 2juf s VAL 68 Cb -0.09 -2.06 -0.07 0.00 0.56 0.00 0.00 36.38 34.72 2juf s VAL 68 CO 0.26 -0.58 0.53 -2.28 -0.31 0.00 0.00 175.10 172.71 2juf s HIS 69 N -2.93 3.53 0.10 2.82 2.46 -1.26 -0.97 115.29 119.03 2juf s HIS 69 Ca 0.23 0.94 -0.18 0.00 0.47 0.00 0.00 55.06 56.52 2juf s HIS 69 Cb -0.01 -2.29 -0.06 0.00 -0.13 0.00 0.00 32.58 30.09 2juf s HIS 69 CO 0.07 0.38 1.58 -1.49 -2.47 0.00 0.00 174.74 172.81 2juf h TRP 70 N 3.17 0.48 0.00 3.88 4.06 -1.87 -1.52 115.95 124.14 2juf h TRP 70 Ca -0.48 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.41 2juf h TRP 70 Cb 1.18 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 29.21 2juf h TRP 70 CO 0.64 0.55 0.00 1.25 -3.56 0.00 0.00 178.44 177.32 2juf h HIS 71 N 0.28 0.00 -0.54 0.49 2.76 -1.87 -1.85 115.15 114.42 2juf h HIS 71 Ca 0.09 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 2juf h HIS 71 Cb 0.32 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.28 2juf h HIS 71 CO 0.02 0.00 0.00 -1.33 -1.30 0.00 0.00 177.93 175.32 2juf n MET 72 N -2.65 3.37 -4.23 5.26 2.81 -0.99 -4.82 117.12 115.86 2juf n MET 72 Ca 0.01 -2.70 -0.33 0.00 -1.81 0.00 0.00 57.70 52.88 2juf n MET 72 Cb 0.27 -1.73 -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 -1.75 2.20 -0.22 4.03 2.96 -0.61 -3.13 118.68 122.16 2juf s LEU 73 Ca 0.44 -0.61 -0.03 0.00 -0.22 0.00 0.00 54.13 53.70 2juf s LEU 73 Cb 0.28 -1.50 -0.00 0.00 0.50 0.00 0.00 46.19 45.47 2juf s LEU 73 CO 0.21 0.02 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.51 2juf s GLU 74 N 1.19 3.33 -0.30 1.98 2.12 -1.06 -4.91 118.70 121.04 2juf s GLU 74 Ca 0.02 -0.65 -0.23 0.00 0.36 0.00 0.00 54.97 54.47 2juf s GLU 74 Cb -0.14 -2.98 -0.00 0.00 0.26 0.00 0.00 34.13 31.28 2juf s GLU 74 CO -0.09 -0.21 0.78 0.96 -0.54 0.00 0.00 175.26 176.15 2juf s ILE 75 N 1.46 4.81 -1.16 -3.70 -4.36 -1.26 -0.23 121.20 116.75 2juf s ILE 75 Ca 0.06 1.20 0.15 0.00 -0.26 0.00 0.00 60.65 61.79 2juf s ILE 75 Cb -0.14 -4.13 0.61 0.00 1.25 0.00 0.00 42.46 40.05 2juf s ILE 75 CO -0.04 -0.22 1.49 -0.11 0.24 0.00 0.00 174.94 176.30 2juf n LEU 76 N 6.15 4.09 0.00 0.37 7.94 -1.20 -4.87 117.00 129.47 2juf n LEU 76 Ca 0.03 -2.07 0.00 0.00 -1.11 0.00 0.00 56.01 52.87 2juf n LEU 76 Cb 0.48 -0.53 0.00 0.00 0.53 0.00 0.00 43.42 43.90 2juf n LEU 76 CO 0.49 0.68 0.23 0.61 -1.11 0.00 0.00 177.39 178.30