#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 -4.79 0.00 -0.08 -1.26 -4.93 116.55 105.49 1dmo n ASP 2 Ca 0.00 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.99 1dmo n ASP 2 Cb 0.00 0.00 0.13 0.00 2.34 0.00 0.00 41.12 43.59 1dmo n ASP 2 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1dmo s GLN 3 N -0.37 1.26 -1.26 -0.67 -2.07 -1.26 -4.89 119.66 110.39 1dmo s GLN 3 Ca 0.00 0.33 -0.19 0.00 -1.82 0.00 0.00 55.36 53.69 1dmo s GLN 3 Cb 0.00 -1.85 0.01 0.00 -1.09 0.00 0.00 33.01 30.08 1dmo s GLN 3 CO 0.00 -2.13 1.88 1.28 -1.32 0.00 0.00 175.29 175.00 1dmo n LEU 4 N -3.73 4.75 -4.41 2.60 4.77 -1.26 -4.96 117.00 114.77 1dmo n LEU 4 Ca 0.07 -3.71 -0.30 0.00 -0.03 0.00 0.00 56.01 52.04 1dmo n LEU 4 Cb 0.59 -1.69 0.27 0.00 -2.33 0.00 0.00 43.42 40.26 1dmo n LEU 4 CO 0.57 -0.19 0.49 0.28 -1.33 0.00 0.00 177.39 177.20 1dmo s THR 5 N 5.70 1.37 0.10 -5.08 -1.32 -1.26 -4.63 115.64 110.53 1dmo s THR 5 Ca 0.56 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.79 1dmo s THR 5 Cb 0.05 -2.21 -0.11 0.00 -1.51 0.00 0.00 72.50 68.72 1dmo s THR 5 CO 0.07 0.00 1.67 -0.33 -2.21 0.00 0.00 174.62 173.82 1dmo h GLU 6 N -3.11 -0.35 -0.58 7.08 5.08 -1.99 -0.98 114.58 119.73 1dmo h GLU 6 Ca -0.45 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.02 1dmo h GLU 6 Cb 1.32 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.58 1dmo h GLU 6 CO 0.31 -0.23 0.20 0.93 -1.00 0.00 0.00 179.01 179.22 1dmo h GLU 7 N -0.36 0.37 -0.99 2.33 4.39 -1.99 0.33 114.58 118.65 1dmo h GLU 7 Ca 0.01 -0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.78 1dmo h GLU 7 Cb 0.36 -0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 28.86 1dmo h GLU 7 CO -0.07 0.24 0.64 1.96 -1.16 0.00 0.00 179.01 180.62 1dmo h GLN 8 N 0.38 1.05 -0.00 2.33 1.08 -1.77 0.21 115.11 118.38 1dmo h GLN 8 Ca 0.29 -0.06 -0.12 0.00 -1.45 0.00 0.00 58.65 57.31 1dmo h GLN 8 Cb 0.35 -0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1dmo h GLN 8 CO -0.30 0.69 -0.55 0.82 -0.95 0.00 0.00 178.83 178.54 1dmo h ILE 9 N 1.08 1.40 -0.16 2.54 2.04 0.54 -1.48 117.51 123.46 1dmo h ILE 9 Ca 0.46 -1.90 -0.07 0.00 1.00 0.00 0.00 64.86 64.34 1dmo h ILE 9 Cb 0.32 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 38.42 1dmo h ILE 9 CO -0.21 0.54 -0.19 0.00 0.00 0.00 0.00 178.15 178.30 1dmo h ALA 10 N 1.44 0.24 -0.17 1.87 0.00 0.24 -0.89 119.26 122.00 1dmo h ALA 10 Ca -0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1dmo h ALA 10 Cb 0.98 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1dmo h ALA 10 CO 0.07 0.17 -0.15 0.93 0.00 0.00 0.00 179.25 180.27 1dmo h GLU 11 N 0.06 0.27 0.50 0.00 4.39 -0.75 -1.57 114.58 117.48 1dmo h GLU 11 Ca 0.02 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1dmo h GLU 11 Cb 0.74 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1dmo h GLU 11 CO 0.05 0.43 -0.24 0.74 -1.16 0.00 0.00 179.01 178.82 1dmo h PHE 12 N 0.25 -0.63 -0.66 4.33 -1.00 -1.06 -2.73 116.94 115.45 1dmo h PHE 12 Ca 0.05 -0.01 0.15 0.00 2.81 0.00 0.00 57.97 60.96 1dmo h PHE 12 Cb 0.43 0.21 -0.04 0.00 3.61 0.00 0.00 35.95 40.15 1dmo h PHE 12 CO 0.01 -0.30 0.45 -0.22 -1.61 0.00 0.00 178.31 176.64 1dmo h LYS 13 N -0.95 0.25 -0.02 1.51 3.64 -1.00 0.15 116.57 120.15 1dmo h LYS 13 Ca -0.07 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1dmo h LYS 13 Cb 0.61 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1dmo h LYS 13 CO 0.11 0.17 -0.11 1.49 -2.27 0.00 0.00 179.45 178.84 1dmo h GLU 14 N 0.26 -0.17 0.00 1.90 4.57 -1.00 0.80 114.58 120.94 1dmo h GLU 14 Ca 0.32 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.51 1dmo h GLU 14 Cb 0.89 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 1dmo h GLU 14 CO -0.07 -0.11 -0.00 0.00 -1.18 0.00 0.00 179.01 177.64 1dmo h ALA 15 N 0.81 -0.01 -0.49 2.92 0.00 -0.82 -0.67 119.26 121.01 1dmo h ALA 15 Ca 0.05 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.93 1dmo h ALA 15 Cb 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1dmo h ALA 15 CO -0.13 -0.33 0.44 0.35 0.00 0.00 0.00 179.25 179.59 1dmo h PHE 16 N -0.36 0.00 0.00 0.00 3.57 -0.45 0.27 116.94 119.98 1dmo h PHE 16 Ca -0.00 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 1dmo h PHE 16 Cb 0.35 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1dmo h PHE 16 CO 0.05 0.00 -1.21 0.77 -2.23 0.00 0.00 178.31 175.68 1dmo h SER 17 N 0.00 0.00 0.16 0.41 0.02 0.11 -3.21 113.55 111.04 1dmo h SER 17 Ca 0.23 