#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dmo n ASP 2 N 0.00 0.00 -4.36 0.00 8.00 -1.26 -4.66 116.55 114.27 1dmo n ASP 2 Ca 0.00 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.21 1dmo n ASP 2 Cb 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.30 1dmo n ASP 2 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1dmo s GLN 3 N 0.00 -0.19 0.37 -1.24 -0.21 -1.26 -4.67 119.66 112.46 1dmo s GLN 3 Ca 0.00 0.25 0.04 0.00 0.02 0.00 0.00 55.36 55.67 1dmo s GLN 3 Cb 0.00 -1.69 -0.04 0.00 1.00 0.00 0.00 33.01 32.28 1dmo s GLN 3 CO 0.00 -3.09 0.08 -0.51 -2.12 0.00 0.00 175.29 169.65 1dmo s LEU 4 N -6.62 2.12 0.24 2.90 1.02 -1.26 -5.07 118.68 112.00 1dmo s LEU 4 Ca 0.68 -1.52 0.09 0.00 0.02 0.00 0.00 54.13 53.39 1dmo s LEU 4 Cb -0.15 -0.30 -0.04 0.00 0.02 0.00 0.00 46.19 45.72 1dmo s LEU 4 CO 0.57 -0.76 0.03 -0.89 0.02 0.00 0.00 176.35 175.32 1dmo s THR 5 N -3.22 3.68 0.26 5.49 2.01 -1.26 -5.01 115.64 117.59 1dmo s THR 5 Ca 0.29 -1.70 -0.02 0.00 0.31 0.00 0.00 61.69 60.57 1dmo s THR 5 Cb 0.06 -2.94 0.25 0.00 0.01 0.00 0.00 72.50 69.88 1dmo s THR 5 CO 0.14 -0.30 1.70 -0.33 -0.69 0.00 0.00 174.62 175.14 1dmo h GLU 6 N 2.06 0.35 0.11 4.92 4.39 -2.02 -0.12 114.58 124.27 1dmo h GLU 6 Ca -0.46 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.22 1dmo h GLU 6 Cb 1.23 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1dmo h GLU 6 CO 0.60 0.23 -0.06 0.93 -1.16 0.00 0.00 179.01 179.54 1dmo h GLU 7 N 0.36 -0.16 -1.00 2.33 4.39 -1.98 0.14 114.58 118.66 1dmo h GLU 7 Ca 0.47 0.01 0.21 0.00 0.34 0.00 0.00 59.36 60.39 1dmo h GLU 7 Cb 0.82 0.04 -0.11 0.00 -0.10 0.00 0.00 28.75 29.40 1dmo h GLU 7 CO -0.50 -0.11 0.61 1.96 -1.16 0.00 0.00 179.01 179.82 1dmo h GLN 8 N -0.17 0.66 0.00 2.33 4.20 -1.47 1.10 115.11 121.76 1dmo h GLN 8 Ca -0.01 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1dmo h GLN 8 Cb 0.14 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1dmo h GLN 8 CO 0.02 0.44 -0.43 0.82 -0.67 0.00 0.00 178.83 179.00 1dmo h ILE 9 N 0.68 1.05 -0.13 2.54 2.04 -0.21 -1.94 117.51 121.55 1dmo h ILE 9 Ca 0.58 -1.64 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 1dmo h ILE 9 Cb 1.02 1.96 -0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1dmo h ILE 9 CO -0.37 0.42 -0.08 0.00 0.00 0.00 0.00 178.15 178.12 1dmo h ALA 10 N 1.57 0.18 -0.06 1.87 0.00 0.39 0.14 119.26 123.35 1dmo h ALA 10 Ca -0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1dmo h ALA 10 Cb 0.92 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1dmo h ALA 10 CO 0.06 -0.01 -0.26 1.49 0.00 0.00 0.00 179.25 180.53 1dmo h GLU 11 N -0.08 0.11 0.14 0.00 4.57 -0.98 -0.54 114.58 117.79 1dmo h GLU 11 Ca 0.03 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1dmo h GLU 11 Cb 0.57 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1dmo h GLU 11 CO 0.02 0.37 -0.06 0.74 -1.18 0.00 0.00 179.01 178.90 1dmo h PHE 12 N 0.10 -0.17 -0.16 0.92 -1.00 -1.13 -2.55 116.94 112.95 1dmo h PHE 12 Ca 0.02 -0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.81 1dmo h PHE 12 Cb 0.52 0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.13 1dmo h PHE 12 CO 0.00 0.21 0.11 -0.22 -1.61 0.00 0.00 178.31 176.80 1dmo h LYS 13 N -0.59 0.10 -0.15 1.51 3.64 -0.75 -0.89 116.57 119.44 1dmo h LYS 13 Ca -0.02 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1dmo h LYS 13 Cb 0.45 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1dmo h LYS 13 CO 0.03 0.07 -0.07 1.49 -2.27 0.00 0.00 179.45 178.70 1dmo h GLU 14 N 0.11 -0.05 -0.22 1.90 4.81 -0.76 0.54 114.58 120.90 1dmo h GLU 14 Ca 0.07 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1dmo h GLU 14 Cb 0.14 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1dmo h GLU 14 CO -0.01 -0.04 0.11 0.00 -0.73 0.00 0.00 179.01 178.35 1dmo h ALA 15 N 1.08 0.27 -0.69 2.92 0.00 -0.80 0.85 119.26 122.89 1dmo h ALA 15 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.14 1dmo h ALA 15 Cb 0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1dmo h ALA 15 CO -0.19 -0.30 0.46 0.35 0.00 0.00 0.00 179.25 179.58 1dmo h PHE 16 N 0.24 0.40 -0.02 0.00 3.57 -0.38 0.91 116.94 121.66 1dmo h PHE 16 Ca 0.09 0.01 -0.20 0.00 3.53 0.00 0.00 57.97 61.40 1dmo h PHE 16 Cb 0.02 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.63 1dmo h PHE 16 CO -0.09 0.16 -0.86 0.77 -2.23 0.00 0.00 178.31 176.06 1dmo h SER 17 N 0.35 0.43 0.28 0.41 0.02 0.18 -1.38 113.55 113.84 1dmo h SER 17 Ca 0.33 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1dmo h SER 17 Cb 0.81 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 1dmo h SER 17 CO -0.09 1.11 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.58 1dmo h LEU 18 N 0.20 0.00 -3.05 5.07 3.38 0.14 -2.09 115.31 118.96 1dmo h LEU 18 Ca -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1dmo h LEU 18 Cb 1.