#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 0.89 2.98 0.00 -1.88 -1.64 103.07 104.17 2juf h GLY 15 Ca 0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 2juf h GLY 15 CO 0.00 0.53 0.08 -2.09 0.00 0.00 0.00 176.54 175.06 2juf h GLU 16 N 0.62 0.31 0.07 4.80 4.81 -1.99 -2.76 114.58 120.43 2juf h GLU 16 Ca 0.10 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2juf h GLU 16 Cb 0.62 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2juf h GLU 16 CO 0.04 0.37 -0.12 -0.92 -0.73 0.00 0.00 179.01 177.65 2juf h TYR 17 N 0.18 -0.31 -0.44 0.92 3.20 -1.87 -1.83 116.97 116.82 2juf h TYR 17 Ca 0.07 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 2juf h TYR 17 Cb 0.18 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2juf h TYR 17 CO -0.01 -0.18 -0.15 -0.39 -1.64 0.00 0.00 178.16 175.78 2juf h VAL 18 N -0.24 1.26 -0.61 1.81 -1.51 -1.42 -1.88 116.25 113.67 2juf h VAL 18 Ca 0.02 -1.26 0.09 0.00 -1.23 0.00 0.00 66.70 64.32 2juf h VAL 18 Cb 0.26 1.09 -0.04 0.00 -2.13 0.00 0.00 31.29 30.47 2juf h VAL 18 CO -0.07 0.43 0.41 -0.61 -1.23 0.00 0.00 177.57 176.49 2juf h GLN 19 N 0.74 0.47 0.00 5.19 -0.00 -1.13 -0.05 115.11 120.32 2juf h GLN 19 Ca 0.11 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.74 2juf h GLN 19 Cb 0.67 -0.11 0.00 0.00 0.00 0.00 0.00 27.48 28.04 2juf h GLN 19 CO 0.05 0.31 -0.00 1.96 0.00 0.00 0.00 178.83 181.15 2juf h GLN 20 N 0.48 -0.00 -0.17 1.69 1.08 -0.93 -3.37 115.11 113.89 2juf h GLN 20 Ca 0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 2juf h GLN 20 Cb 0.45 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 2juf h GLN 20 CO -0.08 0.96 0.00 -2.37 -0.95 0.00 0.00 178.83 176.39 2juf n THR 21 N -4.63 0.21 -2.23 -0.54 5.66 -0.74 -4.89 114.28 107.13 2juf n THR 21 Ca -0.10 -0.38 -0.42 0.00 -3.05 0.00 0.00 64.05 60.10 2juf n THR 21 Cb 0.46 0.46 -0.03 0.00 -1.55 0.00 0.00 70.33 69.68 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 -1.60 4.31 0.04 1.09 1.98 -0.06 -5.03 118.68 119.41 2juf s LEU 22 Ca 0.33 2.10 -0.17 0.00 -2.89 0.00 0.00 54.13 53.50 2juf s LEU 22 Cb 0.18 -3.56 -0.06 0.00 0.66 0.00 0.00 46.19 43.41 2juf s LEU 22 CO 0.27 -0.72 0.50 -1.58 -1.89 0.00 0.00 176.35 172.94 2juf s GLN 23 N 2.41 4.09 -0.99 1.98 0.74 -1.26 -5.01 119.66 121.62 2juf s GLN 23 Ca 0.64 0.60 -0.25 0.00 0.05 0.00 0.00 55.36 56.39 2juf s GLN 23 