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.09 1dmo h SER 17 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1dmo h SER 17 CO -0.00 0.54 -0.35 -0.07 -1.14 0.00 0.00 176.83 175.82 1dmo h LEU 18 N 0.00 0.27 -3.53 5.07 3.38 0.11 -2.88 115.31 117.73 1dmo h LEU 18 Ca -0.12 -0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.54 1dmo h LEU 18 Cb 1.52 -0.07 -0.12 0.00 0.09 0.00 0.00 40.66 42.08 1dmo h LEU 18 CO 0.05 0.61 0.14 0.49 0.09 0.00 0.00 178.44 179.82 1dmo n PHE 19 N -4.08 1.71 -1.13 1.13 3.72 -0.98 -4.76 117.46 113.08 1dmo n PHE 19 Ca -0.01 -1.40 -0.22 0.00 -0.05 0.00 0.00 57.45 55.77 1dmo n PHE 19 Cb 0.43 -0.58 -0.12 0.00 -0.94 0.00 0.00 39.48 38.28 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 -0.78 6.53 0.00 4.37 5.75 -1.09 -4.56 116.55 126.77 1dmo n ASP 20 Ca 0.37 -2.53 0.01 0.00 -0.01 0.00 0.00 54.79 52.63 1dmo n ASP 20 Cb 1.20 -1.47 0.08 0.00 -1.03 0.00 0.00 41.12 39.90 1dmo n ASP 20 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1dmo n LYS 21 N 2.84 0.30 0.00 0.11 5.02 -1.26 -3.91 118.16 121.26 1dmo n LYS 21 Ca 0.56 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1dmo n LYS 21 Cb 0.67 -1.13 0.00 0.00 -0.02 0.00 0.00 35.03 34.54 1dmo n LYS 21 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1dmo n ASP 22 N -0.63 0.00 0.00 4.39 -0.08 -1.26 -5.03 116.55 113.94 1dmo n ASP 22 Ca 0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 1dmo n ASP 22 Cb 0.01 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.47 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 2.89 0.00 0.00 0.27 0.00 -1.25 -4.99 105.19 102.11 1dmo n GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dmo n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dmo n ASP 24 N 0.00 0.31 0.00 1.61 2.03 -1.26 -5.03 116.55 114.20 1dmo n ASP 24 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1dmo n ASP 24 Cb 0.00 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 1dmo n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dmo n GLY 25 N 1.06 0.62 3.74 0.27 0.00 -1.26 -5.13 105.19 104.49 1dmo n GLY 25 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 2.00 0.21 2.61 -4.23 -1.26 -4.64 115.64 110.33 1dmo s THR 26 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1dmo s THR 26 Cb 0.00 -2.64 -0.04 0.00 1.34 0.00 0.00 72.50 71.16 1dmo s THR 26 CO 0.00 0.00 0.13 0.27 -0.54 0.00 0.00 174.62 174.48 1dmo s ILE 27 N -3.15 0.05 -0.06 2.99 -4.36 -0.16 -4.28 121.20 112.23 1dmo s ILE 27 Ca 0.65 -2.00 -0.04 0.00 -0.26 0.00 0.00 60.65 59.00 1dmo s ILE 27 Cb -0.16 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 1dmo s ILE 27 CO 0.55 0.00 0.13 0.42 0.24 0.00 0.00 174.94 176.28 1dmo s THR 28 N -4.10 5.25 0.55 8.37 -4.23 -1.26 0.35 115.64 120.56 1dmo s THR 28 Ca 0.39 -0.06 0.49 0.00 -1.18 0.00 0.00 61.69 61.33 1dmo s THR 28 Cb 0.07 -3.36 0.72 0.00 1.34 0.00 0.00 72.50 71.28 1dmo s THR 28 CO 0.13 0.47 1.55 0.35 -0.54 0.00 0.00 174.62 176.58 1dmo n THR 29 N 1.50 -0.02 -0.11 3.99 -2.24 -1.26 0.14 114.28 116.28 1dmo n THR 29 Ca -0.15 1.51 -0.12 0.00 -2.27 0.00 0.00 64.05 63.01 1dmo n THR 29 Cb 0.54 -2.51 -0.03 0.00 -2.10 0.00 0.00 70.33 66.23 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 0.69 0.00 -0.78 2.10 -1.92 -2.65 116.57 114.02 1dmo h LYS 30 Ca 0.94 -0.31 0.00 0.00 -2.00 0.00 0.00 60.65 59.28 1dmo h LYS 30 Cb 3.71 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 35.02 1dmo h LYS 30 CO -0.04 0.91 0.00 0.39 -2.00 0.00 0.00 179.45 178.71 1dmo n GLU 31 N -4.34 0.02 0.04 0.07 1.02 0.37 -3.91 120.64 113.91 1dmo n GLU 31 Ca -0.03 0.11 -0.09 0.00 -0.02 0.00 0.00 57.16 57.14 1dmo n GLU 31 Cb 0.40 -1.53 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 1dmo n GLU 31 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1dmo h LEU 32 N 0.00 -0.89 -1.11 -4.62 5.85 -0.95 -0.96 115.31 112.63 1dmo h LEU 32 Ca 0.00 0.10 0.39 0.00 0.84 0.00 0.00 57.88 59.20 1dmo h LEU 32 Cb 0.42 0.33 -0.15 0.00 0.37 0.00 0.00 40.66 41.63 1dmo h LEU 32 CO 0.00 -0.29 0.64 1.23 -0.34 0.00 0.00 178.44 179.67 1dmo h GLY 33 N -0.38 1.93 0.87 3.75 0.00 -1.72 0.56 103.07 108.08 1dmo h GLY 33 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1dmo h GLY 33 CO -0.18 -0.58 -0.00 -0.84 0.00 0.00 0.00 176.54 174.94 1dmo h THR 34 N 0.15 1.26 0.24 4.70 2.02 -1.44 -1.99 112.91 117.86 1dmo h THR 34 Ca 0.80 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1dmo h THR 34 Cb 2.11 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 