#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rd8 n LEU 2 N 0.00 0.00 -3.59 0.99 4.77 -1.26 -2.13 117.00 115.78 1rd8 n LEU 2 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1rd8 n LEU 2 Cb 0.00 0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 1rd8 n LEU 2 CO 0.00 0.33 0.78 0.72 -1.33 0.00 0.00 177.39 177.90 1rd8 s PHE 3 N -2.33 -0.37 0.52 -1.77 -0.12 -1.26 -1.72 117.98 110.92 1rd8 s PHE 3 Ca -0.07 0.69 0.04 0.00 -0.05 0.00 0.00 56.93 57.54 1rd8 s PHE 3 Cb 0.04 0.44 0.01 0.00 -0.63 0.00 0.00 43.02 42.88 1rd8 s PHE 3 CO 0.56 -0.31 0.21 0.20 -0.05 0.00 0.00 175.22 175.83 1rd8 s GLY 4 N -0.88 2.67 -0.77 1.99 0.00 -1.26 -4.90 107.32 104.18 1rd8 s GLY 4 Ca -0.01 -0.88 -0.24 0.00 0.00 0.00 0.00 44.72 43.59 1rd8 s GLY 4 CO -0.00 -2.06 1.18 0.00 0.00 0.00 0.00 173.10 172.23 1rd8 s ALA 5 N -2.81 2.92 -0.69 3.20 0.00 -1.26 -4.94 121.76 118.18 1rd8 s ALA 5 Ca 0.21 -1.80 -0.35 0.00 0.00 0.00 0.00 51.96 50.02 1rd8 s ALA 5 Cb -0.00 -4.15 -0.19 0.00 0.00 0.00 0.00 23.12 18.78 1rd8 s ALA 5 CO 0.13 -3.14 2.24 -0.89 0.00 0.00 0.00 175.76 174.10 1rd8 n ILE 6 N 6.22 0.00 0.04 0.00 2.08 -1.26 -4.65 119.36 121.79 1rd8 n ILE 6 Ca 0.07 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.38 1rd8 n ILE 6 Cb 0.48 -0.47 0.00 0.00 -0.75 0.00 0.00 39.64 38.90 1rd8 n ILE 6 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rd8 n ALA 7 N 8.32 1.84 -1.47 -1.39 0.00 -1.26 -4.86 120.51 121.70 1rd8 n ALA 7 Ca 0.56 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 53.53 1rd8 n ALA 7 Cb -0.01 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.00 1rd8 n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rd8 n GLY 8 N 1.42 -1.24 0.27 0.00 0.00 -1.26 -4.79 105.19 99.59 1rd8 n GLY 8 Ca 0.00 0.33 0.14 0.00 0.00 0.00 0.00 46.02 46.49 1rd8 n GLY 8 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1rd8 h PHE 9 N 1.34 0.00 0.00 1.61 3.57 -2.02 -3.44 116.94 118.00 1rd8 h PHE 9 Ca -0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.18 1rd8 h PHE 9 Cb 1.41 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.15 1rd8 h PHE 9 CO 0.44 0.09 0.00 -0.89 -2.23 0.00 0.00 178.31 175.72 1rd8 n ILE 10 N -3.65 0.00 -2.04 1.41 2.08 -1.26 -5.15 119.36 110.74 1rd8 n ILE 10 Ca -0.02 0.00 -0.28 0.00 0.56 0.00 0.00 62.75 63.01 1rd8 n ILE 10 Cb 0.20 0.00 0.07 0.00 -0.75 0.00 0.00 39.64 39.16 1rd8 n ILE 10 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1rd8 s GLU 11 N 0.00 2.29 0.03 0.38 0.41 -1.26 -4.94 118.70 115.61 1rd8 s GLU 11 Ca 0.00 0.04 0.18 0.00 -0.41 0.00 0.00 54.97 54.79 1rd8 s GLU 11 Cb 0.00 -2.07 0.77 0.00 -1.78 0.00 0.00 34.13 31.06 1rd8 s GLU 11 CO 0.00 -1.30 1.58 0.41 -0.49 0.00 0.00 175.26 175.47 1rd8 n GLY 12 N -3.06 -1.14 6.27 -1.39 0.00 -1.26 -4.82 105.19 99.79 1rd8 n GLY 12 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1rd8 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rd8 n GLY 13 N 0.31 0.56 0.00 -0.02 0.00 -1.26 -4.78 105.19 100.01 1rd8 n GLY 13 Ca 0.04 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1rd8 n GLY 13 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1rd8 n TRP 14 N 0.00 0.00 -2.82 1.61 7.02 -1.26 -5.11 117.44 116.88 1rd8 n TRP 14 Ca 0.00 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.15 1rd8 n TRP 14 Cb 0.00 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.83 1rd8 n TRP 14 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1rd8 s THR 15 N -0.68 4.46 1.37 -0.99 2.01 -1.26 -4.86 115.64 115.68 1rd8 s THR 15 Ca 0.00 1.36 -0.21 0.00 0.31 0.00 0.00 61.69 63.15 1rd8 s THR 15 Cb 0.00 -3.62 0.34 0.00 0.01 0.00 0.00 72.50 69.23 1rd8 s THR 15 CO 0.00 -0.35 0.80 0.61 -0.69 0.00 0.00 174.62 174.99 1rd8 n GLY 16 N -0.72 -3.48 5.76 4.40 0.00 -1.26 -4.11 105.19 105.78 1rd8 n GLY 16 Ca 0.06 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1rd8 n GLY 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1rd8 n MET 17 N -5.06 0.00 -3.01 1.61 2.81 -1.26 -4.77 117.12 107.44 1rd8 n MET 17 Ca 0.11 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.60 1rd8 n MET 17 Cb 0.56 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 33.02 1rd8 n MET 17 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1rd8 s ILE 18 N 0.00 4.96 -0.79 2.02 1.09 -1.26 -4.95 121.20 122.27 1rd8 s ILE 18 Ca 0.00 1.54 0.02 0.00 -1.10 0.00 0.00 60.65 61.11 1rd8 s ILE 18 Cb 0.00 -4.08 0.30 0.00 -1.06 0.00 0.00 42.46 37.62 1rd8 s ILE 18 CO 0.00 0.27 1.13 -0.67 -0.10 0.00 0.00 174.94 175.57 1rd8 n ASP 19 N 3.55 5.11 0.00 3.58 2.03 -1.26 -4.60 116.55 124.96 1rd8 n ASP 19 Ca -0.01 -3.53 0.00 0.00 0.52 0.00 0.00 54.79 51.77 1rd8 n ASP 19 Cb 0.51 -0.86 0.00 0.00 -0.72 0.00 0.00 41.12 40.05 1rd8 n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rd8 n GLY 20 N 0.57 -0.55 3.53 0.27 0.00 -1.26 -5.00 105.19 102.76 1rd8 n GLY 20 Ca 0.32 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 1rd8 n GLY 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1rd8 s TRP 21 N -3.13 -0.31 -0.11 1.61 1.48 -1.26 -4.73 118.94 112.50 1rd8 s TRP 21 Ca 0.00 0.17 -0.19 0.00 -1.06 0.00 0.00 56.10 55.01 1rd8 s TRP 21 Cb 0.00 0.54 -0.04 0.00 -1.16 0.00 0.00 33.47 32.81 1rd8 s TRP 21 CO 0.00 -0.54 0.53 0.71 -4.06 0.00 0.00 176.95 173.60 1rd8 s TYR 22 N -3.07 3.53 0.00 1.66 2.02 -1.26 -4.97 117.35 115.25 1rd8 s TYR 22 Ca 0.06 0.98 0.00 0.00 -0.37 0.00 0.00 57.07 57.74 1rd8 s TYR 22 Cb -0.01 -2.62 0.00 0.00 -0.40 0.00 0.00 41.96 38.93 1rd8 s TYR 22 CO -0.08 0.14 0.00 0.41 -1.57 0.00 0.00 175.55 174.46 1rd8 n GLY 23 N 3.23 2.75 3.75 0.71 0.00 -1.26 0.91 105.19 115.28 1rd8 n GLY 23 Ca -0.06 -0.84 -0.29 0.00 0.00 0.00 0.00 46.02 44.83 1rd8 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rd8 s TYR 24 N -4.72 2.10 -0.29 1.61 1.51 0.11 -4.86 117.35 112.81 1rd8 s TYR 24 Ca 0.00 -0.81 0.00 0.00 -1.01 0.00 0.00 57.07 55.26 1rd8 s TYR 24 Cb 0.00 -1.77 0.19 0.00 -0.11 0.00 0.00 41.96 40.27 1rd8 s TYR 24 CO 0.00 0.15 0.57 -1.58 -1.11 0.00 0.00 175.55 173.58 