Cb -0.31 -3.24 -0.15 0.00 1.10 0.00 0.00 33.01 30.41 2juf s GLN 23 CO 0.26 0.64 2.14 -2.14 -0.55 0.00 0.00 175.29 175.65 2juf s PRO 24 N -1.03 1.75 0.00 1.67 0.02 -1.26 -2.92 135.00 133.23 2juf s PRO 24 Ca 0.27 -0.29 0.00 0.00 0.02 0.00 0.00 61.00 61.00 2juf s PRO 24 Cb -0.18 -4.99 0.00 0.00 0.02 0.00 0.00 34.50 29.35 2juf s PRO 24 CO 0.16 -4.60 0.00 0.41 -0.33 0.00 0.00 177.00 172.64 2juf n GLY 25 N 6.39 1.85 4.01 0.52 0.00 -1.12 -5.04 105.19 111.81 2juf n GLY 25 Ca 0.43 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.14 2.54 -0.10 1.61 0.23 -1.15 -4.79 119.30 117.49 2juf s MET 26 Ca 0.00 -1.48 -0.19 0.00 -1.03 0.00 0.00 55.69 52.99 2juf s MET 26 Cb 0.00 -2.67 -0.04 0.00 -1.53 0.00 0.00 34.83 30.59 2juf s MET 26 CO 0.00 -0.58 0.51 0.50 -2.03 0.00 0.00 175.02 173.42 2juf s ARG 27 N -4.50 4.34 0.45 3.16 6.06 -1.26 -1.15 118.95 126.05 2juf s ARG 27 Ca 0.58 0.52 0.05 0.00 -2.50 0.00 0.00 55.73 54.38 2juf s ARG 27 Cb -0.07 -3.43 -0.04 0.00 0.06 0.00 0.00 34.95 31.47 2juf s ARG 27 CO 0.35 0.17 0.12 0.14 -2.50 0.00 0.00 175.30 173.59 2juf s VAL 28 N 0.55 1.86 -0.07 7.11 -7.23 -0.52 -3.16 120.40 118.93 2juf s VAL 28 Ca 0.28 -1.82 -0.06 0.00 -1.81 0.00 0.00 61.98 58.57 2juf s VAL 28 Cb -0.16 -2.68 0.02 0.00 0.56 0.00 0.00 36.38 34.13 2juf s VAL 28 CO 0.12 0.00 0.19 -0.60 -0.31 0.00 0.00 175.10 174.49 2juf s ARG 29 N -3.90 0.19 -0.43 4.82 3.00 0.12 -2.12 118.95 120.63 2juf s ARG 29 Ca 0.30 0.31 -0.27 0.00 -1.00 0.00 0.00 55.73 55.07 2juf s ARG 29 Cb 0.04 0.03 0.02 0.00 0.00 0.00 0.00 34.95 35.05 2juf s ARG 29 CO 0.16 -0.07 1.01 1.41 0.00 0.00 0.00 175.30 177.82 2juf s MET 30 N 0.42 3.72 0.04 5.12 -2.45 0.24 -1.40 119.30 124.98 2juf s MET 30 Ca -0.03 0.48 -0.12 0.00 -1.25 0.00 0.00 55.69 54.77 2juf s MET 30 Cb -0.04 -3.87 -0.34 0.00 1.25 0.00 0.00 34.83 31.83 2juf s MET 30 CO -0.02 -1.19 1.02 1.25 1.05 0.00 0.00 175.02 177.13 2juf h LEU 31 N 10.64 0.72 -8.71 4.11 5.85 -1.84 -2.05 115.31 124.04 2juf h LEU 31 Ca -0.23 -0.79 -0.48 0.00 0.84 0.00 0.00 57.88 57.21 2juf h LEU 31 Cb 1.07 -0.24 -0.19 0.00 0.37 0.00 0.00 40.66 41.68 2juf h LEU 31 CO 1.05 1.62 -0.78 -0.62 -0.34 0.00 0.00 178.44 179.38 2juf s ASP 32 N -7.45 2.37 -0.15 1.25 2.15 -1.24 -4.83 116.67 108.77 2juf s ASP 32 Ca -0.08 -0.81 -0.29 0.00 0.43 0.00 0.00 52.55 51.80 2juf s ASP 32 Cb 0.05 -0.12 -0.02 0.00 -0.30 