1dmo h THR 34 CO -0.61 0.30 -0.12 0.58 0.37 0.00 0.00 175.52 176.04 1dmo h VAL 35 N 0.29 0.81 -0.81 3.16 2.07 0.11 -1.66 116.25 120.22 1dmo h VAL 35 Ca 0.08 -0.31 0.19 0.00 0.82 0.00 0.00 66.70 67.48 1dmo h VAL 35 Cb 0.43 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 1dmo h VAL 35 CO 0.02 0.07 0.55 0.24 0.02 0.00 0.00 177.57 178.46 1dmo h MET 36 N -0.48 0.30 -0.01 1.57 2.86 -1.14 0.27 114.93 118.29 1dmo h MET 36 Ca -0.03 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1dmo h MET 36 Cb 0.36 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1dmo h MET 36 CO 0.06 0.20 -0.66 -0.09 1.06 0.00 0.00 176.91 177.48 1dmo h ARG 37 N 0.31 0.06 0.00 1.72 2.43 -0.89 -3.07 114.38 114.94 1dmo h ARG 37 Ca 0.41 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.39 1dmo h ARG 37 Cb 1.12 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 1dmo h ARG 37 CO -0.11 0.69 -0.65 1.03 -1.51 0.00 0.00 179.97 179.42 1dmo h SER 38 N 0.04 0.00 -0.83 -3.80 0.87 0.43 -3.18 113.55 107.08 1dmo h SER 38 Ca -0.01 0.00 0.15 0.00 -1.23 0.00 0.00 61.79 60.70 1dmo h SER 38 Cb 1.17 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.06 1dmo h SER 38 CO 0.09 0.65 0.55 -0.07 -0.53 0.00 0.00 176.83 177.51 1dmo h LEU 39 N 0.00 0.52 0.00 2.23 4.07 -1.16 -3.45 115.31 117.53 1dmo h LEU 39 Ca -0.01 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1dmo h LEU 39 Cb 1.29 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.96 1dmo h LEU 39 CO 0.08 0.26 0.00 0.61 -1.08 0.00 0.00 178.44 178.32 1dmo n GLY 40 N -1.48 0.40 2.72 0.83 0.00 -1.20 -5.03 105.19 101.43 1dmo n GLY 40 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 1dmo n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dmo n GLN 41 N 0.00 0.82 -3.48 1.61 10.64 -1.25 -5.09 117.38 120.63 1dmo n GLN 41 Ca 0.00 -2.31 -0.28 0.00 -1.83 0.00 0.00 57.00 52.58 1dmo n GLN 41 Cb 0.00 0.04 -0.11 0.00 -0.86 0.00 0.00 30.24 29.31 1dmo n GLN 41 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1dmo s ASN 42 N -3.41 2.26 0.95 2.61 -0.87 -1.26 -4.35 114.94 110.88 1dmo s ASN 42 Ca 0.33 -2.90 -0.12 0.00 -1.57 0.00 0.00 52.86 48.60 1dmo s ASN 42 Cb -0.03 -0.58 0.16 0.00 -0.02 0.00 0.00 41.25 40.78 1dmo s ASN 42 CO 0.21 -0.20 1.09 -2.16 -2.57 0.00 0.00 177.10 173.46 1dmo s PRO 43 N 0.18 0.78 -0.07 -0.60 0.04 -1.26 -5.05 135.00 129.02 1dmo s PRO 43 Ca 0.27 0.76 0.02 0.00 0.04 0.00 0.00 61.00 62.09 1dmo s PRO 43 Cb -0.05 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 1dmo s PRO 43 CO -0.13 -2.55 -0.10 0.99 0.04 0.00 0.00 177.00 175.24 1dmo s THR 44 N -2.89 3.42 0.63 1.26 2.01 -1.26 -4.97 115.64 113.85 1dmo s THR 44 Ca 0.65 -0.58 0.19 0.00 0.31 0.00 0.00 61.69 62.25 1dmo s THR 44 Cb -0.19 -2.38 0.25 0.00 0.01 0.00 0.00 72.50 70.19 1dmo s THR 44 CO 0.58 0.59 1.36 1.05 -0.69 0.00 0.00 174.62 177.51 1dmo h GLU 45 N 5.43 0.00 0.00 4.92 4.11 -1.98 -0.36 114.58 126.70 1dmo h GLU 45 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1dmo h GLU 45 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1dmo h GLU 45 CO 0.52 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.60 1dmo n ALA 46 N -1.97 -0.09 -0.31 1.06 0.00 -1.26 -2.16 120.51 115.78 1dmo n ALA 46 Ca 0.10 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.69 1dmo n ALA 46 Cb 1.09 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.88 1dmo n ALA 46 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1dmo h GLU 47 N 0.00 0.33 -0.62 0.00 4.39 -1.73 1.20 114.58 118.15 1dmo h GLU 47 Ca 0.00 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 59.79 1dmo h GLU 47 Cb 0.00 -0.07 -0.08 0.00 -0.10 0.00 0.00 28.75 28.50 1dmo h GLU 47 CO 0.00 0.22 0.20 1.25 -1.16 0.00 0.00 179.01 179.52 1dmo h LEU 48 N 0.34 0.14 -1.53 1.33 5.85 -1.21 0.27 115.31 120.50 1dmo h LEU 48 Ca 0.59 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.40 1dmo h LEU 48 Cb 1.18 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1dmo h LEU 48 CO -0.57 0.08 0.25 -0.61 -0.34 0.00 0.00 178.44 177.24 1dmo h GLN 49 N 0.35 0.56 0.00 1.25 4.15 0.19 -0.49 115.11 121.13 1dmo h GLN 49 Ca 0.32 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.66 1dmo h GLN 49 Cb 0.45 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 1dmo h GLN 49 CO -0.36 0.40 -0.18 0.22 -1.93 0.00 0.00 178.83 176.98 1dmo h ASP 50 N 0.57 0.00 0.16 -0.69 1.82 0.70 -2.72 116.42 116.26 1dmo h ASP 50 Ca 0.15 0.00 -0.25 0.00 -0.39 0.00 0.00 