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 1dmo h LEU 18 CO 0.14 0.06 -0.13 0.49 0.09 0.00 0.00 178.44 179.09 1dmo n PHE 19 N -3.52 0.17 -0.12 1.13 3.72 -0.89 -4.68 117.46 113.26 1dmo n PHE 19 Ca -0.02 -1.15 -0.05 0.00 -0.05 0.00 0.00 57.45 56.18 1dmo n PHE 19 Cb 0.18 -0.21 0.15 0.00 -0.94 0.00 0.00 39.48 38.66 1dmo n PHE 19 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1dmo n ASP 20 N -1.24 3.49 -0.30 4.37 5.68 -0.54 -3.99 116.55 124.02 1dmo n ASP 20 Ca 0.18 -2.70 0.14 0.00 -0.50 0.00 0.00 54.79 51.91 1dmo n ASP 20 Cb 0.70 -0.65 0.49 0.00 -1.14 0.00 0.00 41.12 40.53 1dmo n ASP 20 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1dmo n LYS 21 N -0.05 1.11 0.08 0.11 4.81 -1.26 -3.88 118.16 119.08 1dmo n LYS 21 Ca 0.24 -0.59 0.03 0.00 -0.87 0.00 0.00 58.31 57.12 1dmo n LYS 21 Cb 0.97 -1.49 0.14 0.00 0.02 0.00 0.00 35.03 34.67 1dmo n LYS 21 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1dmo n ASP 22 N -0.43 0.13 0.00 3.14 -0.08 -1.26 -4.66 116.55 113.40 1dmo n ASP 22 Ca 0.15 0.36 0.00 0.00 -1.51 0.00 0.00 54.79 53.79 1dmo n ASP 22 Cb 0.33 -0.31 0.00 0.00 2.34 0.00 0.00 41.12 43.48 1dmo n ASP 22 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1dmo n GLY 23 N -1.25 1.03 0.00 0.27 0.00 -1.26 -4.88 105.19 99.11 1dmo n GLY 23 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1dmo n GLY 23 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dmo n ASP 24 N 1.14 0.00 0.00 1.61 8.00 -1.26 -5.03 116.55 121.00 1dmo n ASP 24 Ca 0.00 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1dmo n ASP 24 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1dmo n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dmo n GLY 25 N 0.00 2.18 3.77 0.44 0.00 -1.25 -4.98 105.19 105.36 1dmo n GLY 25 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 1dmo n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dmo s THR 26 N 0.00 3.20 0.09 2.61 -4.23 -1.26 -4.51 115.64 111.54 1dmo s THR 26 Ca 0.00 0.67 0.01 0.00 -1.18 0.00 0.00 61.69 61.19 1dmo s THR 26 Cb 0.00 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.58 1dmo s THR 26 CO 0.00 -0.24 0.22 0.27 -0.54 0.00 0.00 174.62 174.33 1dmo s ILE 27 N -1.99 5.28 0.22 2.99 -4.36 -0.29 -4.64 121.20 118.41 1dmo s ILE 27 Ca 0.70 -0.53 -0.22 0.00 -0.26 0.00 0.00 60.65 60.35 1dmo s ILE 27 Cb -0.23 -3.62 -0.08 0.00 1.25 0.00 0.00 42.46 39.78 1dmo s ILE 27 CO 0.32 0.06 0.76 0.42 0.24 0.00 0.00 174.94 176.75 1dmo s THR 28 N -1.58 4.48 0.49 8.37 -4.23 -1.26 0.06 115.64 121.96 1dmo s THR 28 Ca 0.34 1.45 0.43 0.00 -1.18 0.00 0.00 61.69 62.74 1dmo s THR 28 Cb -0.12 -3.95 0.64 0.00 1.34 0.00 0.00 72.50 70.41 1dmo s THR 28 CO 0.28 0.28 1.44 0.35 -0.54 0.00 0.00 174.62 176.43 1dmo n THR 29 N 0.94 -0.05 -0.07 3.99 -2.24 -1.26 0.16 114.28 115.74 1dmo n THR 29 Ca -0.03 1.44 -0.12 0.00 -2.27 0.00 0.00 64.05 63.07 1dmo n THR 29 Cb 0.50 -2.39 -0.06 0.00 -2.10 0.00 0.00 70.33 66.29 1dmo n THR 29 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1dmo h LYS 30 N 0.00 0.43 0.00 -0.78 2.10 -1.91 -2.54 116.57 113.86 1dmo h LYS 30 Ca 0.86 -0.18 0.00 0.00 -2.00 0.00 0.00 60.65 59.33 1dmo h LYS 30 Cb 3.31 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 34.63 1dmo h LYS 30 CO -0.10 0.71 0.00 0.39 -2.00 0.00 0.00 179.45 178.45 1dmo n GLU 31 N -4.56 0.02 0.03 0.07 4.71 0.41 -3.73 120.64 117.59 1dmo n GLU 31 Ca -0.05 0.21 -0.03 0.00 -0.01 0.00 0.00 57.16 57.28 1dmo n GLU 31 Cb 0.32 -1.50 -0.02 0.00 -1.01 0.00 0.00 31.44 29.23 1dmo n GLU 31 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1dmo h LEU 32 N 0.00 -0.29 -1.39 -4.62 5.85 -0.89 -1.09 115.31 112.89 1dmo h LEU 32 Ca 0.00 0.03 0.41 0.00 0.84 0.00 0.00 57.88 59.16 1dmo h LEU 32 Cb 0.27 0.11 -0.13 0.00 0.37 0.00 0.00 40.66 41.28 1dmo h LEU 32 CO 0.00 -0.11 0.82 1.23 -0.34 0.00 0.00 178.44 180.04 1dmo h GLY 33 N -0.15 1.33 1.34 3.75 0.00 -1.73 1.02 103.07 108.63 1dmo h GLY 33 Ca -0.00 -0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.09 1dmo h GLY 33 CO -0.05 -0.38 -0.21 -0.84 0.00 0.00 0.00 176.54 175.06 1dmo h THR 34 N 0.12 1.27 -0.07 4.70 2.02 -1.45 -1.76 112.91 117.74 1dmo h THR 34 Ca 0.79 -1.31 -0.23 0.00 0.77 0.00 0.00 66.41 66.42 1dmo h THR 34 Cb 2.42 1.20 0.01 0.00 -1.74 0.00 0.00 68.15 70.04 1dmo h THR 34 CO -0.41 0.44 -0.88 0.58 0.37 0.00 0.00 175.52 175.61 1dmo h VAL 35 N 0.67 1.31 0.00 3.16 2.07 0.22 -2.52 116.25 121.15 1dmo h VAL 35 Ca 0.09 -2.16 -0.03 0.00 0.82 0.00 0.00 66.70 65.43 1dmo h VAL 35 Cb 0.72 2.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1dmo h VAL 35 CO 0.05 0.67 -0.14 0.24 0.02 0.00 0.00 177.57 178.41 1dmo h MET 36 N 0.41 0.00 0.10 1.57 2.86 -0.96 -1.99 114.93 116.93 1dmo h MET 36 Ca -0.08 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.30 1dmo h MET 36 Cb 1.52 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.18 1dmo h MET 36 CO 0.17 0.14 -1.17 -0.09 1.06 0.00 0.00 176.91 177.02 1dmo h ARG 37 N 0.00 0.25 -0.36 1.72 2.43 -1.19 -3.20 114.38 114.02 1dmo h ARG 37 Ca -0.00 -0.39 -0.15 0.00 -0.81 0.00 0.00 59.98 58.63 1dmo h ARG 37 Cb 0.33 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1dmo h ARG 37 CO 0.02 1.17 -0.35 0.66 -1.51 0.00 0.00 179.97 179.96 1dmo h SER 38 N 0.08 0.94 -0.77 -3.80 4.64 -0.96 -3.10 113.55 110.58 1dmo h SER 38 Ca -0.11 -0.46 0.17 0.00 -0.47 0.00 0.00 61.79 60.91 1dmo h SER 38 Cb 1.89 -0.26 -0.11 0.00 -0.31 0.00 0.00 62.40 63.61 