0.00 0.00 42.92 42.53 2juf s ASP 32 CO 0.93 -0.06 1.38 1.51 -0.17 0.00 0.00 175.17 178.75 2juf s ASP 33 N -2.44 6.83 0.48 -0.34 -4.77 -1.26 -4.21 116.67 110.96 2juf s ASP 33 Ca 0.11 1.79 0.08 0.00 -3.30 0.00 0.00 52.55 51.24 2juf s ASP 33 Cb -0.06 -2.54 0.03 0.00 -1.09 0.00 0.00 42.92 39.26 2juf s ASP 33 CO 0.05 -0.84 0.57 -0.31 0.70 0.00 0.00 175.17 175.34 2juf s TYR 34 N 3.77 2.24 0.21 2.11 1.51 0.65 -4.94 117.35 122.90 2juf s TYR 34 Ca 0.60 -0.56 -0.17 0.00 -1.01 0.00 0.00 57.07 55.93 2juf s TYR 34 Cb -0.24 -2.23 0.21 0.00 -0.11 0.00 0.00 41.96 39.58 2juf s TYR 34 CO 0.19 -0.58 1.60 0.93 -1.11 0.00 0.00 175.55 176.58 2juf h GLU 35 N 0.60 -0.08 0.00 -0.62 4.39 -1.98 -3.26 114.58 113.64 2juf h GLU 35 Ca -0.37 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.34 2juf h GLU 35 Cb 1.28 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2juf h GLU 35 CO 0.48 -0.05 -0.11 -0.85 -1.16 0.00 0.00 179.01 177.32 2juf n GLU 36 N -5.46 4.75 -3.93 2.33 0.28 -1.26 -5.02 120.64 112.34 2juf n GLU 36 Ca 0.07 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.72 2juf n GLU 36 Cb 0.36 -0.45 -0.09 0.00 1.43 0.00 0.00 31.44 32.70 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 -0.86 5.06 0.14 3.84 1.09 -1.23 -4.65 121.20 124.59 2juf s ILE 37 Ca 0.00 0.06 -0.07 0.00 -1.10 0.00 0.00 60.65 59.54 2juf s ILE 37 Cb 0.00 -3.27 -0.06 0.00 -1.06 0.00 0.00 42.46 38.07 2juf s ILE 37 CO 0.00 0.49 0.41 -0.44 -0.10 0.00 0.00 174.94 175.30 2juf s SER 38 N 0.06 6.55 -0.11 3.58 0.01 -1.26 -0.25 113.70 122.28 2juf s SER 38 Ca 0.07 0.69 -0.29 0.00 1.31 0.00 0.00 55.95 57.73 2juf s SER 38 Cb -0.12 -2.13 -0.06 0.00 0.21 0.00 0.00 66.02 63.92 2juf s SER 38 CO 0.00 0.07 1.95 0.00 0.41 0.00 0.00 173.24 175.66 2juf s ALA 39 N -1.61 3.24 0.00 1.44 0.00 -1.26 -1.60 121.76 121.97 2juf s ALA 39 Ca 0.40 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.29 2juf s ALA 39 Cb -0.12 -3.91 0.00 0.00 0.00 0.00 0.00 23.12 19.08 2juf s ALA 39 CO 0.22 -2.03 0.00 0.41 0.00 0.00 0.00 175.76 174.36 2juf n GLY 40 N 4.93 2.03 3.81 0.00 0.00 -0.77 -4.98 105.19 110.20 2juf n GLY 40 Ca 0.23 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 -1.81 5.88 0.14 1.61 2.15 -0.63 -4.82 116.67 119.20 2juf s ASP 41 Ca 0.00 1.76 0.07 0.00 0.43 0.00 0.00 52.55 54.81 2juf s ASP 41 Cb 0.00 -2.53 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 