57.03 56.54 1dmo h ASP 50 Cb -0.02 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.01 1dmo h ASP 50 CO -0.03 0.18 -1.15 0.24 -1.61 0.00 0.00 179.24 176.88 1dmo h MET 51 N 0.00 0.33 -1.00 0.28 2.86 -0.43 -3.19 114.93 113.78 1dmo h MET 51 Ca -0.00 -0.57 0.11 0.00 -2.06 0.00 0.00 59.70 57.18 1dmo h MET 51 Cb 0.41 0.21 -0.08 0.00 0.06 0.00 0.00 31.60 32.20 1dmo h MET 51 CO 0.02 1.27 0.63 0.82 1.06 0.00 0.00 176.91 180.72 1dmo h ILE 52 N -0.24 0.95 0.00 -1.22 5.03 -1.17 0.40 117.51 121.25 1dmo h ILE 52 Ca -0.22 -0.35 0.00 0.00 -0.12 0.00 0.00 64.86 64.17 1dmo h ILE 52 Cb 1.79 -0.16 0.00 0.00 -3.03 0.00 0.00 36.82 35.42 1dmo h ILE 52 CO 0.15 0.19 0.00 -3.20 -0.68 0.00 0.00 178.15 174.60 1dmo n ASN 53 N -4.59 0.26 0.07 1.72 5.15 -1.04 -3.13 115.26 113.69 1dmo n ASN 53 Ca 0.18 0.54 -0.21 0.00 -0.60 0.00 0.00 54.58 54.49 1dmo n ASN 53 Cb 0.33 -0.61 -0.15 0.00 -0.53 0.00 0.00 39.78 38.82 1dmo n ASN 53 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1dmo h GLU 54 N 0.00 0.35 0.00 1.20 4.57 -0.22 -3.46 114.58 117.02 1dmo h GLU 54 Ca 0.00 -0.61 0.00 0.00 -1.18 0.00 0.00 59.36 57.57 1dmo h GLU 54 Cb 0.43 0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1dmo h GLU 54 CO 0.00 1.26 0.00 1.33 -1.18 0.00 0.00 179.01 180.42 1dmo n VAL 55 N -3.55 0.00 -1.84 0.32 0.24 -0.77 -4.62 118.33 108.11 1dmo n VAL 55 Ca -0.24 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1dmo n VAL 55 Cb 1.07 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 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 0.00 -0.64 0.08 -1.34 -0.08 -1.26 -4.67 116.55 108.64 1dmo n ASP 56 Ca 0.00 0.32 -0.03 0.00 -1.51 0.00 0.00 54.79 53.57 1dmo n ASP 56 Cb 0.00 -0.72 -0.07 0.00 2.34 0.00 0.00 41.12 42.68 1dmo n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1dmo h ALA 57 N 1.32 0.54 0.41 -1.67 0.00 -1.91 -3.37 119.26 114.57 1dmo h ALA 57 Ca 0.00 -0.79 -0.02 0.00 0.00 0.00 0.00 54.91 54.10 1dmo h ALA 57 Cb 0.64 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1dmo h ALA 57 CO 0.00 1.02 -0.20 0.22 0.00 0.00 0.00 179.25 180.30 1dmo h ASP 58 N 0.00 -0.46 0.00 0.00 3.58 -1.98 -3.48 116.42 114.08 1dmo h ASP 58 Ca -0.05 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.42 1dmo h ASP 58 Cb 1.63 0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.80 1dmo h ASP 58 CO 0.09 -0.30 0.00 0.61 -2.88 0.00 0.00 179.24 176.76 1dmo n GLY 59 N -0.86 0.60 0.30 -0.78 0.00 -1.26 -5.00 105.19 98.19 1dmo n GLY 59 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 1dmo n GLY 59 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1dmo h ASN 60 N 0.00 0.93 0.00 1.61 -0.26 -1.92 -3.46 115.58 112.47 1dmo h ASN 60 Ca 0.00 -0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.51 1dmo h ASN 60 Cb 0.00 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.01 1dmo h ASN 60 CO 0.00 0.96 0.00 0.61 -1.06 0.00 0.00 177.43 177.94 1dmo n GLY 61 N -0.59 3.19 3.91 2.83 0.00 -1.26 -5.04 105.19 108.24 1dmo n GLY 61 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.88 5.03 -0.08 2.61 -4.23 -1.26 -4.08 115.64 110.75 1dmo s THR 62 Ca 0.00 -0.99 -0.03 0.00 -1.18 0.00 0.00 61.69 59.49 1dmo s THR 62 Cb 0.00 -3.67 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 1dmo s THR 62 CO 0.00 -0.24 0.07 -0.63 -0.54 0.00 0.00 174.62 173.28 1dmo s ILE 63 N -1.91 4.83 0.43 2.99 1.01 0.16 -4.90 121.20 123.81 1dmo s ILE 63 Ca 0.34 -0.12 0.08 0.00 0.00 0.00 0.00 60.65 60.95 1dmo s ILE 63 Cb -0.10 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.29 1dmo s ILE 63 CO 0.27 0.56 0.59 1.51 0.00 0.00 0.00 174.94 177.87 1dmo s ASP 64 N -1.12 5.62 0.15 3.58 1.47 -1.26 -0.99 116.67 124.12 1dmo s ASP 64 Ca 0.16 -0.44 -0.17 0.00 1.18 0.00 0.00 52.55 53.28 1dmo s ASP 64 Cb -0.12 -0.60 0.01 0.00 -0.34 0.00 0.00 42.92 41.87 1dmo s ASP 64 CO 0.05 -0.80 1.79 0.15 0.68 0.00 0.00 175.17 177.04 1dmo h PHE 65 N 0.60 0.39 0.07 2.11 3.57 -1.96 -1.95 116.94 119.77 1dmo h PHE 65 Ca -0.39 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.14 1dmo h PHE 65 Cb 1.28 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.85 1dmo h PHE 65 CO 0.40 0.23 -0.41 -1.35 -2.23 0.00 0.00 178.31 174.95 1dmo h PRO 66 N 0.42 -0.59 -0.55 6.41 0.10 -2.00 -1.65 132.00 134.14 1dmo h PRO 66 Ca 0.14 0.04 0.10 0.00 0.10 0.00 0.00 66.00 66.38 1dmo h PRO 66 Cb -0.00 0.13 -0.08 0.00 0.10 0.00 0.00 31.00 31.15 1dmo h PRO 66 CO -0.06 -0.39 0.10 0.93 0.10 0.00 0.00 178.00 178.68 1dmo h GLU 