1dmo h SER 38 CO 0.19 1.21 0.23 -0.07 -0.87 0.00 0.00 176.83 177.52 1dmo h LEU 39 N 0.69 0.10 0.00 5.97 4.07 -1.47 -3.44 115.31 121.23 1dmo h LEU 39 Ca 0.06 0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.16 1dmo h LEU 39 Cb 0.94 0.17 0.00 0.00 1.08 0.00 0.00 40.66 42.85 1dmo h LEU 39 CO 0.09 -0.01 0.00 0.61 -1.08 0.00 0.00 178.44 178.05 1dmo n GLY 40 N -1.35 0.00 0.00 0.83 0.00 -1.17 -5.08 105.19 98.42 1dmo n GLY 40 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1dmo n GLY 40 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1dmo n GLN 41 N 0.00 0.00 -2.75 1.61 7.27 -1.21 -5.06 117.38 117.25 1dmo n GLN 41 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 57.00 57.01 1dmo n GLN 41 Cb 0.00 0.00 0.03 0.00 2.41 0.00 0.00 30.24 32.68 1dmo n GLN 41 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 1dmo n ASN 42 N -1.18 -3.01 -3.18 1.69 4.05 -1.26 -4.39 115.26 107.97 1dmo n ASN 42 Ca 0.00 -2.90 -0.20 0.00 0.45 0.00 0.00 54.58 51.93 1dmo n ASN 42 Cb 0.00 1.67 0.18 0.00 1.23 0.00 0.00 39.78 42.87 1dmo n ASN 42 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1dmo n PRO 43 N 2.32 -3.22 -4.75 1.20 -0.02 -1.26 -5.06 135.00 124.22 1dmo n PRO 43 Ca 0.13 -1.09 -0.28 0.00 -2.02 0.00 0.00 63.50 60.25 1dmo n PRO 43 Cb 0.60 -1.20 -0.14 0.00 -0.02 0.00 0.00 33.50 32.74 1dmo n PRO 43 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1dmo s THR 44 N -2.05 1.88 0.44 3.45 2.01 -1.26 -5.00 115.64 115.12 1dmo s THR 44 Ca 0.47 -1.29 0.29 0.00 0.31 0.00 0.00 61.69 61.46 1dmo s THR 44 Cb -0.06 -1.62 0.48 0.00 0.01 0.00 0.00 72.50 71.31 1dmo s THR 44 CO 0.37 0.27 1.67 -0.08 -0.69 0.00 0.00 174.62 176.17 1dmo h GLU 45 N 4.82 0.14 0.00 4.92 4.81 -1.98 0.23 114.58 127.52 1dmo h GLU 45 Ca -0.44 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1dmo h GLU 45 Cb 1.15 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1dmo h GLU 45 CO 0.44 0.09 0.00 0.00 -0.73 0.00 0.00 179.01 178.81 1dmo n ALA 46 N -2.55 -0.20 -0.31 2.92 0.00 -1.26 -2.12 120.51 116.99 1dmo n ALA 46 Ca 0.34 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.94 1dmo n ALA 46 Cb 1.32 0.00 0.34 0.00 0.00 0.00 0.00 19.45 21.11 1dmo n ALA 46 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1dmo h GLU 47 N 0.00 0.20 -0.73 0.00 4.22 -1.84 1.86 114.58 118.28 1dmo h GLU 47 Ca 0.00 -0.01 0.15 0.00 0.08 0.00 0.00 59.36 59.57 1dmo h GLU 47 Cb 0.00 -0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.11 1dmo h GLU 47 CO 0.00 0.13 0.25 1.25 -2.18 0.00 0.00 179.01 178.46 1dmo h LEU 48 N 0.20 0.18 -0.95 1.64 5.85 -0.63 0.20 115.31 121.81 1dmo h LEU 48 Ca 0.60 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 59.38 1dmo h LEU 48 Cb 1.28 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1dmo h LEU 48 CO -0.68 0.05 0.08 -0.61 -0.34 0.00 0.00 178.44 176.95 1dmo h GLN 49 N 0.37 0.85 0.00 1.25 4.15 0.34 -1.97 115.11 120.10 1dmo h GLN 49 Ca 0.41 -0.20 -0.00 0.00 0.77 0.00 0.00 58.65 59.62 1dmo h GLN 49 Cb 0.64 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.22 1dmo h GLN 49 CO -0.43 0.80 -0.02 -0.44 -1.93 0.00 0.00 178.83 176.80 1dmo h ASP 50 N 0.81 0.00 0.20 -0.69 3.32 0.72 -2.19 116.42 118.58 1dmo h ASP 50 Ca 0.17 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.94 1dmo h ASP 50 Cb 0.37 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.94 1dmo h ASP 50 CO 0.01 0.02 -1.26 0.24 -1.72 0.00 0.00 179.24 176.53 1dmo h MET 51 N 0.00 0.42 -0.23 3.56 2.86 -0.74 -3.34 114.93 117.45 1dmo h MET 51 Ca -0.00 -0.71 0.05 0.00 -2.06 0.00 0.00 59.70 56.98 1dmo h MET 51 Cb 0.06 0.26 -0.05 0.00 0.06 0.00 0.00 31.60 31.94 1dmo h MET 51 CO 0.00 1.34 -0.10 0.82 1.06 0.00 0.00 176.91 180.03 1dmo h ILE 52 N -0.09 0.67 -0.11 -1.22 5.03 -1.07 0.27 117.51 120.99 1dmo h ILE 52 Ca -0.23 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.54 1dmo h ILE 52 Cb 1.94 0.67 -0.00 0.00 -3.03 0.00 0.00 36.82 36.39 1dmo h ILE 52 CO 0.20 0.00 0.42 -1.13 -0.68 0.00 0.00 178.15 176.96 1dmo h ASN 53 N -0.07 0.00 0.00 1.72 -0.73 -1.61 0.15 115.58 115.04 1dmo h ASN 53 Ca 0.12 0.00 -0.14 0.00 1.87 0.00 0.00 56.30 58.15 1dmo h ASN 53 Cb 0.25 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.82 1dmo h ASN 53 CO -0.27 0.00 -0.83 -0.33 -0.37 0.00 0.00 177.43 175.63 1dmo h GLU 54 N 0.00 0.00 0.00 6.67 4.39 -1.08 -3.35 114.58 121.21 1dmo h GLU 54 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1dmo h GLU 54 Cb 0.89 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.54 1dmo h GLU 54 CO -0.00 0.81 0.00 1.33 -1.16 0.00 0.00 179.01 179.99 1dmo n VAL 55 N -4.51 0.00 0.02 3.13 0.24 -0.87 -3.60 118.33 112.73 1dmo n VAL 55 Ca -0.22 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 1dmo n VAL 55 Cb 0.55 -0.37 0.09 0.00 -1.47 0.00 0.00 33.84 32.63 1dmo n VAL 55 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1dmo n ASP 56 N -0.86 3.32 0.02 -1.34 2.03 0.47 -3.91 116.55 116.28 1dmo n ASP 56 Ca 0.17 -2.70 0.12 0.00 0.52 0.00 0.00 54.79 52.90 1dmo n ASP 56 Cb 0.08 -0.65 0.13 0.00 -0.72 0.00 0.00 41.12 39.96 1dmo n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dmo n