1rd8 s HIS 25 N -2.77 -1.58 0.57 2.71 2.46 -1.26 -2.82 115.29 112.60 1rd8 s HIS 25 Ca 0.23 1.46 0.06 0.00 0.47 0.00 0.00 55.06 57.28 1rd8 s HIS 25 Cb 0.03 0.45 0.06 0.00 -0.13 0.00 0.00 32.58 32.98 1rd8 s HIS 25 CO 0.13 -0.92 0.47 -2.39 -2.47 0.00 0.00 174.74 169.56 1rd8 n HIS 26 N 5.42 -0.76 -3.38 3.88 1.44 -0.40 -4.94 115.22 116.48 1rd8 n HIS 26 Ca 0.00 -2.36 0.02 0.00 -2.01 0.00 0.00 57.72 53.37 1rd8 n HIS 26 Cb 0.52 -0.47 -0.03 0.00 0.12 0.00 0.00 29.99 30.13 1rd8 n HIS 26 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1rd8 s GLN 27 N -4.36 0.52 0.16 -1.40 -0.21 -1.26 -2.75 119.66 110.36 1rd8 s GLN 27 Ca 0.36 1.12 0.03 0.00 0.02 0.00 0.00 55.36 56.89 1rd8 s GLN 27 Cb -0.03 0.65 -0.01 0.00 1.00 0.00 0.00 33.01 34.62 1rd8 s GLN 27 CO 0.23 -0.36 0.14 0.27 -2.12 0.00 0.00 175.29 173.45 1rd8 n ASN 28 N 5.39 -0.36 -0.04 5.90 2.04 -0.24 -4.99 115.26 122.97 1rd8 n ASN 28 Ca -0.07 -2.05 -0.12 0.00 -0.44 0.00 0.00 54.58 51.90 1rd8 n ASN 28 Cb 0.51 0.84 -0.06 0.00 -2.53 0.00 0.00 39.78 38.54 1rd8 n ASN 28 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 1rd8 h GLU 29 N 0.00 -0.43 -1.05 -3.83 5.08 -2.01 -1.98 114.58 110.36 1rd8 h GLU 29 Ca -0.11 0.03 0.30 0.00 -1.00 0.00 0.00 59.36 58.58 1rd8 h GLU 29 Cb 0.58 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.89 1rd8 h GLU 29 CO 0.17 -0.29 0.77 1.96 -1.00 0.00 0.00 179.01 180.62 1rd8 h GLN 30 N -0.44 0.00 0.00 2.33 4.20 -1.97 -3.47 115.11 115.76 1rd8 h GLN 30 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1rd8 h GLN 30 Cb 0.61 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.39 1rd8 h GLN 30 CO -0.45 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.12 1rd8 n GLY 31 N -1.74 0.97 3.88 3.46 0.00 -0.75 -5.11 105.19 105.91 1rd8 n GLY 31 Ca 0.22 -1.87 -0.24 0.00 0.00 0.00 0.00 46.02 44.13 1rd8 n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rd8 s SER 32 N -4.00 5.92 0.03 1.61 1.04 -1.26 -1.07 113.70 115.96 1rd8 s SER 32 Ca 0.00 -0.03 -0.11 0.00 0.48 0.00 0.00 55.95 56.29 1rd8 s SER 32 Cb 0.00 -1.65 0.01 0.00 0.10 0.00 0.00 66.02 64.48 1rd8 s SER 32 CO 0.00 0.01 0.23 -0.83 0.98 0.00 0.00 173.24 173.63 1rd8 s GLY 33 N -3.51 -0.03 -0.09 7.32 0.00 -1.11 -4.96 107.32 104.94 1rd8 s GLY 33 Ca 0.33 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.93 1rd8 s GLY 33 CO 0.26 -0.32 -0.09 -0.19 0.00 0.00 0.00 173.10 172.77 1rd8 s TYR 34 N -2.35 1.40 -0.04 1.90 1.51 -1.26 -1.27 117.35 117.24 1rd8 s TYR 34 Ca -0.07 -0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 55.37 1rd8 s TYR 34 Cb -0.02 -1.12 0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1rd8 s TYR 34 CO -0.02 -0.40 0.09 0.00 -1.11 0.00 0.00 175.55 174.11 1rd8 s ALA 35 N 1.25 -0.12 0.21 3.71 0.00 -1.13 -5.01 121.76 120.69 1rd8 s ALA 35 Ca -0.04 0.49 -0.23 0.00 0.00 0.00 0.00 51.96 52.17 1rd8 s ALA 35 Cb -0.14 -0.34 -0.08 0.00 0.00 0.00 0.00 23.12 22.56 1rd8 s ALA 35 CO -0.03 -0.13 0.79 0.00 0.00 0.00 0.00 175.76 176.39 1rd8 s ALA 36 N 1.02 3.40 -0.51 0.00 0.00 -1.26 0.08 121.76 124.49 1rd8 s ALA 36 Ca -0.08 0.32 -0.28 0.00 0.00 0.00 0.00 51.96 51.92 1rd8 s ALA 36 Cb -0.11 -2.95 0.03 0.00 0.00 0.00 0.00 23.12 20.09 1rd8 s ALA 36 CO -0.04 0.29 1.11 0.34 0.00 0.00 0.00 175.76 177.45 1rd8 s ASP 37 N -1.41 6.53 0.04 0.00 2.15 0.26 -4.88 116.67 119.36 1rd8 s ASP 37 Ca 0.41 0.23 -0.15 0.00 0.43 0.00 0.00 52.55 53.47 1rd8 s ASP 37 Cb -0.20 -2.53 -0.07 0.00 -0.30 0.00 0.00 42.92 39.82 1rd8 s ASP 37 CO 0.24 -1.29 1.23 -0.61 -0.17 0.00 0.00 175.17 174.57 1rd8 h GLN 38 N 9.31 -0.38 -0.74 4.34 4.15 -1.92 -2.27 115.11 127.60 1rd8 h GLN 38 Ca -0.24 0.03 0.16 0.00 0.77 0.00 0.00 58.65 59.37 1rd8 h GLN 38 Cb 1.06 0.09 -0.11 0.00 0.21 0.00 0.00 27.48 28.73 1rd8 h GLN 38 CO 1.13 -0.26 0.15 -0.22 -1.93 0.00 0.00 178.83 177.70 1rd8 h LYS 39 N -0.40 0.23 0.00 1.69 3.64 -1.95 -0.29 116.57 119.49 1rd8 h LYS 39 Ca -0.02 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1rd8 h LYS 39 Cb 0.35 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1rd8 h LYS 39 CO -0.05 0.15 -0.00 0.66 -2.27 0.00 0.00 179.45 177.94 1rd8 h SER 40 N 0.24 -0.01 0.03 4.20 4.64 -1.94 -2.86 113.55 117.85 1rd8 h SER 40 Ca 0.42 -0.82 0.03 0.00 -0.47 0.00 0.00 61.79 60.94 1rd8 h SER 40 Cb 0.72 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.77 1rd8 h SER 40 CO -0.54 0.83 -0.34 0.74 -0.87 0.00 0.00 176.83 176.66 1rd8 h THR 41 N -0.86 0.27 -0.60 2.95 2.02 -1.13 -2.69 112.91 112.87 1rd8 h THR 41 Ca -0.00 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.29 1rd8 h THR 41 Cb 0.83 0.27 -0.09 0.00 -1.74 0.00 0.00 68.15 67.42 1rd8 h THR 41 CO 0.00 0.00 0.12 -0.61 0.37 0.00 0.00 175.52 175.40 1rd8 h GLN 42 N -0.52 0.24 -0.85 6.66 5.75 -1.17 -0.52 115.11 124.70 1rd8 h GLN 42 Ca 0.05 -0.01 0.15 0.00 -0.15 0.00 0.00 58.65 58.68 1rd8 h GLN 42 Cb 0.59 -0.05 -0.09 0.00 1.07 0.00 0.00 27.48 28.99 1rd8 h GLN 42 CO -0.26 0.16 0.44 -0.97 -2.65 0.00 0.00 178.83 175.55 1rd8 h ASN 43 N 0.24 0.53 -0.43 -0.69 -0.73 -1.24 -1.35 115.58 111.91 1rd8 h ASN 43 Ca 0.32 0.09 -0.09 0.00 1.87 0.00 0.00 56.30 58.49 1rd8 h ASN 43 Cb 0.48 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.06 1rd8 h ASN 43 CO -0.42 0.22 -0.09 0.00 -0.37 0.00 0.00 177.43 176.77 1rd8 h ALA 44 N 1.56 0.59 -0.58 1.57 0.00 -0.88 -1.24 119.26 120.28 1rd8 h ALA 44 Ca 0.46 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1rd8 h ALA 44 Cb 0.66 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1rd8 h ALA 44 CO -0.36 0.46 0.35 0.82 0.00 0.00 0.00 179.25 180.51 1rd8 h ILE 45 N 0.64 1.05 -0.86 0.00 2.04 -0.61 0.21 117.51 119.98 1rd8 h ILE 45 Ca 0.11 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1rd8 h ILE 45 Cb 0.62 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 1rd8 h ILE 45 CO 0.04 0.12 0.48 0.44 0.00 0.00 0.00 178.15 179.24 1rd8 h ASP 46 N 0.68 1.07 0.31 1.72 3.32 -1.13 -1.80 116.42 120.59 1rd8 h ASP 46 Ca 0.23 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 1rd8 