67 N -0.61 0.23 -1.33 1.05 5.08 -1.95 0.37 114.58 117.42 1dmo h GLU 67 Ca 0.03 -0.01 0.39 0.00 -1.00 0.00 0.00 59.36 58.77 1dmo h GLU 67 Cb 0.66 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.79 1dmo h GLU 67 CO -0.27 0.15 0.94 0.35 -1.00 0.00 0.00 179.01 179.19 1dmo h PHE 68 N 0.24 0.10 -0.04 4.33 3.04 -0.50 0.91 116.94 125.02 1dmo h PHE 68 Ca 0.28 0.00 -0.22 0.00 3.98 0.00 0.00 57.97 62.02 1dmo h PHE 68 Cb 0.41 -0.03 0.02 0.00 2.56 0.00 0.00 35.95 38.90 1dmo h PHE 68 CO -0.25 -0.01 -0.82 -0.07 -2.02 0.00 0.00 178.31 175.14 1dmo h LEU 69 N 0.05 0.79 -0.60 0.59 3.38 0.11 -2.12 115.31 117.50 1dmo h LEU 69 Ca 0.66 -0.71 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1dmo h LEU 69 Cb 2.50 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 42.98 1dmo h LEU 69 CO -0.06 1.39 0.28 0.74 0.09 0.00 0.00 178.44 180.88 1dmo h THR 70 N 0.26 1.21 -0.00 0.22 2.02 0.11 0.34 112.91 117.07 1dmo h THR 70 Ca -0.09 -0.61 -0.14 0.00 0.77 0.00 0.00 66.41 66.34 1dmo h THR 70 Cb 1.49 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1dmo h THR 70 CO 0.16 0.25 -0.67 0.00 0.37 0.00 0.00 175.52 175.63 1dmo h MET 71 N 0.82 0.02 0.01 6.66 -0.00 -1.07 -2.77 114.93 118.60 1dmo h MET 71 Ca 0.20 -0.02 -0.20 0.00 -0.00 0.00 0.00 59.70 59.69 1dmo h MET 71 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.72 1dmo h MET 71 CO -0.02 0.68 -0.89 0.52 -0.00 0.00 0.00 176.91 177.19 1dmo h MET 72 N 0.01 0.14 -0.23 -0.10 2.07 -0.98 -3.23 114.93 112.62 1dmo h MET 72 Ca -0.01 -0.17 -0.02 0.00 -2.07 0.00 0.00 59.70 57.44 1dmo h MET 72 Cb 1.18 0.05 -0.01 0.00 -1.87 0.00 0.00 31.60 30.95 1dmo h MET 72 CO 0.09 0.94 0.07 0.00 1.07 0.00 0.00 176.91 179.07 1dmo h ALA 73 N 1.00 0.30 -1.00 6.32 0.00 -0.17 0.11 119.26 125.82 1dmo h ALA 73 Ca -0.04 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.88 1dmo h ALA 73 Cb 1.53 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 19.14 1dmo h ALA 73 CO 0.13 -0.07 0.62 0.00 0.00 0.00 0.00 179.25 179.93 1dmo h ARG 74 N 0.19 0.86 -0.05 0.00 3.08 -1.53 1.19 114.38 118.11 1dmo h ARG 74 Ca 0.07 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.90 1dmo h ARG 74 Cb 0.24 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1dmo h ARG 74 CO -0.00 0.57 -0.72 -0.22 -1.07 0.00 0.00 179.97 178.53 1dmo h LYS 75 N 0.88 0.29 -0.58 0.04 1.63 -1.49 -2.89 116.57 114.46 1dmo h LYS 75 Ca 0.52 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 1dmo h LYS 75 Cb 0.67 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 1dmo h LYS 75 CO -0.30 0.89 0.00 -0.12 -3.45 0.00 0.00 179.45 176.47 1dmo n MET 76 N -3.81 2.65 -1.63 1.90 1.56 0.47 -4.99 117.12 113.27 1dmo n MET 76 Ca -0.03 -2.00 -0.00 0.00 -0.27 0.00 0.00 57.70 55.40 1dmo n MET 76 Cb 0.70 -1.58 -0.00 0.00 2.15 0.00 0.00 33.22 34.48 1dmo n MET 76 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1dmo n LYS 77 N 0.89 -2.09 -1.10 2.12 0.00 0.38 -4.86 118.16 113.51 1dmo n LYS 77 Ca 0.18 1.82 -0.38 0.00 0.00 0.00 0.00 58.31 59.93 1dmo n LYS 77 Cb 0.58 -2.32 -0.02 0.00 0.00 0.00 0.00 35.03 33.27 1dmo n LYS 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1dmo n ASP 78 N 0.74 -0.98 -4.24 3.14 2.03 -1.05 -4.82 116.55 111.37 1dmo n ASP 78 Ca -0.03 0.89 -0.34 0.00 0.52 0.00 0.00 54.79 55.83 1dmo n ASP 78 Cb 0.05 -0.75 0.13 0.00 -0.72 0.00 0.00 41.12 39.84 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 0.00 0.00 0.00 5.18 -2.24 -1.26 -4.97 114.28 110.99 1dmo n THR 79 Ca 0.14 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1dmo n THR 79 Cb 0.20 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1dmo n THR 79 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1dmo n ASP 80 N -0.41 0.00 0.00 3.42 8.00 -1.26 -4.99 116.55 121.32 1dmo n ASP 80 Ca 0.01 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1dmo n ASP 80 Cb 0.62 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1dmo n ASP 80 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1dmo n SER 81 N -2.16 0.00 0.27 -2.24 3.41 -1.26 -4.98 113.62 106.67 1dmo n SER 81 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 1dmo n SER 81 Cb 0.00 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.45 1dmo n SER 81 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1dmo h GLU 82 N 0.00 0.00 0.01 4.33 9.09 -1.94 0.03 114.58 126.10 1dmo h GLU 82 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 1dmo h GLU 82 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1dmo