ALA 57 N -0.20 3.42 -0.03 -1.67 0.00 -1.24 -4.18 120.51 116.60 1dmo n ALA 57 Ca 0.26 -0.36 -0.14 0.00 0.00 0.00 0.00 53.44 53.20 1dmo n ALA 57 Cb 1.01 -1.06 -0.11 0.00 0.00 0.00 0.00 19.45 19.28 1dmo n ALA 57 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1dmo h ASP 58 N 0.00 0.06 -0.61 0.00 3.58 -1.90 -3.49 116.42 114.06 1dmo h ASP 58 Ca 0.00 -0.69 0.00 0.00 0.42 0.00 0.00 57.03 56.76 1dmo h ASP 58 Cb 0.64 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1dmo h ASP 58 CO 0.00 0.74 0.00 0.61 -2.88 0.00 0.00 179.24 177.71 1dmo n GLY 59 N 0.79 0.70 0.00 -0.78 0.00 -1.26 -5.04 105.19 99.59 1dmo n GLY 59 Ca -0.09 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1dmo n GLY 59 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dmo n ASN 60 N -0.24 0.00 0.00 1.61 5.15 -1.26 -5.03 115.26 115.50 1dmo n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1dmo n ASN 60 Cb 0.10 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.35 1dmo n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dmo n GLY 61 N 0.26 0.69 3.48 8.20 0.00 -1.26 -5.05 105.19 111.50 1dmo n GLY 61 Ca 0.00 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1dmo n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dmo s THR 62 N -2.00 0.00 -0.07 2.61 -4.23 -1.26 -4.22 115.64 106.47 1dmo s THR 62 Ca 0.00 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 58.93 1dmo s THR 62 Cb 0.00 -2.36 0.02 0.00 1.34 0.00 0.00 72.50 71.50 1dmo s THR 62 CO 0.00 0.00 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.36 1dmo s ILE 63 N -3.88 0.93 0.78 2.99 1.01 0.11 -4.80 121.20 118.34 1dmo s ILE 63 Ca 0.28 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.51 1dmo s ILE 63 Cb 0.01 -0.90 0.07 0.00 0.01 0.00 0.00 42.46 41.65 1dmo s ILE 63 CO 0.12 0.32 1.14 -1.81 0.00 0.00 0.00 174.94 174.71 1dmo s ASP 64 N 1.07 4.59 0.19 3.58 1.01 -1.26 -1.14 116.67 124.71 1dmo s ASP 64 Ca -0.08 0.71 -0.12 0.00 0.71 0.00 0.00 52.55 53.77 1dmo s ASP 64 Cb -0.14 -1.24 0.12 0.00 1.01 0.00 0.00 42.92 42.67 1dmo s ASP 64 CO -0.01 -1.82 1.85 0.15 0.21 0.00 0.00 175.17 175.54 1dmo h PHE 65 N -0.94 0.75 0.63 4.23 3.57 -1.97 -1.84 116.94 121.37 1dmo h PHE 65 Ca -0.46 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.03 1dmo h PHE 65 Cb 1.33 -0.25 0.01 0.00 2.79 0.00 0.00 35.95 39.82 1dmo h PHE 65 CO 0.32 0.45 -0.30 -1.00 -2.23 0.00 0.00 178.31 175.55 1dmo h PRO 66 N 0.80 -0.82 -0.96 6.41 0.13 -2.00 -1.08 132.00 134.48 1dmo h PRO 66 Ca 0.24 0.06 0.25 0.00 -0.87 0.00 0.00 66.00 65.67 1dmo h PRO 66 Cb -0.04 0.19 -0.06 0.00 0.13 0.00 0.00 31.00 31.21 1dmo h PRO 66 CO -0.07 -0.53 0.65 0.93 -0.23 0.00 0.00 178.00 178.75 1dmo h GLU 67 N -0.90 0.24 -0.11 0.86 5.08 -1.92 0.87 114.58 118.70 1dmo h GLU 67 Ca -0.09 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.13 1dmo h GLU 67 Cb 0.67 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1dmo h GLU 67 CO 0.14 0.16 -0.50 0.35 -1.00 0.00 0.00 179.01 178.16 1dmo h PHE 68 N 0.25 0.37 -0.61 4.33 3.57 -0.60 -2.78 116.94 121.48 1dmo h PHE 68 Ca 0.50 -0.12 -0.04 0.00 3.53 0.00 0.00 57.97 61.84 1dmo h PHE 68 Cb 1.51 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 40.15 1dmo h PHE 68 CO -0.00 0.75 0.23 -0.07 -2.23 0.00 0.00 178.31 176.99 1dmo h LEU 69 N 0.24 0.85 0.58 0.59 3.38 0.20 0.12 115.31 121.27 1dmo h LEU 69 Ca 0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1dmo h LEU 69 Cb 0.97 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1dmo h LEU 69 CO 0.08 0.80 -0.50 0.74 0.09 0.00 0.00 178.44 179.65 1dmo h THR 70 N 0.85 0.02 -0.66 0.22 2.02 -1.17 0.54 112.91 114.73 1dmo h THR 70 Ca 0.20 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.42 1dmo h THR 70 Cb 0.22 0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.60 1dmo h THR 70 CO -0.01 0.00 0.40 0.24 0.37 0.00 0.00 175.52 176.52 1dmo h MET 71 N -1.06 0.75 -0.19 6.66 2.86 -1.40 -0.74 114.93 121.81 1dmo h MET 71 Ca -0.07 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1dmo h MET 71 Cb 0.90 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 1dmo h MET 71 CO -0.02 0.50 0.06 1.98 1.06 0.00 0.00 176.91 180.49 1dmo h MET 72 N 0.77 0.26 -0.50 1.72 -1.53 -0.38 -2.23 114.93 113.04 1dmo h MET 72 Ca 0.27 -0.03 -0.02 0.00 -3.44 0.00 0.00 59.70 56.49 1dmo h MET 72 Cb 0.07 -0.05 -0.02 0.00 -0.55 0.00 0.00 31.60 31.04 1dmo h MET 72 CO -0.13 0.23 0.23 0.00 0.14 0.00 0.00 176.91 177.38 1dmo h ALA 73 N 1.81 0.64 -0.76 0.39 0.00 0.16 -2.48 119.26 119.02 1dmo h ALA 73 Ca 0.07 -0.13 0.18 0.00 0.00 0.00 0.00 54.91 55.02 1dmo h ALA 73 Cb 0.08 -0.20 -0.13 0.00 0.00 0.00 0.00 17.79 17.54 1dmo h ALA 73 CO -0.01 0.22 0.02 -0.09 0.00 0.00 0.00 179.25 179.40 1dmo h ARG 74 N 0.66 0.11 0.00 0.00 9.65 -1.11 2.06 114.38 125.75 1dmo h ARG 74 Ca 0.17 -0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 59.01 1dmo h ARG 74 Cb 0.14 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1dmo h ARG 74 CO -0.02 0.07 -0.18 0.87 2.80 0.00 0.00 179.97 183.52 1dmo h LYS 75 N 0.11 0.00 0.00 0.20 1.79 -1.50 -0.46 116.57 116.71 1dmo h LYS 75 Ca 0.42 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.89 