#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4n s VAL 4 N 0.00 5.03 -0.37 3.34 1.01 -0.40 -4.98 120.40 124.03 3h4n s VAL 4 Ca 0.00 0.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 3h4n s VAL 4 Cb 0.00 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.12 3h4n s VAL 4 CO 0.00 0.46 0.23 -0.69 0.00 0.00 0.00 175.10 175.10 3h4n s VAL 5 N 0.32 4.87 -0.45 2.92 1.01 -1.26 -0.66 120.40 127.15 3h4n s VAL 5 Ca 0.05 -0.64 -0.20 0.00 0.00 0.00 0.00 61.98 61.19 3h4n s VAL 5 Cb -0.12 -3.64 0.03 0.00 0.00 0.00 0.00 36.38 32.65 3h4n s VAL 5 CO -0.01 -0.17 0.63 -0.76 0.00 0.00 0.00 175.10 174.79 3h4n s LEU 6 N 1.62 4.58 0.29 3.92 1.43 0.18 -4.95 118.68 125.76 3h4n s LEU 6 Ca 0.04 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.40 3h4n s LEU 6 Cb -0.18 -2.66 -0.10 0.00 0.03 0.00 0.00 46.19 43.28 3h4n s LEU 6 CO 0.08 -0.79 1.10 -1.61 0.23 0.00 0.00 176.35 175.36 3h4n s GLU 7 N 2.77 4.59 -0.16 1.70 2.02 -1.26 -1.16 118.70 127.20 3h4n s GLU 7 Ca 0.21 1.80 -0.13 0.00 0.02 0.00 0.00 54.97 56.86 3h4n s GLU 7 Cb -0.15 -3.13 0.04 0.00 0.10 0.00 0.00 34.13 30.99 3h4n s GLU 7 CO 0.18 0.17 0.41 0.00 0.02 0.00 0.00 175.26 176.03 3h4n s ALA 8 N -1.20 -1.02 0.36 5.21 0.00 -1.26 -4.92 121.76 118.93 3h4n s ALA 8 Ca 0.46 1.23 0.27 0.00 0.00 0.00 0.00 51.96 53.92 3h4n s ALA 8 Cb -0.31 -0.72 1.38 0.00 0.00 0.00 0.00 23.12 23.47 3h4n s ALA 8 CO 0.40 -0.21 2.03 1.57 0.00 0.00 0.00 175.76 179.56 3h4n h LYS 9 N 5.80 0.00 -0.23 0.00 2.10 -2.01 -1.53 116.57 120.70 3h4n h LYS 9 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 3h4n h LYS 9 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 3h4n h LYS 9 CO 0.26 0.13 0.00 0.27 -2.00 0.00 0.00 179.45 178.11 3h4n n ASN 10 N -3.56 1.79 0.00 7.07 6.94 -1.26 -4.95 115.26 121.30 3h4n n ASN 10 Ca -0.01 -1.80 0.00 0.00 -0.02 0.00 0.00 54.58 52.75 3h4n n ASN 10 Cb 0.27 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.54 3h4n n ASN 10 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h4n n GLY 11 N 1.13 3.93 3.74 4.83 0.00 -0.58 -4.56 105.19 113.67 3h4n n GLY 11 Ca 0.15 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.91 3h4n n GLY 11 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h4n s ASN 12 N 0.00 4.60 -0.14 1.61 0.01 -1.06 -3.79 114.94 116.16 3h4n s ASN 12 Ca 0.00 2.38 -0.00 0.00 -0.71 0.00 0.00 52.86 54.53 3h4n s ASN 12 Cb 0.00 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.06 3h4n s ASN 12 CO 0.00 -1.99 -0.13 -0.69 -1.51 0.00 0.00 177.10 172.78 3h4n s VAL 13 N -1.80 2.96 -0.30 1.60 1.01 -0.31 -2.01 120.40 121.55 3h4n s VAL 13 Ca 0.76 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 3h4n s VAL 13 Cb -0.30 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 3h4n s VAL 13 CO 0.41 0.52 0.20 -0.89 0.00 0.00 0.00 175.10 175.33 3h4n s THR 14 N 0.53 5.22 -0.20 3.92 2.01 -1.26 -0.64 115.64 125.21 3h4n s THR 14 Ca -0.09 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.85 3h4n s THR 14 Cb -0.16 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 3h4n s THR 14 CO 0.04 0.16 0.04 0.12 -0.69 0.00 0.00 174.62 174.29 3h4n s PHE 15 N 1.73 3.14 -0.26 4.92 5.36 0.17 -4.98 117.98 128.06 3h4n s PHE 15 Ca 0.07 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 3h4n