h GLU 82 CO 0.00 0.00 -0.00 1.05 0.05 0.00 0.00 179.01 180.11 1dmo h GLU 83 N 0.00 -0.01 -0.99 1.06 4.11 -1.98 -0.25 114.58 116.52 1dmo h GLU 83 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.46 1dmo h GLU 83 Cb 0.91 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.10 1dmo h GLU 83 CO 0.00 0.84 0.65 1.49 0.07 0.00 0.00 179.01 182.06 1dmo h GLU 84 N -0.95 1.23 0.09 1.06 4.22 -1.41 -1.99 114.58 116.83 1dmo h GLU 84 Ca -0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 59.36 1dmo h GLU 84 Cb 0.85 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1dmo h GLU 84 CO 0.00 0.81 -0.04 0.82 -2.18 0.00 0.00 179.01 178.42 1dmo h ILE 85 N 1.26 1.14 -0.71 2.32 2.04 -1.51 -2.65 117.51 119.40 1dmo h ILE 85 Ca 0.39 -1.28 0.12 0.00 1.00 0.00 0.00 64.86 65.09 1dmo h ILE 85 Cb -0.01 1.91 -0.13 0.00 -0.74 0.00 0.00 36.82 37.85 1dmo h ILE 85 CO -0.12 0.29 -0.35 -0.09 0.00 0.00 0.00 178.15 177.88 1dmo h ARG 86 N -0.75 -0.11 -0.79 2.37 2.43 -0.82 0.59 114.38 117.30 1dmo h ARG 86 Ca -0.01 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1dmo h ARG 86 Cb 0.57 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.09 1dmo h ARG 86 CO 0.02 -0.07 0.47 0.93 -1.51 0.00 0.00 179.97 179.81 1dmo h GLU 87 N -0.12 0.82 -1.08 0.20 4.39 -1.43 0.15 114.58 117.51 1dmo h GLU 87 Ca 0.27 -0.05 0.31 0.00 0.34 0.00 0.00 59.36 60.23 1dmo h GLU 87 Cb 0.56 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 1dmo h GLU 87 CO -0.77 0.54 0.81 0.00 -1.16 0.00 0.00 179.01 178.43 1dmo h ALA 88 N 1.39 3.01 0.05 3.43 0.00 0.56 0.53 119.26 128.23 1dmo h ALA 88 Ca 0.35 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.94 1dmo h ALA 88 Cb 0.21 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1dmo h ALA 88 CO -0.19 -1.37 -1.58 1.19 0.00 0.00 0.00 179.25 177.31 1dmo n PHE 89 N -4.12 1.07 0.00 0.00 3.72 0.41 -4.03 117.46 114.51 1dmo n PHE 89 Ca 0.23 0.36 0.21 0.00 -0.05 0.00 0.00 57.45 58.21 1dmo n PHE 89 Cb 1.17 -1.12 0.71 0.00 -0.94 0.00 0.00 39.48 39.30 1dmo n PHE 89 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1dmo h ARG 90 N -0.60 0.00 0.00 -1.08 9.65 0.14 0.79 114.38 123.27 1dmo h ARG 90 Ca -0.39 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.49 1dmo h ARG 90 Cb 1.58 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.16 1dmo h ARG 90 CO -0.11 0.00 0.31 0.28 2.80 0.00 0.00 179.97 183.26 1dmo n VAL 91 N -4.20 0.77 -0.08 0.20 0.31 0.04 0.70 118.33 116.08 1dmo n VAL 91 Ca 0.10 0.56 0.00 0.00 -0.01 0.00 0.00 64.34 64.99 1dmo n VAL 91 Cb 0.65 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 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 -1.39 0.00 -2.55 3.52 3.01 0.26 -5.02 117.46 115.29 1dmo n PHE 92 Ca -0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 1dmo n PHE 92 Cb 0.32 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.77 1dmo n PHE 92 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1dmo s ASP 93 N -0.48 6.81 0.27 4.37 2.15 0.22 -4.70 116.67 125.31 1dmo s ASP 93 Ca 0.00 1.07 0.00 0.00 0.43 0.00 0.00 52.55 54.05 1dmo s ASP 93 Cb 0.00 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1dmo s ASP 93 CO 0.00 -0.98 0.00 0.29 -0.17 0.00 0.00 175.17 174.31 1dmo n LYS 94 N 7.11 0.00 0.00 4.34 5.02 -1.26 -4.87 118.16 128.50 1dmo n LYS 94 Ca 0.13 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.40 1dmo n LYS 94 Cb 0.47 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.37 1dmo n LYS 94 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1dmo n ASP 95 N -3.19 0.68 0.21 4.39 5.75 -1.26 -3.94 116.55 119.20 1dmo n ASP 95 Ca 0.00 0.31 0.11 0.00 -0.01 0.00 0.00 54.79 55.19 1dmo n ASP 95 Cb 0.00 0.37 0.30 0.00 -1.03 0.00 0.00 41.12 40.76 1dmo n ASP 95 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1dmo h GLY 96 N 3.75 0.00 -6.16 6.12 0.00 -1.89 -3.48 103.07 101.41 1dmo h GLY 96 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.79 1dmo h GLY 96 CO 0.05 0.00 -1.10 1.16 0.00 0.00 0.00 176.54 176.65 1dmo n ASN 97 N -3.18 -5.15 -0.03 0.19 6.94 -1.25 -3.72 115.26 109.07 1dmo n ASN 97 Ca 0.02 -0.08 0.00 0.00 -0.02 0.00 0.00 54.58 54.50 1dmo n ASN 97 Cb 0.51 -1.45 0.00 0.00 -2.36 0.00 0.00 39.78 36.48 1dmo n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1dmo n GLY 98 N 0.04 1.35 3.15 4.83 0.00 -1.26 -5.06 105.19 108.24 1dmo n GLY 98 Ca -0.07 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.05 -0.85 0.49 1.61 2.02 -1.24 -4.56 117.35 112.76 