2juf s ASP 41 CO 0.00 -1.10 -0.17 -1.61 -0.17 0.00 0.00 175.17 172.12 2juf s GLU 42 N -4.18 1.16 0.00 4.34 2.02 -1.26 -0.59 118.70 120.19 2juf s GLU 42 Ca 0.62 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 54.30 2juf s GLU 42 Cb -0.15 -1.18 0.00 0.00 0.10 0.00 0.00 34.13 32.91 2juf s GLU 42 CO 0.38 0.24 0.00 0.41 0.02 0.00 0.00 175.26 176.31 2juf n GLY 43 N 0.49 4.13 2.98 -1.39 0.00 -0.90 -2.37 105.19 108.12 2juf n GLY 43 Ca -0.15 -1.72 -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 -1.85 0.37 -0.05 1.61 2.12 -0.91 -1.43 118.70 118.55 2juf s GLU 44 Ca 0.00 -0.38 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 2juf s GLU 44 Cb 0.00 -0.23 -0.05 0.00 0.26 0.00 0.00 34.13 34.11 2juf s GLU 44 CO 0.00 0.05 1.50 0.12 -0.54 0.00 0.00 175.26 176.39 2juf s PHE 45 N -0.66 2.44 -0.15 5.30 2.19 -0.30 -1.84 117.98 124.96 2juf s PHE 45 Ca -0.04 0.55 -0.02 0.00 0.33 0.00 0.00 56.93 57.75 2juf s PHE 45 Cb -0.05 -3.76 -0.08 0.00 -1.31 0.00 0.00 43.02 37.82 2juf s PHE 45 CO -0.00 -3.00 -0.15 0.54 1.83 0.00 0.00 175.22 174.44 2juf n ARG 46 N 6.40 0.35 -3.76 10.12 5.12 -1.24 -2.78 116.66 130.87 2juf n ARG 46 Ca 0.15 0.11 -0.01 0.00 -1.93 0.00 0.00 57.85 56.17 2juf n ARG 46 Cb 0.43 -1.20 -0.00 0.00 -1.16 0.00 0.00 32.46 30.53 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 0.89 0.39 5.56 0.00 -1.23 -4.90 119.66 118.08 2juf s GLN 47 Ca -0.20 -0.52 -0.12 0.00 -0.00 0.00 0.00 55.36 54.52 2juf s GLN 47 Cb 0.06 0.28 0.05 0.00 0.00 0.00 0.00 33.01 33.40 2juf s GLN 47 CO 0.31 -0.41 0.73 -1.54 0.00 0.00 0.00 175.29 174.37 2juf s SER 48 N -3.13 0.28 -0.10 12.60 1.04 -1.26 -3.18 113.70 119.95 2juf s SER 48 Ca 0.16 -1.29 0.02 0.00 0.48 0.00 0.00 55.95 55.32 2juf s SER 48 Cb 0.01 0.82 0.01 0.00 0.10 0.00 0.00 66.02 66.96 2juf s SER 48 CO 0.01 -1.64 -0.14 0.20 0.98 0.00 0.00 173.24 172.65 2juf s ASN 49 N -3.13 2.24 0.03 7.02 0.01 -1.26 -4.98 114.94 114.87 2juf s ASN 49 Ca 0.19 -0.38 -0.19 0.00 -0.71 0.00 0.00 52.86 51.77 2juf s ASN 49 Cb -0.04 -1.00 -0.19 0.00 0.41 0.00 0.00 41.25 40.43 2juf s ASN 49 CO 0.14 0.02 1.20 0.78 -1.51 0.00 0.00 177.10 177.73 2juf h ASN 50 N 7.32 0.52 0.75 -1.22 -0.26 -1.98 -3.33 115.58 117.38 2juf h ASN 50 Ca -0.30 -0.65 -0.21 0.00 -0.56 0.00 0.00 56.30 54.58 2juf h ASN 50 Cb 1.18 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 