s PHE 15 Cb -0.16 -2.11 0.04 0.00 -0.34 0.00 0.00 43.02 40.45 3h4n s PHE 15 CO 0.10 -0.08 -0.08 0.34 -1.46 0.00 0.00 175.22 174.04 3h4n s ASP 16 N 0.84 4.36 0.43 6.13 -1.08 -1.26 -1.27 116.67 124.81 3h4n s ASP 16 Ca 0.03 -1.13 0.11 0.00 -0.52 0.00 0.00 52.55 51.03 3h4n s ASP 16 Cb -0.14 -1.61 0.97 0.00 -1.46 0.00 0.00 42.92 40.68 3h4n s ASP 16 CO 0.02 -0.17 2.03 0.45 0.52 0.00 0.00 175.17 178.02 3h4n h HIS 17 N 7.91 0.44 -0.95 -5.34 3.86 -1.98 -2.60 115.15 116.50 3h4n h HIS 17 Ca -0.26 0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.04 3h4n h HIS 17 Cb 1.08 -0.15 -0.07 0.00 1.06 0.00 0.00 27.41 29.33 3h4n h HIS 17 CO 0.60 0.25 0.59 0.87 0.86 0.00 0.00 177.93 181.10 3h4n h LYS 18 N 0.45 0.99 0.00 2.45 1.57 -1.99 -1.10 116.57 118.94 3h4n h LYS 18 Ca 0.20 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3h4n h LYS 18 Cb 0.24 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3h4n h LYS 18 CO -0.05 0.66 0.00 1.63 -0.57 0.00 0.00 179.45 181.11 3h4n n LYS 19 N -4.60 0.11 -0.15 3.15 5.02 -0.98 -3.29 118.16 117.41 3h4n n LYS 19 Ca 0.16 0.29 0.05 0.00 -2.02 0.00 0.00 58.31 56.79 3h4n n LYS 19 Cb 0.25 -1.69 0.12 0.00 -0.02 0.00 0.00 35.03 33.69 3h4n n LYS 19 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3h4n n HIS 20 N -1.89 0.35 -2.51 2.13 8.25 -0.43 -4.97 115.22 116.14 3h4n n HIS 20 Ca 0.04 -0.62 -0.36 0.00 -0.26 0.00 0.00 57.72 56.51 3h4n n HIS 20 Cb 0.24 -0.10 -0.04 0.00 1.12 0.00 0.00 29.99 31.22 3h4n n HIS 20 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h4n s ALA 21 N -1.52 3.03 -0.27 -1.41 0.00 -1.11 -4.16 121.76 116.32 3h4n s ALA 21 Ca 0.20 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 52.86 3h4n s ALA 21 Cb 0.14 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.98 3h4n s ALA 21 CO 0.08 -0.29 0.23 0.41 0.00 0.00 0.00 175.76 176.20 3h4n n GLY 22 N 0.22 0.54 3.60 0.00 0.00 -1.26 -5.07 105.19 103.22 3h4n n GLY 22 Ca 0.06 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 3h4n n GLY 22 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h4n s VAL 23 N -3.07 3.34 0.20 1.61 -7.23 -1.26 -5.05 120.40 108.95 3h4n s VAL 23 Ca 0.08 -1.67 -0.32 0.00 -1.81 0.00 0.00 61.98 58.27 3h4n s VAL 23 Cb -0.04 -2.69 -0.11 0.00 0.56 0.00 0.00 36.38 34.10 3h4n s VAL 23 CO 0.15 -0.16 1.67 -0.75 -0.31 0.00 0.00 175.10 175.69 3h4n s LYS 24 N -3.02 4.15 0.00 4.82 2.20 -1.26 -0.98 119.74 125.65 3h4n s LYS 24 Ca 0.27 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.41 3h4n s LYS 24 Cb -0.08 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 3h4n s LYS 24 CO 0.17 -0.70 0.00 0.41 -0.36 0.00 0.00 175.35 174.87 3h4n n GLY 25 N 3.83 1.73 7.00 5.54 0.00 -1.26 -4.34 105.19 117.68 3h4n n GLY 25 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3h4n n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h4n n GLU 26 N -2.00 0.00 -0.17 1.61 4.07 -0.15 -1.15 120.64 122.85 3h4n n GLU 26 Ca 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 3h4n n GLU 26 Cb 0.00 0.00 0.40 0.00 -0.06 0.00 0.00 31.44 31.78 3h4n n GLU 26 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3h4n n LYS 28 N -4.49 0.51 0.22 0.00 5.02 -0.30 -1.08 118.16 118.04 3h4n n LYS 28 Ca 0.11 0.04 0.07 0.00 -2.02 0.00 0.00 58.31 56.52 3h4n n