1dmo s TYR 99 Ca 0.00 0.61 0.05 0.00 -0.37 0.00 0.00 57.07 57.36 1dmo s TYR 99 Cb 0.00 0.19 0.02 0.00 -0.40 0.00 0.00 41.96 41.77 1dmo s TYR 99 CO 0.00 -0.49 0.67 0.96 -1.57 0.00 0.00 175.55 175.13 1dmo s ILE 100 N 2.92 2.81 0.14 2.71 -4.36 -0.79 -4.54 121.20 120.10 1dmo s ILE 100 Ca 0.17 -0.85 -0.30 0.00 -0.26 0.00 0.00 60.65 59.41 1dmo s ILE 100 Cb -0.06 -2.97 -0.07 0.00 1.25 0.00 0.00 42.46 40.61 1dmo s ILE 100 CO -0.21 0.00 0.97 -0.44 0.24 0.00 0.00 174.94 175.50 1dmo s SER 101 N -4.40 7.51 0.43 4.36 0.01 -1.26 -0.55 113.70 119.80 1dmo s SER 101 Ca 0.56 1.84 0.09 0.00 1.31 0.00 0.00 55.95 59.76 1dmo s SER 101 Cb -0.10 -2.59 0.94 0.00 0.21 0.00 0.00 66.02 64.48 1dmo s SER 101 CO 0.36 -0.03 2.06 0.00 0.41 0.00 0.00 173.24 176.03 1dmo h ALA 102 N 5.27 1.74 0.59 1.44 0.00 -0.95 0.78 119.26 128.13 1dmo h ALA 102 Ca -0.43 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1dmo h ALA 102 Cb 1.21 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.89 1dmo h ALA 102 CO 0.71 0.22 -0.28 0.00 0.00 0.00 0.00 179.25 179.90 1dmo h ALA 103 N 1.78 -0.94 -0.97 0.00 0.00 -1.92 -0.79 119.26 116.42 1dmo h ALA 103 Ca 0.10 -0.17 0.19 0.00 0.00 0.00 0.00 54.91 55.02 1dmo h ALA 103 Cb 0.02 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 1dmo h ALA 103 CO -0.02 -0.88 0.61 1.49 0.00 0.00 0.00 179.25 180.45 1dmo h GLU 104 N -1.01 0.65 -0.78 0.00 4.81 -1.92 0.38 114.58 116.71 1dmo h GLU 104 Ca -0.08 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 1dmo h GLU 104 Cb 0.61 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 1dmo h GLU 104 CO 0.13 0.43 0.50 1.25 -0.73 0.00 0.00 179.01 180.60 1dmo h LEU 105 N 0.67 0.84 -2.11 1.64 6.46 -0.67 0.29 115.31 122.44 1dmo h LEU 105 Ca 0.53 -0.01 0.07 0.00 -0.12 0.00 0.00 57.88 58.35 1dmo h LEU 105 Cb 0.94 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 1dmo h LEU 105 CO -0.30 0.59 0.20 -0.09 -0.62 0.00 0.00 178.44 178.22 1dmo h ARG 106 N 1.00 0.00 0.00 1.25 2.43 0.13 0.40 114.38 119.58 1dmo h ARG 106 Ca 0.31 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.30 1dmo h ARG 106 Cb -0.02 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1dmo h ARG 106 CO -0.10 0.00 -0.87 1.25 -1.51 0.00 0.00 179.97 178.74 1dmo h HIS 107 N 0.00 0.00 -0.77 2.20 2.76 -0.07 -3.22 115.15 116.05 1dmo h HIS 107 Ca 0.11 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 1dmo h HIS 107 Cb 0.50 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.43 1dmo h HIS 107 CO 0.00 0.87 0.31 0.28 -1.30 0.00 0.00 177.93 178.09 1dmo h VAL 108 N 0.00 1.26 -0.51 5.26 2.07 0.12 -1.70 116.25 122.75 1dmo h VAL 108 Ca -0.01 -0.80 0.06 0.00 0.82 0.00 0.00 66.70 66.77 1dmo h VAL 108 Cb 1.58 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1dmo h VAL 108 CO 0.11 0.33 0.34 0.24 0.02 0.00 0.00 177.57 178.61 1dmo h MET 109 N 1.11 0.41 -0.48 1.57 2.07 -1.45 -0.20 114.93 117.96 1dmo h MET 109 Ca 0.26 -0.02 -0.13 0.00 -2.07 0.00 0.00 59.70 57.74 1dmo h MET 109 Cb 0.21 -0.09 -0.01 0.00 -1.87 0.00 0.00 31.60 29.83 1dmo h MET 109 CO -0.02 0.27 -0.19 1.15 1.07 0.00 0.00 176.91 179.19 1dmo h THR 110 N 0.43 1.27 -0.25 2.22 2.02 -1.39 -1.87 112.91 115.34 1dmo h THR 110 Ca 0.22 -1.35 0.01 0.00 0.77 0.00 0.00 66.41 66.06 1dmo h THR 110 Cb 0.33 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1dmo h THR 110 CO -0.06 0.47 0.14 -1.13 0.37 0.00 0.00 175.52 175.31 1dmo h ASN 111 N 0.83 0.23 0.14 4.18 -1.24 -0.63 -3.02 115.58 116.07 1dmo h ASN 111 Ca 0.11 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.12 1dmo h ASN 111 Cb 0.77 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.77 1dmo h ASN 111 CO 0.06 0.17 -0.07 -0.07 -1.29 0.00 0.00 177.43 176.24 1dmo h LEU 112 N 0.30 -0.16 -2.42 0.34 3.38 -1.36 -3.49 115.31 111.90 1dmo h LEU 112 Ca 0.10 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1dmo h LEU 112 Cb -0.00 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1dmo h LEU 112 CO -0.05 0.08 -0.63 0.61 0.09 0.00 0.00 178.44 178.54 1dmo n GLY 113 N -0.59 -3.42 0.61 0.83 0.00 -0.71 -4.98 105.19 96.92 1dmo n GLY 113 Ca -0.09 0.35 0.05 0.00 0.00 0.00 0.00 46.02 46.32 1dmo n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dmo n GLU 114 N 0.35 0.61 -2.34 1.61 1.02 -1.26 -4.96 120.64 115.67 1dmo n GLU 114 Ca 0.01 -2.01 -0.03 0.00 -0.02 0.00 0.00 57.16 55.11 1dmo n GLU 114 Cb 0.05 -0.85 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 1dmo n GLU 114 