38.25 2juf h ASN 50 CO 0.48 1.09 -1.37 1.23 -1.06 0.00 0.00 177.43 177.80 2juf h GLY 51 N -0.01 0.00 -7.81 2.83 0.00 -2.01 -3.45 103.07 92.62 2juf h GLY 51 Ca -0.03 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.65 2juf h GLY 51 CO 0.09 0.00 -0.52 -0.42 0.00 0.00 0.00 176.54 175.69 2juf s ILE 52 N -2.80 5.22 0.49 2.60 -1.09 -1.25 -5.03 121.20 119.32 2juf s ILE 52 Ca -0.02 0.03 0.14 0.00 -2.23 0.00 0.00 60.65 58.57 2juf s ILE 52 Cb 0.08 -3.54 0.26 0.00 -1.58 0.00 0.00 42.46 37.69 2juf s ILE 52 CO 0.81 0.19 2.11 1.55 -1.23 0.00 0.00 174.94 178.37 2juf h PRO 53 N 8.39 0.13 -6.35 2.79 0.13 -1.88 -3.39 132.00 131.83 2juf h PRO 53 Ca -0.34 -0.01 -0.57 0.00 -0.87 0.00 0.00 66.00 64.20 2juf h PRO 53 Cb 1.18 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 2juf h PRO 53 CO 0.57 0.11 1.21 -1.25 -0.23 0.00 0.00 178.00 178.41 2juf s PRO 54 N -5.13 3.43 0.05 1.56 0.04 -1.26 -3.39 135.00 130.30 2juf s PRO 54 Ca -0.06 1.30 -0.19 0.00 0.04 0.00 0.00 61.00 62.09 2juf s PRO 54 Cb 0.17 -4.14 -0.06 0.00 0.04 0.00 0.00 34.50 30.51 2juf s PRO 54 CO 0.69 -1.74 0.54 0.54 0.04 0.00 0.00 177.00 177.07 2juf s VAL 55 N 6.37 4.80 -0.23 -0.36 0.11 -0.00 -4.36 120.40 126.73 2juf s VAL 55 Ca 0.74 1.15 -0.18 0.00 -2.93 0.00 0.00 61.98 60.76 2juf s VAL 55 Cb -0.20 -3.87 -0.03 0.00 -1.53 0.00 0.00 36.38 30.75 2juf s VAL 55 CO 0.33 0.55 0.52 -1.10 -3.33 0.00 0.00 175.10 172.07 2juf s GLN 56 N -1.01 4.13 -0.02 1.54 1.11 -1.19 -1.16 119.66 123.06 2juf s GLN 56 Ca 0.28 0.37 0.01 0.00 0.01 0.00 0.00 55.36 56.04 2juf s GLN 56 Cb -0.19 -3.61 0.01 0.00 -1.01 0.00 0.00 33.01 28.21 2juf s GLN 56 CO 0.18 -0.25 -0.04 0.14 0.01 0.00 0.00 175.29 175.32 2juf s VAL 57 N 1.99 0.41 -0.56 1.09 -7.23 -0.95 -3.54 120.40 111.61 2juf s VAL 57 Ca 0.23 -0.16 -0.27 0.00 -1.81 0.00 0.00 61.98 59.97 2juf s VAL 57 Cb -0.15 -0.39 0.03 0.00 0.56 0.00 0.00 36.38 36.43 2juf s VAL 57 CO 0.09 0.15 1.11 0.12 -0.31 0.00 0.00 175.10 176.26 2juf s PHE 58 N 0.27 2.68 -0.09 2.82 5.36 -0.77 -1.48 117.98 126.77 2juf s PHE 58 Ca -0.03 0.31 -0.20 0.00 -0.96 0.00 0.00 56.93 56.05 2juf s PHE 58 Cb -0.07 -4.36 -0.04 0.00 -0.34 0.00 0.00 43.02 38.21 2juf s PHE 58 CO -0.00 -1.48 0.54 -1.58 -1.46 0.00 0.00 175.22 171.23 2juf s TRP 59 N 4.60 3.55 0.18 10.12 0.52 -0.21 -2.13 118.94 135.57 2juf s TRP 59 Ca 0.39 1.01 -0.06 0.00 