h ASP 46 Cb 0.04 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.32 1rd8 h ASP 46 CO -0.11 0.86 -0.15 1.23 -1.72 0.00 0.00 179.24 179.35 1rd8 h GLY 47 N 1.20 -0.44 2.00 2.75 0.00 -0.45 -1.78 103.07 106.36 1rd8 h GLY 47 Ca 0.31 0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.73 1rd8 h GLY 47 CO -0.05 -0.16 -0.33 -2.22 0.00 0.00 0.00 176.54 173.79 1rd8 h ILE 48 N -0.74 1.06 -0.04 2.60 1.08 -0.62 -0.27 117.51 120.58 1rd8 h ILE 48 Ca -0.04 -1.19 -0.20 0.00 -0.39 0.00 0.00 64.86 63.04 1rd8 h ILE 48 Cb 0.50 1.67 -0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1rd8 h ILE 48 CO 0.07 0.32 -0.81 0.71 -0.69 0.00 0.00 178.15 177.74 1rd8 h THR 49 N 0.00 1.41 -0.14 -0.27 1.35 -1.29 -1.34 112.91 112.62 1rd8 h THR 49 Ca -0.00 -2.31 -0.04 0.00 -0.55 0.00 0.00 66.41 63.50 1rd8 h THR 49 Cb 0.64 2.26 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 1rd8 h THR 49 CO 0.04 0.69 -0.11 -1.13 -0.25 0.00 0.00 175.52 174.76 1rd8 h ASN 50 N 0.23 0.21 -0.01 5.36 -0.73 -0.31 0.11 115.58 120.44 1rd8 h ASN 50 Ca -0.05 -0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.02 1rd8 h ASN 50 Cb 1.42 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.96 1rd8 h ASN 50 CO 0.14 0.35 -0.25 0.50 -0.37 0.00 0.00 177.43 177.80 1rd8 h LYS 51 N 0.21 0.18 -0.52 6.67 3.64 -0.83 -1.84 116.57 124.08 1rd8 h LYS 51 Ca 0.04 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1rd8 h LYS 51 Cb 0.34 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1rd8 h LYS 51 CO 0.02 0.91 0.09 0.28 -2.27 0.00 0.00 179.45 178.48 1rd8 h VAL 52 N -0.48 1.23 -0.25 2.00 2.07 -0.94 -2.62 116.25 117.26 1rd8 h VAL 52 Ca -0.03 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1rd8 h VAL 52 Cb 0.99 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1rd8 h VAL 52 CO 0.05 0.32 0.05 0.78 0.02 0.00 0.00 177.57 178.79 1rd8 h ASN 53 N 0.78 0.40 -0.55 0.57 2.35 -0.79 -2.66 115.58 115.68 1rd8 h ASN 53 Ca 0.17 -0.25 0.08 0.00 -0.55 0.00 0.00 56.30 55.75 1rd8 h ASN 53 Cb 0.34 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.55 1rd8 h ASN 53 CO 0.01 0.54 0.20 0.28 -1.65 0.00 0.00 177.43 176.81 1rd8 h SER 54 N 0.23 0.21 -0.57 5.81 0.02 -1.07 0.54 113.55 118.72 1rd8 h SER 54 Ca 0.08 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1rd8 h SER 54 Cb 0.31 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 1rd8 h SER 54 CO 0.00 0.14 0.38 0.58 -1.14 0.00 0.00 176.83 176.79 1rd8 h VAL 55 N 0.39 1.02 0.00 2.27 2.07 -1.37 -2.42 116.25 118.21 1rd8 h VAL 55 Ca 0.27 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 1rd8 h VAL 55 Cb 0.30 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1rd8 h VAL 55 CO -0.27 0.11 -0.43 0.40 0.02 0.00 0.00 177.57 177.40 1rd8 h ILE 56 N 0.58 0.50 0.16 4.57 2.04 -0.83 -3.40 117.51 121.14 1rd8 h ILE 56 Ca 0.24 -1.48 0.02 0.00 1.00 0.00 0.00 64.86 64.64 1rd8 h ILE 56 Cb 0.21 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1rd8 h ILE 56 CO -0.07 0.17 -0.36 -0.33 0.00 0.00 0.00 178.15 177.56 1rd8 h GLU 57 N -1.00 -0.59 -0.11 2.37 4.39 0.02 -2.76 114.58 116.91 1rd8 h GLU 57 Ca -0.07 0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.70 1rd8 h GLU 57 Cb 0.61 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1rd8 h GLU 57 CO -0.04 -0.40 0.30 0.87 -1.16 0.00 0.00 179.01 178.58 1rd8 h LYS 58 N -0.62 0.00 0.00 2.33 1.79 -1.62 -2.30 116.57 116.15 1rd8 h LYS 58 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1rd8 h LYS 58 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1rd8 h LYS 58 CO -0.18 0.00 0.00 -0.12 -1.08 0.00 0.00 179.45 178.07 1rd8 n MET 59 N -3.20 0.00 -0.29 3.15 0.00 -1.04 -4.60 117.12 111.13 1rd8 n MET 59 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1rd8 n MET 59 Cb 0.38 -0.67 0.00 0.00 0.00 0.00 0.00 33.22 32.93 1rd8 n MET 59 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1rd8 n ASN 60 N -0.31 0.00 0.00 6.12 3.02 -0.87 -4.41 115.26 118.81 1rd8 n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1rd8 n ASN 60 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1rd8 n ASN 60 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1rd8 n THR 61 N -0.07 0.00 -0.43 3.41 -2.24 -1.26 -5.09 114.28 108.60 1rd8 n THR 61 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1rd8 n THR 61 Cb 0.00 -0.94 0.01 0.00 -2.10 0.00 0.00 70.33 67.30 1rd8 n THR 61 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rd8 n GLN 62 N -2.68 0.00 -4.10 -0.78 1.13 -1.26 -5.00 117.38 104.68 1rd8 n GLN 62 Ca 0.00 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.98 1rd8 n GLN 62 Cb 0.45 -0.37 -0.10 0.00 0.11 0.00 0.00 30.24 30.33 1rd8 n GLN 62 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 1rd8 s PHE 63 N -0.75 0.65 -0.23 1.08 -0.12 -1.26 -5.09 117.98 112.27 1rd8 s PHE 63 Ca 0.19 -1.11 -0.37 0.00 -0.05 0.00 0.00 56.93 55.59 1rd8 s PHE 63 Cb -0.14 -0.40 -0.13 0.00 -0.63 0.00 0.00 43.02 41.71 1rd8 s PHE 63 CO 0.27 -0.46 1.88 2.41 -0.05 0.00 0.00 175.22 179.27 1rd8 n THR 64 N -0.00 0.39 -4.00 -4.49 -1.04 -1.26 -4.88 114.28 98.99 1rd8 n THR 64 Ca -0.10 -0.11 -0.10 0.00 -2.04 0.00 0.00 64.05 61.70 1rd8 n THR 64 Cb 0.62 -1.55 -0.03 0.00 -1.82 0.00 0.00 70.33 67.55 1rd8 n THR 64 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rd8 n ALA 65 N 6.71 0.08 -2.05 2.41 0.00 -1.26 -5.19 120.51 121.21 1rd8 n ALA 65 Ca 0.28 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1rd8 n ALA 65 Cb 0.21 0.85 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1rd8 n ALA 65 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1rd8 n VAL 66 N -0.36 0.00 0.00 0.00 0.24 -1.26 -5.21 118.33 111.74 1rd8 n VAL 66 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 1rd8 n VAL 66 Cb 0.35 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 1rd8 n VAL 66 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rd8 n GLY 67 N 0.00 0.73 3.18 7.63 0.00 -1.26 -5.17 105.19 110.30 1rd8 n GLY 67 Ca 0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 