1dmo h LYS 75 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1dmo h LYS 75 CO -0.66 0.18 -0.12 1.98 -1.08 0.00 0.00 179.45 179.74 1dmo h MET 76 N 0.00 0.00 -0.12 3.15 4.05 0.33 -3.07 114.93 119.26 1dmo h MET 76 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1dmo h MET 76 Cb 0.34 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1dmo h MET 76 CO 0.02 0.00 0.00 1.63 0.23 0.00 0.00 176.91 178.79 1dmo n LYS 77 N -2.63 1.48 -2.99 0.39 5.02 0.27 -4.09 118.16 115.61 1dmo n LYS 77 Ca 0.04 -0.72 -0.16 0.00 -2.02 0.00 0.00 58.31 55.45 1dmo n LYS 77 Cb 0.48 -1.33 -0.01 0.00 -0.02 0.00 0.00 35.03 34.16 1dmo n LYS 77 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1dmo n ASP 78 N -0.04 -1.09 -3.63 4.39 2.03 -1.16 -4.86 116.55 112.19 1dmo n ASP 78 Ca 0.14 -3.06 0.00 0.00 0.52 0.00 0.00 54.79 52.39 1dmo n ASP 78 Cb 0.23 0.51 0.00 0.00 -0.72 0.00 0.00 41.12 41.14 1dmo n ASP 78 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1dmo n THR 79 N 1.23 0.00 -1.20 5.18 -2.24 -1.25 -4.91 114.28 111.09 1dmo n THR 79 Ca 0.16 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.85 1dmo n THR 79 Cb 0.60 -0.63 0.24 0.00 -2.10 0.00 0.00 70.33 68.44 1dmo n THR 79 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1dmo n ASP 80 N 0.00 3.83 0.00 3.42 2.03 -1.26 -4.89 116.55 119.68 1dmo n ASP 80 Ca 0.00 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 51.86 1dmo n ASP 80 Cb 0.00 -0.72 0.00 0.00 -0.72 0.00 0.00 41.12 39.68 1dmo n ASP 80 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1dmo n SER 81 N -0.72 0.00 0.28 1.67 7.64 -1.26 -4.65 113.62 116.58 1dmo n SER 81 Ca 0.42 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.45 1dmo n SER 81 Cb 1.32 -1.64 0.84 0.00 -1.01 0.00 0.00 64.21 63.72 1dmo n SER 81 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1dmo h GLU 82 N 0.00 0.00 0.10 1.43 5.08 -1.93 -2.65 114.58 116.61 1dmo h GLU 82 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1dmo h GLU 82 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1dmo h GLU 82 CO 0.00 0.07 -0.05 1.05 -1.00 0.00 0.00 179.01 179.08 1dmo h GLU 83 N 0.00 -0.13 -0.78 2.33 4.11 -1.99 -2.30 114.58 115.82 1dmo h GLU 83 Ca -0.00 0.01 0.19 0.00 0.07 0.00 0.00 59.36 59.63 1dmo h GLU 83 Cb 0.21 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.45 1dmo h GLU 83 CO 0.01 0.38 0.53 0.93 0.07 0.00 0.00 179.01 180.93 1dmo h GLU 84 N -0.83 0.22 0.40 1.06 5.08 -1.89 -2.22 114.58 116.40 1dmo h GLU 84 Ca -0.01 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1dmo h GLU 84 Cb 0.57 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1dmo h GLU 84 CO 0.02 0.15 -0.19 0.82 -1.00 0.00 0.00 179.01 178.81 1dmo h ILE 85 N 0.23 0.19 -1.20 3.13 2.04 -1.46 -2.51 117.51 117.94 1dmo h ILE 85 Ca 0.38 -0.64 0.38 0.00 1.00 0.00 0.00 64.86 65.98 1dmo h ILE 85 Cb 1.16 0.30 -0.12 0.00 -0.74 0.00 0.00 36.82 37.42 1dmo h ILE 85 CO -0.09 0.04 0.76 -0.09 0.00 0.00 0.00 178.15 178.77 1dmo h ARG 86 N -1.09 0.18 0.20 2.37 2.43 -0.84 0.23 114.38 117.85 1dmo h ARG 86 Ca -0.06 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1dmo h ARG 86 Cb 0.48 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1dmo h ARG 86 CO 0.09 0.12 -0.09 1.49 -1.51 0.00 0.00 179.97 180.07 1dmo h GLU 87 N 0.19 -0.25 -1.50 0.20 4.81 -1.40 -1.52 114.58 115.10 1dmo h GLU 87 Ca 0.76 0.02 0.44 0.00 -0.13 0.00 0.00 59.36 60.44 1dmo h GLU 87 Cb 2.18 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 31.56 1dmo h GLU 87 CO -0.43 0.11 1.19 0.00 -0.73 0.00 0.00 179.01 179.15 1dmo h ALA 88 N -0.02 3.41 0.08 2.92 0.00 -0.10 0.65 119.26 126.20 1dmo h ALA 88 Ca -0.03 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1dmo h ALA 88 Cb 0.48 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1dmo h ALA 88 CO 0.04 -1.97 -1.10 0.74 0.00 0.00 0.00 179.25 176.97 1dmo h PHE 89 N 0.00 0.29 -0.59 0.00 0.04 -1.17 -3.30 116.94 112.21 1dmo h PHE 89 Ca 0.71 -0.21 0.17 0.00 2.80 0.00 0.00 57.97 61.44 1dmo h PHE 89 Cb 3.09 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 41.20 1dmo h PHE 89 CO 0.00 1.43 0.58 -0.09 -0.60 0.00 0.00 178.31 179.63 1dmo h ARG 90 N -0.56 0.00 0.00 1.51 2.43 0.13 0.24 114.38 118.13 1dmo h ARG 90 Ca -0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1dmo h ARG 90 Cb 1.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.08 1dmo h ARG 90 CO 0.00 0.00 0.00 0.28 -1.51 0.00 0.00 179.97 178.74 1dmo n VAL 91 N -3.76 0.00 0.00 0.20 0.31 -0.52 -1.02 118.33 113.55 1dmo n VAL 91 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1dmo n VAL 91 Cb 0.81 -0.89 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 1dmo n VAL 91 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1dmo n PHE 92 N -0.82 0.00 -3.73 3.52 3.72 0.84 -5.08 117.46 115.91 1dmo n PHE 92 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 1dmo n PHE 92 Cb 0.00 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.43 1dmo n PHE 92 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1dmo s ASP 93 N -0.18 -0.40 0.00 4.37 2.15 -0.19 -4.94 116.67 117.49 1dmo s ASP 93 Ca 0.00 0.73 0.00 0.00 0.43 