LYS 28 Cb 0.30 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.42 3h4n n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h4n h ALA 29 N 3.24 1.95 0.00 7.82 0.00 -1.12 -3.36 119.26 127.80 3h4n h ALA 29 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h4n h ALA 29 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h4n h ALA 29 CO 0.00 0.04 -0.78 0.00 0.00 0.00 0.00 179.25 178.52 3h4n s HIS 31 N -1.74 2.92 0.20 0.00 4.02 -0.24 -5.03 115.29 115.43 3h4n s HIS 31 Ca 0.00 -0.09 -0.09 0.00 1.02 0.00 0.00 55.06 55.90 3h4n s HIS 31 Cb 0.00 -1.44 0.14 0.00 -1.02 0.00 0.00 32.58 30.26 3h4n s HIS 31 CO 0.00 0.51 1.78 1.49 1.02 0.00 0.00 174.74 179.53 3h4n h GLU 32 N 2.83 1.11 -5.81 1.40 4.81 -1.88 -3.36 114.58 113.68 3h4n h GLU 32 Ca -0.47 -0.19 -0.58 0.00 -0.13 0.00 0.00 59.36 57.99 3h4n h GLU 32 Cb 1.19 -0.19 -0.14 0.00 0.63 0.00 0.00 28.75 30.25 3h4n h GLU 32 CO 0.59 0.89 -0.69 0.95 -0.73 0.00 0.00 179.01 180.03 3h4n s THR 32 N -5.60 2.06 0.60 0.32 -4.23 -1.26 -4.93 115.64 102.61 3h4n s THR 32 Ca -0.13 -2.20 0.32 0.00 -1.18 0.00 0.00 61.69 58.51 3h4n s THR 32 Cb 0.15 -2.55 0.37 0.00 1.34 0.00 0.00 72.50 71.81 3h4n s THR 32 CO 0.82 -0.25 2.27 1.05 -0.54 0.00 0.00 174.62 177.97 3h4n h GLU 33 N 2.13 0.00 0.00 3.99 4.11 -1.91 -2.55 114.58 120.35 3h4n h GLU 33 Ca -0.41 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 58.85 3h4n h GLU 33 Cb 1.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 3h4n h GLU 33 CO 0.68 0.00 -0.81 0.00 0.07 0.00 0.00 179.01 178.96 3h4n h ALA 34 N 1.98 0.59 -0.84 1.06 0.00 -1.97 -3.47 119.26 116.61 3h4n h ALA 34 Ca 0.00 -0.74 0.06 0.00 0.00 0.00 0.00 54.91 54.24 3h4n h ALA 34 Cb 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3h4n h ALA 34 CO -0.00 1.01 -0.08 0.41 0.00 0.00 0.00 179.25 180.59 3h4n n GLY 35 N 0.97 -1.91 0.00 0.00 0.00 -0.96 -5.10 105.19 98.19 3h4n n GLY 35 Ca -0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3h4n n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4n n GLY 36 N -0.92 -0.81 3.72 -0.02 0.00 -1.26 -4.95 105.19 100.95 3h4n n GLY 36 Ca 0.00 -1.50 -0.32 0.00 0.00 0.00 0.00 46.02 44.20 3h4n n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4n s LYS 37 N -1.89 1.91 -0.36 1.61 -0.14 -1.26 -5.00 119.74 114.61 3h4n s LYS 37 Ca 0.00 1.52 0.01 0.00 -1.36 0.00 0.00 55.97 56.14 3h4n s LYS 37 Cb 0.00 -1.83 0.10 0.00 -1.68 0.00 0.00 37.83 34.42 3h4n s LYS 37 CO 0.00 -1.96 0.11 0.42 -0.76 0.00 0.00 175.35 173.16 3h4n s ILE 38 N -2.43 2.76 0.41 2.17 1.01 -1.26 -4.99 121.20 118.87 3h4n s ILE 38 Ca 0.68 -2.13 0.11 0.00 0.00 0.00 0.00 60.65 59.31 3h4n s ILE 38 Cb -0.23 -2.92 0.30 0.00 0.01 0.00 0.00 42.46 39.62 3h4n s ILE 38 CO 0.51 -0.58 2.00 0.00 0.00 0.00 0.00 174.94 176.86 3h4n h ALA 39 N 7.83 1.87 0.00 9.38 0.00 -1.99 -1.82 119.26 134.53 3h4n h ALA 39 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3h4n h ALA 39 Cb 1.