1rd8 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rd8 s LYS 68 N -2.00 0.92 -0.05 1.61 3.01 -1.26 -5.16 119.74 116.81 1rd8 s LYS 68 Ca 0.00 -1.41 0.02 0.00 -1.01 0.00 0.00 55.97 53.57 1rd8 s LYS 68 Cb 0.00 -0.12 0.01 0.00 -1.01 0.00 0.00 37.83 36.71 1rd8 s LYS 68 CO 0.00 -0.10 -0.10 -1.83 0.51 0.00 0.00 175.35 173.83 1rd8 s GLU 69 N -3.90 1.39 0.36 1.68 -1.05 -1.26 -5.14 118.70 110.77 1rd8 s GLU 69 Ca 0.17 -0.32 0.04 0.00 -0.15 0.00 0.00 54.97 54.71 1rd8 s GLU 69 Cb 0.06 -1.20 -0.06 0.00 -0.44 0.00 0.00 34.13 32.50 1rd8 s GLU 69 CO -0.01 0.01 0.06 -0.06 0.95 0.00 0.00 175.26 176.21 1rd8 s PHE 70 N 0.66 2.02 0.47 4.83 0.08 -1.26 -5.13 117.98 119.65 1rd8 s PHE 70 Ca -0.12 -0.96 0.07 0.00 0.12 0.00 0.00 56.93 56.04 1rd8 s PHE 70 Cb -0.15 -1.36 0.01 0.00 -0.57 0.00 0.00 43.02 40.96 1rd8 s PHE 70 CO 0.02 0.04 0.42 0.54 -0.10 0.00 0.00 175.22 176.15 1rd8 s ASN 71 N -3.55 4.89 0.23 1.36 2.20 -1.26 -4.98 114.94 113.82 1rd8 s ASN 71 Ca 0.33 -0.94 0.11 0.00 -0.94 0.00 0.00 52.86 51.42 1rd8 s ASN 71 Cb 0.08 -0.15 0.58 0.00 -2.00 0.00 0.00 41.25 39.76 1rd8 s ASN 71 CO 0.15 -0.87 1.23 -0.46 -2.94 0.00 0.00 177.10 174.21 1rd8 n ASN 72 N -1.68 0.28 -1.00 3.54 6.94 -1.26 -0.28 115.26 121.80 1rd8 n ASN 72 Ca 0.03 0.53 0.08 0.00 -0.02 0.00 0.00 54.58 55.20 1rd8 n ASN 72 Cb 0.63 -0.52 0.24 0.00 -2.36 0.00 0.00 39.78 37.78 1rd8 n ASN 72 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1rd8 n LEU 73 N -1.88 3.69 -1.45 -4.53 4.77 -1.26 -4.56 117.00 111.79 1rd8 n LEU 73 Ca -0.01 -2.31 -0.06 0.00 -0.03 0.00 0.00 56.01 53.60 1rd8 n LEU 73 Cb 0.22 -0.41 0.10 0.00 -2.33 0.00 0.00 43.42 41.00 1rd8 n LEU 73 CO 0.05 0.77 0.22 -0.62 -1.33 0.00 0.00 177.39 176.48 1rd8 n GLU 74 N 0.59 2.16 -0.06 3.23 1.02 0.62 -4.80 120.64 123.39 1rd8 n GLU 74 Ca 0.18 -3.49 0.01 0.00 -0.02 0.00 0.00 57.16 53.85 1rd8 n GLU 74 Cb 0.65 -1.67 0.32 0.00 -0.02 0.00 0.00 31.44 30.73 1rd8 n GLU 74 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1rd8 h ARG 75 N 1.59 0.65 -0.25 3.49 9.65 -1.80 -2.30 114.38 125.40 1rd8 h ARG 75 Ca 0.09 -0.08 -0.11 0.00 -1.10 0.00 0.00 59.98 58.79 1rd8 h ARG 75 Cb 1.33 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 29.78 1rd8 h ARG 75 CO 0.31 0.52 -0.26 0.00 2.80 0.00 0.00 179.97 183.34 1rd8 h ARG 76 N 0.65 0.62 -0.65 0.20 3.08 -1.94 -2.05 114.38 114.29 1rd8 h ARG 76 Ca 0.16 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1rd8 h ARG 76 Cb 0.10 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 1rd8 h ARG 76 CO -0.02 0.93 0.34 0.82 -1.07 0.00 0.00 179.97 180.98 1rd8 h ILE 77 N 0.34 1.21 -0.14 2.04 1.08 -1.93 -0.10 117.51 120.01 1rd8 h ILE 77 Ca 0.04 -0.55 0.03 0.00 -0.39 0.00 0.00 64.86 63.99 1rd8 h ILE 77 Cb 0.82 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.92 1rd8 h ILE 77 CO 0.06 0.24 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.62 1rd8 h GLU 78 N 0.90 -0.04 -0.16 2.37 4.81 -1.28 0.20 114.58 121.38 1rd8 h GLU 78 Ca 0.23 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1rd8 h GLU 78 Cb 0.07 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1rd8 h GLU 78 CO -0.03 -0.02 -0.23 -0.91 -0.73 0.00 0.00 179.01 177.08 1rd8 h ASN 79 N -0.04 0.27 -0.45 1.04 2.35 -1.23 -1.78 115.58 115.74 1rd8 h ASN 79 Ca 0.08 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1rd8 h ASN 79 Cb 0.15 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 1rd8 h ASN 79 CO -0.17 0.51 0.21 0.25 -1.65 0.00 0.00 177.43 176.58 1rd8 h LEU 80 N 0.25 0.63 -0.88 1.61 5.85 -0.01 -1.78 115.31 120.98 1rd8 h LEU 80 Ca 0.04 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 1rd8 h LEU 80 Cb 0.55 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1rd8 h LEU 80 CO 0.04 0.56 -0.47 -1.13 -0.34 0.00 0.00 178.44 177.10 1rd8 h ASN 81 N 0.70 0.22 -0.07 1.25 -1.24 0.20 -2.80 115.58 113.83 1rd8 h ASN 81 Ca 0.17 -0.10 -0.16 0.00 0.71 0.00 0.00 56.30 56.92 1rd8 h ASN 81 Cb 0.12 -0.06 0.01 0.00 0.73 0.00 0.00 38.32 39.12 1rd8 h ASN 81 CO -0.02 0.66 -0.58 0.11 -1.29 0.00 0.00 177.43 176.31 1rd8 h LYS 82 N 0.16 0.51 -0.94 6.67 1.57 -1.16 -2.19 116.57 121.20 1rd8 h LYS 82 Ca 0.01 -0.46 0.22 0.00 -1.87 0.00 0.00 60.65 58.55 1rd8 h LYS 82 Cb 0.90 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 1rd8 h LYS 82 CO 0.07 1.09 0.62 -0.22 -0.57 0.00 0.00 179.45 180.45 1rd8 h LYS 83 N 0.09 0.36 0.01 3.15 3.64 -1.23 0.12 116.57 122.71 1rd8 h LYS 83 Ca -0.05 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1rd8 h LYS 83 Cb 1.24 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1rd8 h LYS 83 CO 0.12 0.24 -0.00 0.28 -2.27 0.00 0.00 179.45 177.81 1rd8 h VAL 84 N 0.37 1.57 -0.05 2.00 2.07 -1.29 -1.81 116.25 119.11 1rd8 h VAL 84 Ca 0.49 -1.83 0.04 0.00 0.82 0.00 0.00 66.70 66.22 1rd8 h VAL 84 Cb 1.30 2.80 -0.05 0.00 -1.52 0.00 0.00 31.29 33.82 1rd8 h VAL 84 CO -0.19 0.47 -0.27 0.44 0.02 0.00 0.00 177.57 178.04 1rd8 h ASP 85 N -0.81 -0.82 -0.26 0.57 3.32 -0.60 -1.84 116.42 115.97 1rd8 h ASP 85 Ca -0.00 0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 1rd8 h ASP 85 Cb 0.78 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 1rd8 h ASP 85 CO 0.00 -0.33 -0.19 0.44 -1.72 0.00 0.00 179.24 177.44 1rd8 h ASP 86 N -0.39 0.72 -0.06 6.45 3.32 -0.92 -1.48 116.42 124.05 1rd8 h ASP 86 Ca 0.08 -0.24 0.04 0.00 0.02 0.00 0.00 57.03 56.93 1rd8 h ASP 86 Cb 0.50 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.80 1rd8 h ASP 86 CO -0.27 0.90 -0.34 1.23 -1.72 0.00 0.00 179.24 179.04 1rd8 h GLY 87 N 0.98 -0.53 0.52 2.75 0.00 -0.90 -1.11 103.07 104.78 1rd8 h GLY 87 Ca 0.10 0.41 0.07 0.00 0.00 0.00 0.00 47.33 47.90 1rd8 h GLY 87 CO 0.05 -0.23 0.17 0.74 0.00 0.00 0.00 176.54 177.27 1rd8 h PHE 88 N -0.45 0.29 -0.75 5.60 0.04 -1.13 -2.06 116.94 118.48 1rd8 h PHE 88 Ca 0.07 0.03 0.11 0.00 2.80 0.00 0.00 57.97 60.98 1rd8 h PHE 88 Cb 0.57 -0.06 -0.08 0.00 2.20 0.00 0.00 35.95 38.58 1rd8 h PHE 88 CO -0.39 0.09 0.38 1.25 -0.60 0.00 0.00 178.31 179.04 1rd8 h LEU 89 N 