0.00 0.00 52.55 53.71 1dmo s ASP 93 Cb 0.00 0.67 0.00 0.00 -0.30 0.00 0.00 42.92 43.29 1dmo s ASP 93 CO 0.00 -0.16 0.00 2.29 -0.17 0.00 0.00 175.17 177.13 1dmo n LYS 94 N 3.67 0.00 -0.09 4.34 2.85 -1.26 -4.36 118.16 123.31 1dmo n LYS 94 Ca -0.19 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 56.97 1dmo n LYS 94 Cb 0.56 0.00 -0.16 0.00 -0.65 0.00 0.00 35.03 34.78 1dmo n LYS 94 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1dmo n ASP 95 N 0.00 0.06 0.00 -5.58 5.68 -1.26 -4.79 116.55 110.66 1dmo n ASP 95 Ca 0.00 0.03 0.00 0.00 -0.50 0.00 0.00 54.79 54.32 1dmo n ASP 95 Cb 0.00 0.94 0.00 0.00 -1.14 0.00 0.00 41.12 40.92 1dmo n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dmo n GLY 96 N 1.73 -0.91 0.15 6.12 0.00 -1.26 -4.96 105.19 106.06 1dmo n GLY 96 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1dmo n GLY 96 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dmo n ASN 97 N 0.00 0.00 0.00 1.61 5.15 -1.26 -4.99 115.26 115.77 1dmo n ASN 97 Ca 0.00 -0.51 0.00 0.00 -0.60 0.00 0.00 54.58 53.47 1dmo n ASN 97 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1dmo n ASN 97 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dmo n GLY 98 N 0.00 1.02 3.00 8.20 0.00 -1.26 -5.11 105.19 111.04 1dmo n GLY 98 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1dmo n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dmo s TYR 99 N -2.00 1.01 0.26 1.61 2.02 -1.26 -3.52 117.35 115.47 1dmo s TYR 99 Ca 0.00 -0.27 0.06 0.00 -0.37 0.00 0.00 57.07 56.49 1dmo s TYR 99 Cb 0.00 -0.73 -0.06 0.00 -0.40 0.00 0.00 41.96 40.78 1dmo s TYR 99 CO 0.00 -0.12 -0.04 0.96 -1.57 0.00 0.00 175.55 174.77 1dmo s ILE 100 N 0.28 1.43 0.08 2.71 -4.36 -0.35 -4.70 121.20 116.31 1dmo s ILE 100 Ca -0.05 -2.09 -0.30 0.00 -0.26 0.00 0.00 60.65 57.95 1dmo s ILE 100 Cb -0.10 -2.39 -0.05 0.00 1.25 0.00 0.00 42.46 41.17 1dmo s ILE 100 CO 0.01 -0.33 1.02 -0.44 0.24 0.00 0.00 174.94 175.45 1dmo s SER 101 N -3.39 7.36 0.66 4.36 0.01 -1.26 0.45 113.70 121.89 1dmo s SER 101 Ca 0.29 1.84 0.32 0.00 1.31 0.00 0.00 55.95 59.71 1dmo s SER 101 Cb 0.04 -2.58 1.74 0.00 0.21 0.00 0.00 66.02 65.43 1dmo s SER 101 CO 0.10 -0.21 1.99 0.00 0.41 0.00 0.00 173.24 175.54 1dmo h ALA 102 N 6.01 1.35 0.18 1.44 0.00 -1.80 -1.62 119.26 124.83 1dmo h ALA 102 Ca -0.42 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1dmo h ALA 102 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1dmo h ALA 102 CO 0.74 -0.31 -0.09 0.00 0.00 0.00 0.00 179.25 179.60 1dmo h ALA 103 N 1.45 -0.56 -0.46 0.00 0.00 -1.90 -1.91 119.26 115.88 1dmo h ALA 103 Ca 0.02 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1dmo h ALA 103 Cb 0.59 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1dmo h ALA 103 CO -0.00 -0.54 0.47 0.93 0.00 0.00 0.00 179.25 180.11 1dmo h GLU 104 N -0.42 0.00 0.15 0.00 5.08 -1.85 0.08 114.58 117.62 1dmo h GLU 104 Ca -0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1dmo h GLU 104 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1dmo h GLU 104 CO 0.04 0.00 -0.07 1.25 -1.00 0.00 0.00 179.01 179.23 1dmo h LEU 105 N 0.00 -0.18 -2.00 1.33 6.46 -1.23 -0.38 115.31 119.31 1dmo h LEU 105 Ca 0.22 -0.26 0.30 0.00 -0.12 0.00 0.00 57.88 58.02 1dmo h LEU 105 Cb 1.17 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 41.10 1dmo h LEU 105 CO -0.00 0.18 0.74 -0.09 -0.62 0.00 0.00 178.44 178.64 1dmo h ARG 106 N -0.55 0.00 0.00 1.25 2.43 -0.14 1.64 114.38 119.01 1dmo h ARG 106 Ca -0.02 -0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.95 1dmo h ARG 106 Cb 0.42 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1dmo h ARG 106 CO 0.03 0.00 -0.88 1.25 -1.51 0.00 0.00 179.97 178.87 1dmo h HIS 107 N 0.00 0.29 -0.02 2.20 2.76 -1.13 -2.75 115.15 116.49 1dmo h HIS 107 Ca 0.49 -0.16 -0.00 0.00 -2.20 0.00 0.00 60.37 58.49 1dmo h HIS 107 Cb 1.95 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 30.88 1dmo h HIS 107 CO -0.00 0.97 0.00 0.28 -1.30 0.00 0.00 177.93 177.89 1dmo h VAL 108 N 0.11 1.20 -0.41 5.26 2.07 0.40 -2.46 116.25 122.42 1dmo h VAL 108 Ca -0.04 -0.59 0.03 0.00 0.82 0.00 0.00 66.70 66.92 1dmo h VAL 108 Cb 1.51 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1dmo h VAL 108 CO 0.13 0.16 0.27 0.24 0.02 0.00 0.00 177.57 178.39 1dmo h MET 109 N -0.20 0.42 -0.98 1.57 2.07 -1.18 0.31 114.93 116.94 1dmo h MET 109 Ca 0.01 -0.03 0.01 0.00 -2.07 0.00 0.00 59.70 57.62 1dmo h MET 109 Cb 0.25 -0.09 -0.05 0.00 -1.87 0.00 0.00 31.60 29.84 1dmo h MET 109 CO 0.00 0.28 0.65 1.15 1.07 0.00 0.00 176.91 180.05 1dmo h THR 110 N 0.43 1.25 0.62 2.22 2.02 -1.14 0.39 112.91 118.70 1dmo h THR 110 Ca 0.16 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 1dmo h THR 110 Cb 0.13 -0.19 0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1dmo h THR 110 CO -0.04 0.24 -0.30 0.78 0.37 0.00 0.00 175.52 176.57 1dmo h ASN 111 N 1.32 -0.71 -0.36 4.18 4.21 -0.52 -3.25 115.58 120.44 1dmo h ASN 111 Ca 0.36 0.02 0.07 0.00 1.21 0.00 0.00 56.30 57.96 1dmo h ASN 111 Cb -0.15 0.18 -0.09 0.00 -1.12 0.00 0.00 38.32 37.15 1dmo h ASN 111 CO -0.08 -0.37 -0.38 -0.07 -1.29 0.00 0.00 