0.02 0.00 0.00 56.10 57.46 2juf s TRP 59 Cb -0.09 -2.61 0.09 0.00 -1.15 0.00 0.00 33.47 29.71 2juf s TRP 59 CO 0.24 0.18 1.54 -0.56 0.02 0.00 0.00 176.95 178.37 2juf h GLN 60 N 6.58 0.76 -0.27 4.98 3.07 -1.77 -0.02 115.11 128.43 2juf h GLN 60 Ca -0.42 -0.39 -0.11 0.00 0.09 0.00 0.00 58.65 57.83 2juf h GLN 60 Cb 1.19 0.01 -0.00 0.00 0.08 0.00 0.00 27.48 28.75 2juf h GLN 60 CO 0.75 1.01 -0.25 1.03 0.09 0.00 0.00 178.83 181.46 2juf h SER 61 N 0.63 0.69 1.18 0.06 0.87 -1.95 -2.97 113.55 112.06 2juf h SER 61 Ca 0.05 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2juf h SER 61 Cb 0.93 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2juf h SER 61 CO 0.09 1.01 -0.53 0.00 -0.53 0.00 0.00 176.83 176.87 2juf h THR 62 N 0.38 0.00 -0.06 2.23 1.03 -1.83 -3.48 112.91 111.18 2juf h THR 62 Ca 0.05 -0.71 -0.03 0.00 -0.01 0.00 0.00 66.41 65.71 2juf h THR 62 Cb 0.81 1.40 -0.01 0.00 -1.07 0.00 0.00 68.15 69.28 2juf h THR 62 CO 0.06 0.00 -0.02 0.61 -0.01 0.00 0.00 175.52 176.16 2juf n GLY 63 N 1.25 0.50 3.51 2.99 0.00 -0.06 -5.00 105.19 108.37 2juf n GLY 63 Ca 0.03 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.80 1.39 -0.04 1.61 1.70 -0.97 -4.95 118.95 115.89 2juf s ARG 64 Ca 0.00 -1.05 -0.24 0.00 -0.47 0.00 0.00 55.73 53.96 2juf s ARG 64 Cb 0.00 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.82 2juf s ARG 64 CO 0.00 -0.57 0.74 0.99 -1.08 0.00 0.00 175.30 175.37 2juf s THR 65 N -3.94 4.98 0.03 4.99 2.01 -1.26 -1.04 115.64 121.41 2juf s THR 65 Ca 0.15 1.53 0.02 0.00 0.31 0.00 0.00 61.69 63.70 2juf s THR 65 Cb -0.00 -4.08 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 2juf s THR 65 CO 0.02 0.26 -0.06 -0.47 -0.69 0.00 0.00 174.62 173.68 2juf s TYR 66 N 0.67 0.53 -0.33 4.92 5.04 -0.55 -4.85 117.35 122.77 2juf s TYR 66 Ca 0.39 -0.46 -0.29 0.00 -2.44 0.00 0.00 57.07 54.27 2juf s TYR 66 Cb -0.18 -0.33 0.01 0.00 0.35 0.00 0.00 41.96 41.81 2juf s TYR 66 CO 0.20 -0.10 1.26 -1.58 -1.34 0.00 0.00 175.55 173.99 2juf s TRP 67 N -1.26 2.73 0.17 4.97 0.52 -1.26 -2.23 118.94 122.58 2juf s TRP 67 Ca -0.10 0.88 0.08 0.00 0.02 0.00 0.00 56.10 56.97 2juf s TRP 67 Cb -0.09 -3.98 -0.04 0.00 -1.15 0.00 0.00 33.47 28.21 2juf s TRP 67 CO -0.00 -1.56 -0.16 0.14 0.02 0.00 0.00 176.95 175.39 2juf s VAL 68 N 4.40 1.69 0.24 4.03 -7.23 -0.31 -4.91 120.40 118.31 2juf s VAL 68 Ca 0.54 -1.96 -0.18 0.00 -1.81 0.00 0.00 61.98 58.57 2juf s VAL 68 Cb -0.15 -1.83 -0.08 0.00 0.56 0.00 0.00 36.38 34.88 2juf s VAL 68 CO 0.24 -0.42 0.71 -2.28 -0.31 0.00 0.00 175.10 173.04 2juf s HIS 69 N -2.34 3.58 0.17 2.82 2.46 -1.26 -0.82 115.29 119.89 2juf s HIS 69 Ca 0.16 1.32 -0.12 0.00 0.47 0.00 0.00 55.06 56.89 2juf s HIS 69 Cb -0.04 -2.58 0.07 0.00 -0.13 0.00 0.00 32.58 29.91 2juf s HIS 69 CO 0.06 0.28 1.73 -1.49 -2.47 0.00 0.00 174.74 172.85 2juf h TRP 70 N 3.14 0.90 0.00 3.88 4.06 -1.88 -2.21 115.95 123.83 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 1.19 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 29.08 2juf h TRP 70 CO 0.63 0.71 0.00 1.58 -3.56 0.00 0.00 178.44 177.80 2juf n HIS 71 N -4.48 0.75 -0.75 0.49 -0.00 -1.26 -1.44 115.22 108.54 2juf n HIS 71 Ca 0.03 0.31 0.07 0.00 0.46 0.00 0.00 57.72 58.60 2juf n HIS 71 Cb 0.16 -1.00 0.20 0.00 -0.12 0.00 0.00 29.99 29.22 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 -2.20 2.67 -4.16 1.57 2.81 -0.88 -4.83 117.12 112.09 2juf n MET 72 Ca 0.02 -2.52 -0.34 0.00 -1.81 0.00 0.00 57.70 53.04 2juf n MET 72 Cb 0.19 -1.60 -0.15 0.00 -0.71 0.00 0.00 33.22 30.96 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 -2.28 2.62 0.03 4.03 2.96 -0.52 -2.71 118.68 122.82 2juf s LEU 73 Ca 0.33 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2juf s LEU 73 Cb 0.26 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 45.27 2juf s LEU 73 CO 0.09 0.03 0.07 -0.70 -1.32 0.00 0.00 176.35 174.51 2juf s GLU 74 N 1.18 2.96 -0.26 1.98 2.56 -0.49 -4.94 118.70 121.69 2juf s GLU 74 Ca 0.02 -0.59 -0.04 0.00 0.00 0.00 0.00 54.97 54.36 2juf s GLU 74 Cb -0.14 -2.78 0.01 0.00 2.00 0.00 0.00 34.13 33.22 2juf s GLU 74 CO -0.04 0.61 -0.01 0.96 -0.56 0.00 0.00 175.26 176.22 2juf s ILE 75 N -1.26 3.31 -0.28 -3.70 -4.36 -1.26 0.12 121.20 113.76 2juf s ILE 75 Ca 0.25 -0.82 -0.03 0.00 -0.26 0.00 0.00 60.65 59.79 2juf s ILE 75 Cb -0.12 -2.66 0.09 0.00 1.25 0.00 0.00 42.46 41.02 2juf s ILE 75 CO 0.17 0.20 0.11 -0.22 0.24 0.00 0.00 174.94 175.44 2juf s LEU 76 N 1.41 1.19 0.00 0.37 2.96 -1.19 -4.94 118.68 118.48 2juf s LEU 76 Ca 0.02 -1.32 0.00 0.00 -0.22 0.00 0.00 54.13 52.61 2juf s LEU 76 Cb -0.16 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 45.98 2juf s LEU 76 CO -0.02 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.21