0.34 0.49 -0.38 1.54 5.85 -0.47 -1.44 115.31 121.24 1rd8 h LEU 89 Ca 0.23 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.95 1rd8 h LEU 89 Cb 0.25 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1rd8 h LEU 89 CO -0.25 0.26 -0.04 0.44 -0.34 0.00 0.00 178.44 178.52 1rd8 h ASP 90 N 0.62 0.68 0.10 1.25 3.32 -0.97 -2.07 116.42 119.36 1rd8 h ASP 90 Ca 0.38 -0.33 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1rd8 h ASP 90 Cb 0.43 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1rd8 h ASP 90 CO -0.29 0.85 -0.05 0.40 -1.72 0.00 0.00 179.24 178.43 1rd8 h ILE 91 N 0.50 0.94 -0.33 0.35 2.04 -0.80 -1.77 117.51 118.45 1rd8 h ILE 91 Ca 0.10 -0.17 -0.12 0.00 1.00 0.00 0.00 64.86 65.67 1rd8 h ILE 91 Cb 0.52 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1rd8 h ILE 91 CO 0.03 0.04 -0.27 -0.50 0.00 0.00 0.00 178.15 177.45 1rd8 h TRP 92 N -0.21 0.90 -0.10 1.37 4.06 -1.31 -1.88 115.95 118.77 1rd8 h TRP 92 Ca -0.01 -0.26 0.01 0.00 2.06 0.00 0.00 58.89 60.69 1rd8 h TRP 92 Cb 0.17 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.13 1rd8 h TRP 92 CO -0.05 1.01 0.03 1.15 -3.56 0.00 0.00 178.44 177.02 1rd8 h THR 93 N 0.53 0.97 -0.33 1.49 2.02 -1.37 0.75 112.91 116.97 1rd8 h THR 93 Ca 0.06 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 1rd8 h THR 93 Cb 0.83 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1rd8 h THR 93 CO 0.07 0.01 0.20 0.22 0.37 0.00 0.00 175.52 176.39 1rd8 h TYR 94 N 0.07 0.43 -0.10 3.16 3.20 -1.31 -1.62 116.97 120.80 1rd8 h TYR 94 Ca 0.04 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 1rd8 h TYR 94 Cb 0.03 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1rd8 h TYR 94 CO -0.10 0.31 -0.37 -0.91 -1.64 0.00 0.00 178.16 175.45 1rd8 h ASN 95 N 0.43 0.49 -0.96 -2.11 2.35 -0.86 -1.06 115.58 113.86 1rd8 h ASN 95 Ca 0.12 -0.62 0.02 0.00 -0.55 0.00 0.00 56.30 55.27 1rd8 h ASN 95 Cb 0.01 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.18 1rd8 h ASN 95 CO -0.02 1.03 0.63 0.00 -1.65 0.00 0.00 177.43 177.42 1rd8 h ALA 96 N 0.48 1.34 0.63 -0.83 0.00 0.50 0.42 119.26 121.80 1rd8 h ALA 96 Ca -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1rd8 h ALA 96 Cb 1.00 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1rd8 h ALA 96 CO 0.08 0.59 -0.30 1.49 0.00 0.00 0.00 179.25 181.11 1rd8 h GLU 97 N 1.27 -0.81 -0.51 0.00 4.57 -1.25 -1.90 114.58 115.94 1rd8 h GLU 97 Ca 0.36 0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.68 1rd8 h GLU 97 Cb -0.09 0.19 -0.07 0.00 -0.16 0.00 0.00 28.75 28.62 1rd8 h GLU 97 CO -0.09 -0.51 0.14 -0.07 -1.18 0.00 0.00 179.01 177.30 1rd8 h LEU 98 N -1.17 0.09 -0.87 1.64 3.38 -1.08 -1.56 115.31 115.75 1rd8 h LEU 98 Ca -0.09 0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.08 1rd8 h LEU 98 Cb 0.68 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.43 1rd8 h LEU 98 CO 0.14 0.08 0.49 0.25 0.09 0.00 0.00 178.44 179.49 1rd8 h LEU 99 N 0.30 0.68 -0.06 1.67 5.85 -0.15 -0.68 115.31 122.91 1rd8 h LEU 99 Ca 0.25 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 1rd8 h LEU 99 Cb 0.31 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1rd8 h LEU 99 CO -0.29 0.35 -0.16 0.58 -0.34 0.00 0.00 178.44 178.57 1rd8 h VAL 100 N 0.77 1.43 -0.42 1.05 2.07 -0.65 -2.23 116.25 118.27 1rd8 h VAL 100 Ca 0.44 -1.52 0.04 0.00 0.82 0.00 0.00 66.70 66.48 1rd8 h VAL 100 Cb 0.49 2.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.49 1rd8 h VAL 100 CO -0.29 0.42 0.20 -0.07 0.02 0.00 0.00 177.57 177.85 1rd8 h LEU 101 N -0.28 0.27 -0.14 2.57 3.38 -0.95 0.07 115.31 120.23 1rd8 h LEU 101 Ca -0.00 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1rd8 h LEU 101 Cb 0.77 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1rd8 h LEU 101 CO 0.04 0.20 -0.04 -0.07 0.09 0.00 0.00 178.44 178.65 1rd8 h LEU 102 N 0.40 0.27 0.00 1.67 -0.00 -1.22 -3.06 115.31 113.37 1rd8 h LEU 102 Ca 0.18 -0.38 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 1rd8 h LEU 102 Cb 0.11 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 40.69 1rd8 h LEU 102 CO -0.14 0.59 0.00 1.21 -0.00 0.00 0.00 178.44 180.10 1rd8 n GLU 103 N -4.70 0.08 0.04 1.13 4.07 -0.84 -2.82 120.64 117.60 1rd8 n GLU 103 Ca -0.06 0.13 -0.21 0.00 -0.06 0.00 0.00 57.16 56.97 1rd8 n GLU 103 Cb 0.26 -1.50 -0.14 0.00 -0.06 0.00 0.00 31.44 30.00 1rd8 n GLU 103 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1rd8 h ASN 104 N 0.00 0.48 -0.03 4.31 4.21 -0.88 -2.85 115.58 120.81 1rd8 h ASN 104 Ca 0.00 -0.84 0.01 0.00 1.21 0.00 0.00 56.30 56.67 1rd8 h ASN 104 Cb 0.31 -0.16 -0.00 0.00 -1.12 0.00 0.00 38.32 37.35 1rd8 h ASN 104 CO 0.00 1.73 0.02 1.05 -1.29 0.00 0.00 177.43 178.95 1rd8 h GLU 105 N 0.08 0.00 0.08 0.81 4.11 -1.44 -2.02 114.58 116.21 1rd8 h GLU 105 Ca -0.36 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.07 1rd8 h GLU 105 Cb 2.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.31 1rd8 h GLU 105 CO 0.14 0.00 -0.04 0.00 0.07 0.00 0.00 179.01 179.18 1rd8 h ARG 106 N 0.00 -0.11 -0.87 1.06 2.47 -1.58 -2.06 114.38 113.30 1rd8 h ARG 106 Ca 0.01 0.01 0.07 0.00 -1.26 0.00 0.00 59.98 58.81 1rd8 h ARG 106 Cb 0.06 0.02 -0.06 0.00 -1.65 0.00 0.00 29.97 28.34 1rd8 h ARG 106 CO -0.00 0.41 0.54 1.15 0.56 0.00 0.00 179.97 182.62 1rd8 h THR 107 N -0.70 1.03 -0.28 2.04 2.02 -1.31 -0.99 112.91 114.72 1rd8 h THR 107 Ca -0.01 -0.33 -0.13 0.00 0.77 0.00 0.00 66.41 66.70 1rd8 h THR 107 Cb 0.56 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 1rd8 h THR 107 CO 0.02 0.18 -0.37 -0.07 0.37 0.00 0.00 175.52 175.65 1rd8 h LEU 108 N 0.97 0.67 -0.84 2.58 3.38 -1.37 -2.46 115.31 118.25 1rd8 h LEU 108 Ca 0.38 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1rd8 h LEU 108 Cb 0.19 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1rd8 h LEU 108 CO -0.18 0.97 -0.23 0.44 0.09 0.00 0.00 178.44 179.53 1rd8 h ASP 109 N 0.53 0.62 -0.97 -0.43 3.32 -0.98 -2.61 116.42 115.90 1rd8 h ASP 109 Ca 0.05 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1rd8 