177.43 175.24 1dmo h LEU 112 N -1.12 -1.26 -3.88 1.61 3.38 -1.31 -3.45 115.31 109.27 1dmo h LEU 112 Ca -0.09 0.20 -0.58 0.00 0.09 0.00 0.00 57.88 57.51 1dmo h LEU 112 Cb 0.64 0.56 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1dmo h LEU 112 CO 0.14 -0.36 -1.02 0.61 0.09 0.00 0.00 178.44 177.90 1dmo n GLY 113 N -1.42 -0.92 0.00 0.83 0.00 0.12 -4.92 105.19 98.88 1dmo n GLY 113 Ca -0.00 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1dmo n GLY 113 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1dmo n GLU 114 N -4.65 0.00 -0.28 1.61 2.13 -1.26 -4.85 120.64 113.34 1dmo n GLU 114 Ca -0.14 0.05 0.05 0.00 0.66 0.00 0.00 57.16 57.78 1dmo n GLU 114 Cb 0.58 -0.31 0.07 0.00 0.27 0.00 0.00 31.44 32.06 1dmo n GLU 114 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1dmo n LYS 115 N -1.50 0.67 -3.95 5.31 4.01 -1.26 -5.07 118.16 116.37 1dmo n LYS 115 Ca 0.00 -1.83 -0.21 0.00 -0.51 0.00 0.00 58.31 55.76 1dmo n LYS 115 Cb 0.00 -1.02 -0.03 0.00 -0.51 0.00 0.00 35.03 33.47 1dmo n LYS 115 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1dmo s LEU 116 N -1.50 3.95 -0.00 -0.35 1.43 -1.26 -5.12 118.68 115.83 1dmo s LEU 116 Ca 0.17 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 1dmo s LEU 116 Cb 0.15 -2.53 -0.00 0.00 0.03 0.00 0.00 46.19 43.83 1dmo s LEU 116 CO 0.01 -0.14 -0.04 0.42 0.23 0.00 0.00 176.35 176.83 1dmo s THR 117 N -2.12 0.30 0.56 5.49 -4.23 -1.26 -4.95 115.64 109.44 1dmo s THR 117 Ca 0.36 -0.17 0.49 0.00 -1.18 0.00 0.00 61.69 61.18 1dmo s THR 117 Cb -0.08 -0.26 0.72 0.00 1.34 0.00 0.00 72.50 74.22 1dmo s THR 117 CO 0.27 0.08 1.57 0.44 -0.54 0.00 0.00 174.62 176.45 1dmo h ASP 118 N 6.04 0.00 -0.06 3.99 5.19 -1.99 0.97 116.42 130.56 1dmo h ASP 118 Ca -0.27 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.00 1dmo h ASP 118 Cb 1.20 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.72 1dmo h ASP 118 CO 0.50 0.00 -0.53 -0.33 -3.12 0.00 0.00 179.24 175.76 1dmo h GLU 119 N 0.00 0.46 -0.20 3.56 3.07 -1.99 -2.09 114.58 117.38 1dmo h GLU 119 Ca 0.90 -0.42 -0.19 0.00 -0.50 0.00 0.00 59.36 59.14 1dmo h GLU 119 Cb 3.65 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 31.66 1dmo h GLU 119 CO -0.01 1.06 -0.64 1.49 -1.40 0.00 0.00 179.01 179.51 1dmo h GLU 120 N 0.00 0.73 -0.06 2.33 4.57 0.39 -2.72 114.58 119.83 1dmo h GLU 120 Ca -0.05 -0.52 -0.04 0.00 -1.18 0.00 0.00 59.36 57.57 1dmo h GLU 120 Cb 1.20 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.87 1dmo h GLU 120 CO 0.11 1.14 -0.16 0.28 -1.18 0.00 0.00 179.01 179.20 1dmo h VAL 121 N 0.54 1.15 -0.13 0.32 2.07 -0.68 -2.09 116.25 117.43 1dmo h VAL 121 Ca -0.01 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 1dmo h VAL 121 Cb 1.24 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1dmo h VAL 121 CO 0.13 0.21 -0.17 -0.78 0.02 0.00 0.00 177.57 176.98 1dmo h ASP 122 N 0.10 0.37 -0.07 0.57 1.82 -1.19 0.89 116.42 118.89 1dmo h ASP 122 Ca 0.02 -0.51 -0.00 0.00 -0.39 0.00 0.00 57.03 56.15 1dmo h ASP 122 Cb 0.34 -0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.24 1dmo h ASP 122 CO 0.02 0.81 0.04 -0.08 -1.61 0.00 0.00 179.24 178.42 1dmo h GLU 123 N -0.06 0.12 0.00 0.28 4.22 -1.17 -1.26 114.58 116.71 1dmo h GLU 123 Ca 0.02 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.45 1dmo h GLU 123 Cb 0.72 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1dmo h GLU 123 CO 0.04 0.10 -0.00 0.52 -2.18 0.00 0.00 179.01 177.49 1dmo h MET 124 N 0.12 -0.00 -0.07 1.92 2.86 -1.23 -3.25 114.93 115.28 1dmo h MET 124 Ca 0.03 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1dmo h MET 124 Cb 0.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1dmo h MET 124 CO -0.00 0.89 0.18 0.82 1.06 0.00 0.00 176.91 179.85 1dmo h ILE 125 N -0.97 0.17 0.00 -1.22 2.04 -0.58 0.34 117.51 117.30 1dmo h ILE 125 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1dmo h ILE 125 Cb 0.89 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1dmo h ILE 125 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 178.15 178.06 1dmo h ARG 126 N 0.00 0.00 -0.26 2.37 2.43 -1.27 -3.30 114.38 114.35 1dmo h ARG 126 Ca 0.03 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.98 1dmo h ARG 126 Cb 0.38 0.00 -0.39 0.00 -0.42 0.00 0.00 29.97 29.54 1dmo h ARG 126 CO -0.00 0.00 -1.07 -1.91 -1.51 0.00 0.00 179.97 175.48 1dmo n GLU 127 N -2.68 1.07 -0.69 0.20 2.13 0.98 -4.92 120.64 116.73 1dmo n GLU 127 Ca 0.04 -2.91 -0.06 0.00 0.66 0.00 0.00 57.16 54.90 1dmo n GLU 127 Cb 0.42 -0.97 -0.08 0.00 0.27 0.00 0.00 31.44 31.08 1dmo n GLU 127 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1dmo n ALA 128 N -0.16 4.89 -3.75 4.31 0.00 0.11 -4.64 120.51 121.27 1dmo n ALA 128 Ca 0.08 -0.84 -0.25 0.00 0.00 0.00 0.00 53.44 52.42 1dmo n ALA 128 Cb 0.94 -1.69 0.04 0.00 0.00 0.00 0.00 19.45 18.74 1dmo n ALA 128 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1dmo n ASN 129 N 2.04 -3.57 -4.94 0.00 5.15 -1.26 -4.58 115.26 108.09 1dmo n ASN 129 Ca 0.20 -0.74 -0.24 0.00 -0.60 0.00 0.00 54.58 53.20 1dmo n ASN 129 Cb 0.66 -4.25 -0.00 0.00 -0.53 0.00 0.00 39.78 35.65 1dmo n ASN 129 