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3h4n h ALA 39 CO 0.60 0.03 0.00 0.41 0.00 0.00 0.00 179.25 180.28 3h4n n GLY 40 N -1.49 -0.99 3.75 0.00 0.00 -1.26 -4.93 105.19 100.27 3h4n n GLY 40 Ca 0.08 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 3h4n n GLY 40 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h4n s MET 41 N -2.00 4.11 0.00 1.61 1.75 -0.69 -4.42 119.30 119.67 3h4n s MET 41 Ca 0.42 2.59 0.00 0.00 -1.25 0.00 0.00 55.69 57.46 3h4n s MET 41 Cb 0.19 -3.02 0.00 0.00 2.84 0.00 0.00 34.83 34.84 3h4n s MET 41 CO 0.33 -0.65 0.00 0.41 -0.65 0.00 0.00 175.02 174.46 3h4n n GLY 42 N 2.21 -1.43 0.16 2.11 0.00 -1.26 -4.96 105.19 102.02 3h4n n GLY 42 Ca 0.08 -1.12 -0.06 0.00 0.00 0.00 0.00 46.02 44.93 3h4n n GLY 42 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3h4n h LYS 43 N 0.00 0.22 -0.56 1.61 3.64 -1.98 -0.59 116.57 118.91 3h4n h LYS 43 Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3h4n h LYS 43 Cb 0.00 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3h4n h LYS 43 CO 0.00 0.15 0.28 -0.44 -2.27 0.00 0.00 179.45 177.16 3h4n h ASP 44 N 0.23 0.73 0.01 4.20 3.32 -1.95 -1.07 116.42 121.88 3h4n h ASP 44 Ca 0.18 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 3h4n h ASP 44 Cb 0.19 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h4n h ASP 44 CO -0.21 0.64 -0.00 -0.25 -1.72 0.00 0.00 179.24 177.70 3h4n h TRP 45 N 0.75 -0.01 -0.32 4.55 7.01 -1.71 -2.82 115.95 123.41 3h4n h TRP 45 Ca 0.19 -0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.12 3h4n h TRP 45 Cb 0.10 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 3h4n h TRP 45 CO -0.00 0.19 -0.08 0.00 -2.79 0.00 0.00 178.44 175.75 3h4n h ALA 46 N 0.78 0.44 0.00 2.65 0.00 -0.95 0.46 119.26 122.64 3h4n h ALA 46 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3h4n h ALA 46 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h4n h ALA 46 CO 0.00 0.27 0.00 0.72 0.00 0.00 0.00 179.25 180.24 3h4n n HIS 47 N -4.45 0.66 -0.04 0.00 8.25 -0.42 -1.44 115.22 117.78 3h4n n HIS 47 Ca -0.03 0.23 -0.02 0.00 -0.26 0.00 0.00 57.72 57.64 3h4n n HIS 47 Cb 0.33 -0.87 -0.01 0.00 1.12 0.00 0.00 29.99 30.56 3h4n n HIS 47 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3h4n h LYS 48 N 0.00 0.00 0.14 -0.41 3.64 -1.30 -3.41 116.57 115.23 3h4n h LYS 48 Ca 0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 3h4n h LYS 48 Cb 0.49 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.33 3h4n h LYS 48 CO 0.00 0.00 -0.82 1.15 -2.27 0.00 0.00 179.45 177.51 3h4n h THR 49 N -0.62 1.51 0.61 1.00 2.02 -0.93 -1.73 112.91 114.77 3h4n h THR 49 Ca 0.00 -2.54 -0.03 0.00 0.77 0.00 0.00 66.41 64.61 3h4n h THR 49 Cb 0.28 3.21 0.01 0.00 -1.74 0.00 0.00 68.15 69.90 3h4n h THR 49 CO 0.00 0.72 -0.29 0.00 0.37 0.00 0.00 175.52 176.32 3h4n h THR 52 N -1.17 1.22 -0.35 0.00 2.02 -1.65 -2.65 112.91 110.34 3h4n h THR 52 Ca -0.08 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.46 3h4n h THR 52 Cb 0.66 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 3h4n h THR 52 CO 0.14 0.27 0.14 1.23 0.37 0.00 0.00 175.52 177.67 3h4n h GLY 53 N 1.01 0.45 1.04 2.16 0.00 -1.34 -1.39 103.07 105.00 3h4n h GLY 53 Ca 0.22 -0.09 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 3h4n h GLY 53 CO -0.02 0.06 -0.20 0.00 0.00 0.00 0.00 176.54 176.38 3h4n h HIS 55 N 0.69 1.20 -0.45 0.00 3.86 -1.16 0.13 115.15 119.42 3h4n h HIS 55 Ca 0.09 0.03 -0.14 0.00 -1.16 0.00 0.00 60.37 59.20 3h4n h HIS 55 Cb 0.76 -0.40 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 3h4n h HIS 55 CO 0.06 0.67 -0.26 0.87 0.86 