h ASP 109 Cb 0.88 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.21 1rd8 h ASP 109 CO 0.08 0.84 0.62 0.15 -1.72 0.00 0.00 179.24 179.21 1rd8 h PHE 110 N 0.54 1.25 -0.03 4.55 3.57 -0.96 -0.58 116.94 125.27 1rd8 h PHE 110 Ca 0.08 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1rd8 h PHE 110 Cb 0.69 -0.42 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 1rd8 h PHE 110 CO 0.03 0.80 -0.02 0.45 -2.23 0.00 0.00 178.31 177.35 1rd8 h HIS 111 N 1.33 0.07 -0.27 0.41 3.86 -1.15 -2.36 115.15 117.03 1rd8 h HIS 111 Ca 0.35 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 1rd8 h HIS 111 Cb -0.11 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 1rd8 h HIS 111 CO 0.00 0.48 0.18 -0.44 0.86 0.00 0.00 177.93 179.01 1rd8 h ASP 112 N -0.36 0.31 0.12 2.45 3.32 -1.15 -2.20 116.42 118.90 1rd8 h ASP 112 Ca 0.01 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.83 1rd8 h ASP 112 Cb 0.46 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 39.94 1rd8 h ASP 112 CO 0.00 0.22 -0.84 0.28 -1.72 0.00 0.00 179.24 177.19 1rd8 h SER 113 N 0.36 0.69 -0.22 6.45 0.02 -1.04 -2.38 113.55 117.44 1rd8 h SER 113 Ca 0.10 -0.49 -0.09 0.00 -0.84 0.00 0.00 61.79 60.47 1rd8 h SER 113 Cb -0.03 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 1rd8 h SER 113 CO -0.02 1.27 -0.15 0.78 -1.14 0.00 0.00 176.83 177.57 1rd8 h ASN 114 N 0.36 0.62 -0.31 3.07 2.35 -0.86 0.21 115.58 121.02 1rd8 h ASN 114 Ca -0.06 -0.19 -0.16 0.00 -0.55 0.00 0.00 56.30 55.35 1rd8 h ASN 114 Cb 1.45 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.65 1rd8 h ASN 114 CO 0.16 0.79 -0.39 0.58 -1.65 0.00 0.00 177.43 176.92 1rd8 h VAL 115 N 0.57 1.28 -0.06 2.81 2.07 -1.37 -1.28 116.25 120.27 1rd8 h VAL 115 Ca 0.10 -1.57 -0.15 0.00 0.82 0.00 0.00 66.70 65.90 1rd8 h VAL 115 Cb 0.59 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1rd8 h VAL 115 CO 0.04 0.52 -0.63 -0.09 0.02 0.00 0.00 177.57 177.43 1rd8 h ARG 116 N 0.71 0.22 -0.23 1.57 9.65 -1.28 -2.94 114.38 122.08 1rd8 h ARG 116 Ca 0.06 -0.16 -0.14 0.00 -1.10 0.00 0.00 59.98 58.64 1rd8 h ARG 116 Cb 0.97 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 1rd8 h ARG 116 CO 0.09 0.78 -0.43 -0.97 2.80 0.00 0.00 179.97 182.24 1rd8 h ASN 117 N 0.16 0.61 -0.60 -3.80 -1.24 -0.32 -2.23 115.58 108.17 1rd8 h ASN 117 Ca -0.01 -0.28 -0.04 0.00 0.71 0.00 0.00 56.30 56.68 1rd8 h ASN 117 Cb 1.14 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 40.00 1rd8 h ASN 117 CO 0.10 0.96 0.22 0.25 -1.29 0.00 0.00 177.43 177.67 1rd8 h LEU 118 N 0.46 0.84 -0.73 0.34 5.85 -1.15 -1.49 115.31 119.43 1rd8 h LEU 118 Ca 0.03 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.60 1rd8 h LEU 118 Cb 0.94 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 1rd8 h LEU 118 CO 0.08 0.80 0.46 0.22 -0.34 0.00 0.00 178.44 179.66 1rd8 h TYR 119 N 0.83 0.86 -0.01 1.25 3.20 -1.32 -1.91 116.97 119.88 1rd8 h TYR 119 Ca 0.20 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.98 1rd8 h TYR 119 Cb 0.23 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 1rd8 h TYR 119 CO 0.01 0.49 -0.50 0.93 -1.64 0.00 0.00 178.16 177.45 1rd8 h GLU 120 N 0.90 0.02 -0.27 1.82 4.39 -1.00 -0.87 114.58 119.57 1rd8 h GLU 120 Ca 0.30 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.89 1rd8 h GLU 120 Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1rd8 h GLU 120 CO -0.11 0.52 -0.22 0.87 -1.16 0.00 0.00 179.01 178.90 1rd8 h LYS 121 N 0.02 0.50 0.12 2.33 1.57 -0.55 -2.12 116.57 118.45 1rd8 h LYS 121 Ca -0.00 -0.18 -0.29 0.00 -1.87 0.00 0.00 60.65 58.30 1rd8 h LYS 121 Cb 0.89 -0.03 0.02 0.00 0.08 0.00 0.00 32.23 33.19 1rd8 h LYS 121 CO 0.07 0.70 -1.23 0.28 -0.57 0.00 0.00 179.45 178.69 1rd8 h VAL 122 N 0.45 1.32 -0.46 0.50 2.07 -1.02 -3.00 116.25 116.11 1rd8 h VAL 122 Ca 0.07 -2.55 0.10 0.00 0.82 0.00 0.00 66.70 65.13 1rd8 h VAL 122 Cb 0.64 2.72 -0.02 0.00 -1.52 0.00 0.00 31.29 33.10 1rd8 h VAL 122 CO 0.05 0.77 0.32 0.50 0.02 0.00 0.00 177.57 179.23 1rd8 h LYS 123 N 0.24 0.19 -0.11 1.57 3.64 -1.11 -1.92 116.57 119.07 1rd8 h LYS 123 Ca -0.18 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.05 1rd8 h LYS 123 Cb 1.91 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 1rd8 h LYS 123 CO 0.23 0.12 -0.54 1.03 -2.27 0.00 0.00 179.45 178.03 1rd8 h SER 124 N 0.19 0.37 0.02 4.20 0.87 -1.24 -2.19 113.55 115.77 1rd8 h SER 124 Ca 0.22 -0.19 -0.06 0.00 -1.23 0.00 0.00 61.79 60.53 1rd8 h SER 124 Cb 0.60 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1rd8 h SER 124 CO -0.04 0.83 -0.27 1.56 -0.53 0.00 0.00 176.83 178.38 1rd8 h GLN 125 N 0.26 0.05 -0.12 2.24 4.20 -1.33 -3.39 115.11 117.02 1rd8 h GLN 125 Ca 0.01 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1rd8 h GLN 125 Cb 1.03 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1rd8 h GLN 125 CO 0.09 1.04 -0.12 -0.07 -0.67 0.00 0.00 178.83 179.10 1rd8 h LEU 126 N -0.90 0.32 0.00 1.46 3.38 -1.44 -3.43 115.31 114.70 1rd8 h LEU 126 Ca -0.06 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1rd8 h LEU 126 Cb 1.14 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1rd8 h LEU 126 CO 0.00 0.73 0.00 0.29 0.09 0.00 0.00 178.44 179.55 1rd8 n LYS 127 N -4.61 0.00 -0.21 1.13 5.02 -0.82 -1.84 118.16 116.83 1rd8 n LYS 127 Ca -0.07 0.00 0.20 0.00 -2.02 0.00 0.00 58.31 56.42 1rd8 n LYS 127 Cb 0.34 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.70 1rd8 n LYS 127 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1rd8 n ASN 128 N -0.73 0.15 0.00 4.39 5.03 -1.26 -2.00 115.26 120.84 1rd8 n ASN 128 Ca 0.00 0.83 0.10 0.00 0.87 0.00 0.00 54.58 56.38 1rd8 n ASN 128 Cb 0.00 -0.41 0.61 0.00 -1.02 0.00 0.00 39.78 38.96 1rd8 n ASN 128 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1rd8 n ASN 129 N -4.00 0.00 -3.79 6.41 3.02 -0.76 -4.73 115.26 111.40 1rd8 n ASN 129 Ca 0.21 -0.70 -0.11 0.00 -0.03 0.00 0.00 54.58 53.95 1rd8 n ASN 129 Cb 0.78 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.89 1rd8 n