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1dmo s ILE 130 N -3.44 4.60 0.00 -1.44 1.01 -1.26 -4.80 121.20 115.88 1dmo s ILE 130 Ca 0.36 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.59 1dmo s ILE 130 Cb -0.18 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.60 1dmo s ILE 130 CO 0.80 -0.48 0.00 -0.90 0.00 0.00 0.00 174.94 174.35 1dmo n ASP 131 N -1.95 0.00 0.00 3.58 5.68 -1.26 -5.09 116.55 117.50 1dmo n ASP 131 Ca -0.02 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.27 1dmo n ASP 131 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 1dmo n ASP 131 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dmo n GLY 132 N 0.00 0.57 0.23 6.12 0.00 -1.26 -4.88 105.19 105.96 1dmo n GLY 132 Ca 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 1dmo n GLY 132 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1dmo h ASP 133 N 0.00 -0.42 0.00 1.61 1.82 -2.06 -3.47 116.42 113.90 1dmo h ASP 133 Ca 0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1dmo h ASP 133 Cb 0.00 0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.12 1dmo h ASP 133 CO 0.00 -0.02 0.00 0.61 -1.61 0.00 0.00 179.24 178.22 1dmo n GLY 134 N 0.46 0.00 3.22 -0.78 0.00 -1.26 -5.15 105.19 101.67 1dmo n GLY 134 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 1dmo n GLY 134 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dmo n GLN 135 N 0.00 -0.91 -3.35 1.61 1.13 -1.26 -3.20 117.38 111.40 1dmo n GLN 135 Ca 0.00 -1.80 -0.02 0.00 -1.94 0.00 0.00 57.00 53.24 1dmo n GLN 135 Cb 0.00 -1.05 -0.04 0.00 0.11 0.00 0.00 30.24 29.26 1dmo n GLN 135 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1dmo s VAL 136 N -3.28 -0.86 -0.92 5.09 1.01 0.17 -4.59 120.40 117.02 1dmo s VAL 136 Ca 0.62 0.00 -0.24 0.00 0.00 0.00 0.00 61.98 62.35 1dmo s VAL 136 Cb -0.02 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1dmo s VAL 136 CO 0.43 -0.02 1.96 0.21 0.00 0.00 0.00 175.10 177.68 1dmo s ASN 137 N 2.76 5.08 0.40 3.32 2.47 -1.26 -1.21 114.94 126.49 1dmo s ASN 137 Ca 0.11 -0.72 0.19 0.00 0.42 0.00 0.00 52.86 52.87 1dmo s ASN 137 Cb -0.14 -2.56 1.13 0.00 -1.45 0.00 0.00 41.25 38.23 1dmo s ASN 137 CO -0.18 -2.82 1.75 0.10 -3.72 0.00 0.00 177.10 172.22 1dmo h TYR 138 N 11.23 0.67 -0.47 0.43 -0.00 -1.91 0.06 116.97 126.98 1dmo h TYR 138 Ca 0.10 0.02 0.10 0.00 0.00 0.00 0.00 58.73 58.95 1dmo h TYR 138 Cb 1.00 -0.19 -0.09 0.00 0.00 0.00 0.00 36.73 37.45 1dmo h TYR 138 CO 1.22 0.02 -0.14 0.93 -0.00 0.00 0.00 178.16 180.18 1dmo h GLU 139 N 0.36 -0.03 -0.01 0.10 5.08 -1.86 1.01 114.58 119.24 1dmo h GLU 139 Ca 0.63 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.94 1dmo h GLU 139 Cb 1.62 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.87 1dmo h GLU 139 CO -0.33 -0.02 -0.24 0.93 -1.00 0.00 0.00 179.01 178.35 1dmo h GLU 140 N -0.03 0.02 0.00 2.33 4.39 -1.37 -1.19 114.58 118.73 1dmo h GLU 140 Ca 0.23 -0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.85 1dmo h GLU 140 Cb 0.38 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1dmo h GLU 140 CO -0.50 0.26 -0.33 0.35 -1.16 0.00 0.00 179.01 177.63 1dmo h PHE 141 N 0.02 0.00 0.00 4.33 3.04 0.35 -2.16 116.94 122.52 1dmo h PHE 141 Ca 0.00 0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.80 1dmo h PHE 141 Cb 0.43 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.92 1dmo h PHE 141 CO 0.00 0.33 -0.71 0.28 -2.02 0.00 0.00 178.31 176.19 1dmo h VAL 142 N 0.00 1.51 0.07 1.41 2.07 0.20 -2.58 116.25 118.92 1dmo h VAL 142 Ca -0.00 -2.43 -0.17 0.00 0.82 0.00 0.00 66.70 64.92 1dmo h VAL 142 Cb 0.96 2.31 -0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1dmo h VAL 142 CO 0.04 0.69 -0.83 1.56 0.02 0.00 0.00 177.57 179.06 1dmo h GLN 143 N 0.00 0.14 0.00 1.57 4.20 -1.33 -3.28 115.11 116.41 1dmo h GLN 143 Ca -0.01 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.47 1dmo h GLN 143 Cb 1.25 0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.12 1dmo h GLN 143 CO 0.09 1.11 0.00 -0.12 -0.67 0.00 0.00 178.83 179.24 1dmo n MET 144 N -4.27 0.00 0.18 1.46 1.56 -0.83 -1.48 117.12 113.75 1dmo n MET 144 Ca -0.19 0.35 0.07 0.00 -0.27 0.00 0.00 57.70 57.66 1dmo n MET 144 Cb 0.72 -1.51 0.13 0.00 2.15 0.00 0.00 33.22 34.71 1dmo n MET 144 CO 0.00 0.00 0.00 0.52 -0.73 0.00 0.00 175.97 175.76 1dmo h MET 145 N 0.00 0.00 0.00 2.12 2.86 -1.52 -3.38 114.93 115.02 1dmo h MET 145 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1dmo h MET 145 Cb 0.15 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 1dmo h MET 145 CO 0.00 0.26 -0.81 2.41 1.06 0.00 0.00 176.91 179.83 1dmo n THR 146 N -3.18 1.47 -2.67 2.22 -1.04 -0.55 -5.00 114.28 105.54 1dmo n THR 146 Ca 0.03 0.17 -0.23 0.00 -2.04 0.00 0.00 64.05 61.98 1dmo n THR 146 Cb 0.62 -2.37 0.03 0.00 -1.82 0.00 0.00 70.33 66.79 1dmo n THR 146 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dmo s ALA 147 N -2.84 3.67 -2.89 2.41 0.00 -1.06 -5.16 121.76 115.90 1dmo s ALA 147 Ca -0.23 -1.09 0.23 0.00 0.00 0.00 0.00 51.96 50.87 1dmo s ALA 147 Cb 0.03 -2.24 0.18 0.00 0.00 0.00 0.00 23.12 21.10 1dmo s ALA 147 CO 0.35 -0.69 1.23 1.63 0.00 0.00 0.00 175.76 178.27