0.00 0.00 177.93 180.13 3h4n h LYS 56 N 1.22 0.96 -0.60 2.45 1.57 -1.14 -1.08 116.57 119.95 3h4n h LYS 56 Ca 0.40 -0.43 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 3h4n h LYS 56 Cb 0.04 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3h4n h LYS 56 CO -0.14 1.09 0.16 1.49 -0.57 0.00 0.00 179.45 181.49 3h4n h GLU 57 N 0.82 0.93 0.00 3.15 4.57 -0.11 -3.07 114.58 120.87 3h4n h GLU 57 Ca 0.10 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3h4n h GLU 57 Cb 0.83 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 3h4n h GLU 57 CO 0.07 0.82 -0.76 -1.33 -1.18 0.00 0.00 179.01 176.64 3h4n n MET 58 N -4.26 0.22 -2.07 1.92 2.81 -0.07 -4.95 117.12 110.71 3h4n n MET 58 Ca 0.05 0.03 -0.16 0.00 -1.81 0.00 0.00 57.70 55.81 3h4n n MET 58 Cb 0.23 -1.61 -0.02 0.00 -0.71 0.00 0.00 33.22 31.11 3h4n n MET 58 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h4n n GLY 59 N 1.39 0.22 2.89 3.03 0.00 -0.45 -5.00 105.19 107.26 3h4n n GLY 59 Ca 0.03 -0.24 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 3h4n n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4n s LYS 60 N -4.40 0.05 0.00 1.61 -0.14 -0.95 -5.05 119.74 110.87 3h4n s LYS 60 Ca 0.00 -0.09 0.00 0.00 -1.36 0.00 0.00 55.97 54.52 3h4n s LYS 60 Cb 0.00 0.01 0.00 0.00 -1.68 0.00 0.00 37.83 36.16 3h4n s LYS 60 CO 0.00 -0.01 0.00 0.41 -0.76 0.00 0.00 175.35 174.99 3h4n n GLY 61 N 2.87 0.86 3.73 -3.33 0.00 -1.26 -4.27 105.19 103.78 3h4n n GLY 61 Ca -0.14 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 3h4n n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h4n s PRO 62 N -2.36 4.33 0.00 1.61 0.04 -1.26 -4.90 135.00 132.46 3h4n s PRO 62 Ca 0.00 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.15 3h4n s PRO 62 Cb 0.00 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.33 3h4n s PRO 62 CO 0.00 -0.38 0.05 0.25 0.04 0.00 0.00 177.00 176.95 3h4n n THR 63 N 3.30 0.00 -4.05 1.26 -2.24 -1.26 -4.79 114.28 106.50 3h4n n THR 63 Ca 0.09 -0.38 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 3h4n n THR 63 Cb 0.42 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.61 3h4n n THR 63 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3h4n s LYS 64 N -0.68 2.90 0.18 -0.78 -0.14 -1.26 -5.04 119.74 114.92 3h4n s LYS 64 Ca 0.00 -0.70 -0.18 0.00 -1.36 0.00 0.00 55.97 53.73 3h4n s LYS 64 Cb 0.00 -2.73 0.12 0.00 -1.68 0.00 0.00 37.83 33.54 3h4n s LYS 64 CO 0.00 0.56 1.63 0.00 -0.76 0.00 0.00 175.35 176.78 3h4n n GLY 66 N -1.39 -1.45 0.18 0.00 0.00 -1.26 -0.81 105.19 100.46 3h4n n GLY 66 Ca 0.03 0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.10 3h4n n GLY 66 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h4n h GLU 67 N 0.00 0.00 0.00 1.61 5.08 -1.63 -3.35 114.58 116.29 3h4n h GLU 67 Ca 0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.00 3h4n h GLU 67 Cb 0.52 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.71 3h4n h GLU 67 CO 0.00 0.43 -2.06 0.00 -1.00 0.00 0.00 179.01 176.38 3h4n s HIS 69 N -2.49 3.10 0.00 0.00 3.76 0.01 -4.17 115.29 115.50 3h4n s HIS 69 Ca -0.35 0.83 0.00 0.00 -0.15 0.00 0.00 55.06 55.39 3h4n s HIS 69 Cb 0.12 -3.61 0.00 0.00 1.11 0.00 0.00 32.58 30.19 3h4n s HIS 69 CO 0.50 -0.79 0.29 1.63 -0.85 0.00 0.00 174.74 175.53