ASN 129 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rd8 s ALA 130 N -2.00 0.30 -0.09 5.41 0.00 -0.85 -2.07 121.76 122.47 1rd8 s ALA 130 Ca 0.31 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 51.08 1rd8 s ALA 130 Cb 0.14 1.15 0.01 0.00 0.00 0.00 0.00 23.12 24.41 1rd8 s ALA 130 CO 0.24 -0.79 -0.18 0.21 0.00 0.00 0.00 175.76 175.23 1rd8 s LYS 131 N -3.73 2.42 -0.19 0.00 2.20 0.31 -4.88 119.74 115.88 1rd8 s LYS 131 Ca 0.28 -0.66 -0.29 0.00 -0.36 0.00 0.00 55.97 54.94 1rd8 s LYS 131 Cb 0.01 -1.90 -0.00 0.00 -1.51 0.00 0.00 37.83 34.43 1rd8 s LYS 131 CO 0.13 0.09 1.15 -1.21 -0.36 0.00 0.00 175.35 175.15 1rd8 s GLU 132 N 0.54 4.26 -0.10 4.03 2.02 -1.26 -0.89 118.70 127.30 1rd8 s GLU 132 Ca -0.16 1.51 0.14 0.00 0.02 0.00 0.00 54.97 56.49 1rd8 s GLU 132 Cb -0.17 -3.69 0.26 0.00 0.10 0.00 0.00 34.13 30.64 1rd8 s GLU 132 CO 0.06 -0.65 1.16 0.44 0.02 0.00 0.00 175.26 176.29 1rd8 n ILE 133 N 5.29 1.71 0.00 -1.63 -5.35 -0.67 -4.96 119.36 113.73 1rd8 n ILE 133 Ca 0.13 -1.87 0.00 0.00 -0.27 0.00 0.00 62.75 60.74 1rd8 n ILE 133 Cb 0.46 -0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.31 1rd8 n ILE 133 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rd8 n GLY 134 N -0.99 0.16 4.00 3.28 0.00 -1.25 -4.88 105.19 105.52 1rd8 n GLY 134 Ca 0.13 -1.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 1rd8 n GLY 134 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rd8 n ASN 135 N -0.90 -4.41 -2.62 1.61 3.02 -0.91 -1.87 115.26 109.19 1rd8 n ASN 135 Ca 0.00 -0.84 -0.18 0.00 -0.03 0.00 0.00 54.58 53.52 1rd8 n ASN 135 Cb 0.00 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 35.60 1rd8 n ASN 135 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rd8 n GLY 136 N -1.61 -0.50 3.49 7.41 0.00 -0.70 -4.23 105.19 109.04 1rd8 n GLY 136 Ca 0.05 0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1rd8 n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rd8 s PHE 138 N -0.81 3.19 -0.25 0.00 0.40 -1.26 -1.68 117.98 117.58 1rd8 s PHE 138 Ca 0.13 0.05 -0.11 0.00 -0.60 0.00 0.00 56.93 56.40 1rd8 s PHE 138 Cb -0.11 -1.95 -0.05 0.00 0.51 0.00 0.00 43.02 41.43 1rd8 s PHE 138 CO 0.02 0.25 0.20 -2.00 0.70 0.00 0.00 175.22 174.39 1rd8 s GLU 139 N -0.12 4.04 0.34 0.44 2.12 -0.06 -4.90 118.70 120.57 1rd8 s GLU 139 Ca 0.05 -0.22 -0.26 0.00 0.36 0.00 0.00 54.97 54.90 1rd8 s GLU 139 Cb -0.12 -3.58 -0.09 0.00 0.26 0.00 0.00 34.13 30.59 1rd8 s GLU 139 CO 0.02 -0.04 1.03 -0.06 -0.54 0.00 0.00 175.26 175.66 1rd8 s PHE 140 N 1.36 3.48 -1.68 5.30 0.40 -1.26 -0.53 117.98 125.05 1rd8 s PHE 140 Ca 0.09 1.71 0.17 0.00 -0.60 0.00 0.00 56.93 58.29 1rd8 s PHE 140 Cb -0.14 -3.11 0.56 0.00 0.51 0.00 0.00 43.02 40.83 1rd8 s PHE 140 CO 0.07 -0.35 1.45 0.66 0.70 0.00 0.00 175.22 177.76 1rd8 n TYR 141 N 0.46 0.98 -4.07 0.36 4.01 -0.88 -4.92 117.16 113.09 1rd8 n TYR 141 Ca 0.02 -0.44 -0.10 0.00 -0.16 0.00 0.00 57.90 57.23 1rd8 n TYR 141 Cb 0.48 -0.09 -0.09 0.00 -0.31 0.00 0.00 39.34 39.34 1rd8 n TYR 141 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 1rd8 s HIS 142 N -1.44 0.69 -0.29 -0.72 -3.43 -1.26 -4.03 115.29 104.80 1rd8 s HIS 142 Ca 0.41 -1.04 -0.29 0.00 -0.80 0.00 0.00 55.06 53.34 1rd8 s HIS 142 Cb 0.23 -0.29 -0.01 0.00 -1.43 0.00 0.00 32.58 31.09 1rd8 s HIS 142 CO 0.24 -0.64 1.48 0.15 -2.00 0.00 0.00 174.74 173.97 1rd8 s LYS 143 N -4.03 3.77 -0.56 -0.38 1.02 -1.26 -4.98 119.74 113.33 1rd8 s LYS 143 Ca 0.23 1.37 -0.08 0.00 0.02 0.00 0.00 55.97 57.51 1rd8 s LYS 143 Cb 0.05 -3.99 0.14 0.00 -0.52 0.00 0.00 37.83 33.52 1rd8 s LYS 143 CO 0.03 -1.32 0.42 0.00 -0.92 0.00 0.00 175.35 173.56 1rd8 s ASP 145 N 2.01 5.69 0.27 0.00 -4.77 -1.26 -4.64 116.67 113.96 1rd8 s ASP 145 Ca 0.11 1.51 0.15 0.00 -3.30 0.00 0.00 52.55 51.01 1rd8 s ASP 145 Cb -0.22 -2.44 0.98 0.00 -1.09 0.00 0.00 42.92 40.14 1rd8 s ASP 145 CO -0.03 -1.23 1.17 0.47 0.70 0.00 0.00 175.17 176.25 1rd8 n ASP 146 N -2.99 0.24 -0.06 2.11 9.92 -1.26 0.21 116.55 124.72 1rd8 n ASP 146 Ca 0.07 1.24 -0.12 0.00 -0.53 0.00 0.00 54.79 55.45 1rd8 n ASP 146 Cb 0.54 -0.59 -0.05 0.00 -0.64 0.00 0.00 41.12 40.37 1rd8 n ASP 146 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rd8 h ALA 147 N 1.49 0.25 -0.87 2.24 0.00 -1.99 -1.61 119.26 118.77 1rd8 h ALA 147 Ca 0.62 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1rd8 h ALA 147 Cb 1.63 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.31 1rd8 h ALA 147 CO -0.58 -0.04 0.44 0.00 0.00 0.00 0.00 179.25 179.07 1rd8 h MET 149 N 1.23 0.96 -0.68 0.00 2.07 -0.72 -2.63 114.93 115.16 1rd8 h MET 149 Ca 0.30 -0.09 -0.04 0.00 -2.07 0.00 0.00 59.70 57.80 1rd8 h MET 149 Cb 0.08 -0.20 -0.03 0.00 -1.87 0.00 0.00 31.60 29.59 1rd8 h MET 149 CO -0.04 0.69 0.26 1.49 1.07 0.00 0.00 176.91 180.38 1rd8 h GLU 150 N 0.96 1.02 0.00 1.72 4.81 -1.09 -2.01 114.58 119.99 1rd8 h GLU 150 Ca 0.25 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1rd8 h GLU 150 Cb -0.02 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.20 1rd8 h GLU 150 CO -0.05 0.86 -0.09 0.66 -0.73 0.00 0.00 179.01 179.66 1rd8 h SER 151 N 0.97 0.00 0.11 1.04 4.64 -1.09 -1.21 113.55 118.01 1rd8 h SER 151 Ca 0.22 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 1rd8 h SER 151 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1rd8 h SER 151 CO -0.02 0.09 -0.05 0.58 -0.87 0.00 0.00 176.83 176.57 1rd8 h VAL 152 N 0.00 1.02 0.00 0.95 2.07 -1.08 0.79 116.25 120.00 1rd8 h VAL 152 Ca -0.00 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1rd8 h VAL 152 Cb 0.22 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1rd8 h VAL 152 CO 0.01 0.28 0.09 0.03 0.02 0.00 0.00 177.57 178.01 1rd8 h ARG 153 N -0.84 0.00 0.00 1.57 3.08 -0.77 -2.12 114.38 115.30 1rd8 h ARG 153 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1rd8 h ARG 153 Cb 0.57 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.55 1rd8 h ARG 153 CO 0.02 0.00 -0.54 0.27 -1.07 0.00 0.00 179.97 178.66 1rd8 n ASN 154 N -2.84 1.62 -1.49 7.04 6.94 -0.51 -4.94 115.26 121.07 1rd8 n ASN 154 Ca -0.02 -3.46 -0.16 0.00 -0.02 0.00 0.00 54.58 50.91 1rd8 n ASN 154 Cb 0.15 -0.47 -0.05 0.00 -2.36 0.00 0.00 39.78 37.05 1rd8 n ASN 154 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rd8 n GLY 155 N -0.86 0.86 0.19 4.83 0.00 -0.80 -4.89 105.19 104.53 1rd8 n GLY 155 Ca 0.16 -0.23 0.08 0.00 0.00 0.00 0.00 46.02 46.03 1rd8 n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rd8 n THR 156 N -3.12 1.81 -1.68 2.61 -2.24 0.26 -5.01 114.28 106.91 1rd8 n THR 156 Ca -0.17 -2.02 -0.46 0.00 -2.27 0.00 0.00 64.05 59.13 1rd8 n THR 156 Cb 0.58 -0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 1rd8 n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rd8 n TYR 157 N -1.14 2.36 -3.04 4.78 9.36 -0.50 -4.88 117.16 124.10 1rd8 n TYR 157 Ca 0.15 0.16 -0.44 0.00 3.32 0.00 0.00 57.90 61.08 1rd8 n TYR 157 Cb 0.62 -2.60 -0.04 0.00 -0.63 0.00 0.00 39.34 36.69 1rd8 n TYR 157 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1rd8 s ASP 158 N 1.68 6.29 0.07 2.98 2.15 -1.26 -4.95 116.67 123.63 1rd8 s ASP 158 Ca 0.81 -1.52 -0.25 0.00 0.43 0.00 0.00 52.55 52.02 1rd8 s ASP 158 Cb -0.64 -2.34 -0.16 0.00 -0.30 0.00 0.00 42.92 39.47 1rd8 s ASP 158 CO 0.40 -1.14 1.64 0.22 -0.17 0.00 0.00 175.17 176.11 1rd8 h TYR 159 N 9.12 -0.17 -0.99 -5.34 3.20 -1.92 -3.02 116.97 117.84 1rd8 h TYR 159 Ca -0.19 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.77 1rd8 h TYR 159 Cb 1.07 0.06 -0.08 0.00 1.54 0.00 0.00 36.73 39.32 1rd8 h TYR 159 CO 0.93 -0.04 0.63 -1.35 -1.64 0.00 0.00 178.16 176.69 1rd8 h PRO 160 N -0.26 1.03 -0.79 1.82 0.11 -1.96 -0.35 132.00 131.59 1rd8 h PRO 160 Ca -0.02 -0.06 0.18 0.00 0.11 0.00 0.00 66.00 66.21 1rd8 h PRO 160 Cb 0.21 -0.23 -0.12 0.00 0.11 0.00 0.00 31.00 30.97 1rd8 h PRO 160 CO 0.03 0.68 0.24 -0.22 -0.21 0.00 0.00 178.00 178.52 1rd8 h LYS 161 N 1.06 0.30 -0.17 1.05 3.64 -1.96 -2.66 116.57 117.83 1rd8 h LYS 161 Ca 0.46 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1rd8 h LYS 161 Cb 0.36 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1rd8 h LYS 161 CO -0.22 0.20 0.00 0.66 -2.27 0.00 0.00 179.45 177.82 1rd8 n TYR 162 N -5.12 0.20 0.15 1.91 4.02 -0.84 -4.73 117.16 112.74 1rd8 n TYR 162 Ca 0.17 -0.12 -0.16 0.00 -0.01 0.00 0.00 57.90 57.77 1rd8 n TYR 162 Cb 0.52 -0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.75 1rd8 n TYR 162 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1rd8 h SER 163 N 3.77 -1.42 -0.27 7.72 4.64 -0.71 -0.44 113.55 126.83 1rd8 h SER 163 Ca 0.00 0.14 0.05 0.00 -0.47 0.00 0.00 61.79 61.52 1rd8 h SER 163 Cb 0.84 0.52 -0.05 0.00 -0.31 0.00 0.00 62.40 63.39 1rd8 h SER 163 CO 0.00 -0.56 -0.08 1.05 -0.87 0.00 0.00 176.83 176.37 1rd8 h GLU 164 N -0.78 -0.01 0.17 4.77 9.09 -1.85 0.68 114.58 126.65 1rd8 h GLU 164 Ca -0.01 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.41 1rd8 h GLU 164 Cb 0.76 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.84 1rd8 h GLU 164 CO -0.22 -0.01 -0.22 1.49 0.05 0.00 0.00 179.01 180.09 1rd8 h GLU 165 N -0.02 -0.43 -0.85 1.06 4.81 -1.85 -1.76 114.58 115.55 1rd8 h GLU 165 Ca 0.13 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.51 1rd8 h GLU 165 Cb 0.21 0.10 -0.08 0.00 0.63 0.00 0.00 28.75 29.61 1rd8 h GLU 165 CO -0.28 -0.29 0.47 0.77 -0.73 0.00 0.00 179.01 178.95 1rd8 h SER 166 N -0.45 0.64 0.19 1.04 0.02 -0.80 -1.80 113.55 112.38 1rd8 h SER 166 Ca 0.01 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1rd8 h SER 166 Cb 0.45 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.89 1rd8 h SER 166 CO -0.09 0.33 -0.52 0.50 -1.14 0.00 0.00 176.83 175.91 1rd8 h LYS 167 N 0.74 -0.77 0.20 3.45 3.64 0.11 -0.59 116.57 123.35 1rd8 h LYS 167 Ca 0.43 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 1rd8 h LYS 167 Cb 0.49 0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 1rd8 h LYS 167 CO -0.30 -0.51 -0.40 -0.07 -2.27 0.00 0.00 179.45 175.90 1rd8 h LEU 168 N -0.79 -1.17 -0.97 5.20 3.38 -0.60 -0.04 115.31 120.32 1rd8 h LEU 168 Ca -0.01 0.11 0.20 0.00 0.09 0.00 0.00 57.88 58.27 1rd8 h LEU 168 Cb 0.78 0.42 -0.11 0.00 0.09 0.00 0.00 40.66 41.83 1rd8 h LEU 168 CO -0.25 -0.46 0.56 0.78 0.09 0.00 0.00 178.44 179.17 1rd8 h ASN 169 N -0.66 0.68 -0.02 -0.43 2.35 -1.25 -2.67 115.58 113.58 1rd8 h ASN 169 Ca -0.02 0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 1rd8 h ASN 169 Cb 0.62 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1rd8 h ASN 169 CO -0.16 0.20 -0.19 -0.09 -1.65 0.00 0.00 177.43 175.54 1rd8 h ARG 170 N 0.67 0.17 -0.71 0.81 2.43 -0.42 -1.67 114.38 115.65 1rd8 h ARG 170 Ca 0.58 -0.15 0.15 0.00 -0.81 0.00 0.00 59.98 59.74 1rd8 h ARG 170 Cb 0.97 0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.42 1rd8 h ARG 170 CO -0.42 0.84 -0.15 0.93 -1.51 0.00 0.00 179.97 179.66 1rd8 h GLU 171 N -0.45 0.01 -1.76 0.20 5.08 -0.73 -2.05 114.58 114.88 1rd8 h GLU 171 Ca -0.02 -0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.71 1rd8 h GLU 171 Cb 0.89 -0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.75 1rd8 h GLU 171 CO 0.04 0.01 -0.32 -0.85 -1.00 0.00 0.00 179.01 176.89 1rd8 n GLU 172 N -5.45 3.37 0.12 2.33 -0.00 -1.03 -4.29 120.64 115.69 1rd8 n GLU 172 Ca 0.10 -4.40 0.00 0.00 -0.00 0.00 0.00 57.16 52.86 1rd8 n GLU 172 Cb 0.38 -2.26 0.00 0.00 -0.00 0.00 0.00 31.44 29.56 1rd8 n GLU 172 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1rd8 n ILE 173 N -0.43 0.00 -3.94 3.84 2.08 -0.63 -4.92 119.36 115.35 1rd8 n ILE 173 Ca 0.41 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 63.38 1rd8 n ILE 173 Cb 0.52 -0.40 -0.14 0.00 -0.75 0.00 0.00 39.64 38.87 1rd8 n ILE 173 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 1rd8 s ASP 174 N -4.40 4.85 0.00 4.38 1.01 -0.79 -5.07 116.67 116.65 1rd8 s ASP 174 Ca 0.00 -1.67 0.00 0.00 0.71 0.00 0.00 52.55 51.59 1rd8 s ASP 174 Cb 0.00 -1.68 0.00 0.00 1.01 0.00 0.00 42.92 42.25 1rd8 s ASP 174 CO 0.00 -0.34 0.00 0.61 0.21 0.00 0.00 175.17 175.65