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1dmo n LYS 115 N -0.47 -0.61 -3.06 3.49 4.81 -1.26 -4.99 118.16 116.08 1dmo n LYS 115 Ca 0.09 0.12 -0.45 0.00 -0.87 0.00 0.00 58.31 57.20 1dmo n LYS 115 Cb 0.78 -3.36 -0.04 0.00 0.02 0.00 0.00 35.03 32.43 1dmo n LYS 115 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1dmo s LEU 116 N -1.27 5.31 1.03 3.14 1.43 -1.26 -5.03 118.68 122.02 1dmo s LEU 116 Ca 0.04 -1.63 -0.15 0.00 -1.03 0.00 0.00 54.13 51.36 1dmo s LEU 116 Cb -0.02 -2.33 0.08 0.00 0.03 0.00 0.00 46.19 43.95 1dmo s LEU 116 CO 0.05 -1.10 0.31 0.41 0.23 0.00 0.00 176.35 176.25 1dmo n THR 117 N 5.42 0.00 -0.08 5.49 -1.04 -1.26 -4.71 114.28 118.10 1dmo n THR 117 Ca 0.01 -0.24 -0.13 0.00 -2.04 0.00 0.00 64.05 61.65 1dmo n THR 117 Cb 0.45 -0.65 -0.05 0.00 -1.82 0.00 0.00 70.33 68.26 1dmo n THR 117 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1dmo h ASP 118 N -1.83 0.55 -0.78 8.00 3.32 -1.99 -2.05 116.42 121.65 1dmo h ASP 118 Ca -0.48 -0.45 0.01 0.00 0.02 0.00 0.00 57.03 56.13 1dmo h ASP 118 Cb 1.31 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.67 1dmo h ASP 118 CO 0.37 0.89 0.52 -0.33 -1.72 0.00 0.00 179.24 178.96 1dmo h GLU 119 N 0.22 1.01 -0.11 3.56 5.08 -1.98 0.25 114.58 122.61 1dmo h GLU 119 Ca 0.04 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1dmo h GLU 119 Cb 0.71 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1dmo h GLU 119 CO 0.05 0.67 -0.02 0.93 -1.00 0.00 0.00 179.01 179.63 1dmo h GLU 120 N 1.04 0.21 -0.07 2.33 4.39 -1.88 -0.23 114.58 120.36 1dmo h GLU 120 Ca 0.29 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.84 1dmo h GLU 120 Cb -0.09 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1dmo h GLU 120 CO -0.07 0.50 -0.30 0.28 -1.16 0.00 0.00 179.01 178.27 1dmo h VAL 121 N -0.11 1.24 -0.08 3.13 2.07 -0.97 -2.00 116.25 119.53 1dmo h VAL 121 Ca 0.03 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 1dmo h VAL 121 Cb 0.42 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1dmo h VAL 121 CO 0.01 0.34 -0.19 -0.78 0.02 0.00 0.00 177.57 176.97 1dmo h ASP 122 N 0.12 0.32 0.17 0.57 3.58 -0.34 0.85 116.42 121.69 1dmo h ASP 122 Ca 0.02 -0.58 -0.03 0.00 0.42 0.00 0.00 57.03 56.86 1dmo h ASP 122 Cb 0.59 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.55 1dmo h ASP 122 CO 0.04 0.84 -0.12 -0.08 -2.88 0.00 0.00 179.24 177.04 1dmo h GLU 123 N -0.19 0.00 0.08 0.28 4.22 -0.91 -1.73 114.58 116.34 1dmo h GLU 123 Ca -0.00 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.29 1dmo h GLU 123 Cb 0.79 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.05 1dmo h GLU 123 CO 0.04 0.12 -0.70 1.98 -2.18 0.00 0.00 179.01 178.27 1dmo h MET 124 N 0.00 0.17 -0.09 1.92 4.05 -1.26 -3.27 114.93 116.45 1dmo h MET 124 Ca -0.00 -0.29 0.03 0.00 -0.28 0.00 0.00 59.70 59.15 1dmo h MET 124 Cb 0.24 0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.15 1dmo h MET 124 CO 0.02 1.14 0.10 0.82 0.23 0.00 0.00 176.91 179.21 1dmo h ILE 125 N -0.61 0.58 -0.33 1.77 2.04 -0.59 -1.21 117.51 119.16 1dmo h ILE 125 Ca -0.14 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1dmo h ILE 125 Cb 1.44 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1dmo h ILE 125 CO 0.06 0.00 -0.15 -0.09 0.00 0.00 0.00 178.15 177.97 1dmo h ARG 126 N 0.00 0.69 -0.69 2.37 2.43 -1.38 -2.72 114.38 115.08 1dmo h ARG 126 Ca 0.04 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1dmo h ARG 126 Cb 0.24 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1dmo h ARG 126 CO -0.00 0.89 0.00 -0.85 -1.51 0.00 0.00 179.97 178.50 1dmo n GLU 127 N -4.36 2.48 -0.03 0.20 0.28 -0.50 -4.36 120.64 114.35 1dmo n GLU 127 Ca -0.03 -1.34 0.00 0.00 -0.16 0.00 0.00 57.16 55.63 1dmo n GLU 127 Cb 0.39 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.57 1dmo n GLU 127 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1dmo n ALA 128 N 0.32 2.25 -4.01 -1.84 0.00 -0.91 -4.75 120.51 111.58 1dmo n ALA 128 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.17 1dmo n ALA 128 Cb 0.57 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1dmo n ALA 128 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1dmo n ASN 129 N 0.76 -3.21 -4.91 0.00 4.13 -1.26 -4.60 115.26 106.17 1dmo n ASN 129 Ca 0.00 -1.20 -0.28 0.00 1.68 0.00 0.00 54.58 54.78 1dmo n ASN 129 Cb 0.33 -2.22 0.08 0.00 -1.54 0.00 0.00 39.78 36.42 1dmo n ASN 129 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1dmo s ILE 130 N -3.69 2.30 0.00 2.41 1.01 -1.26 -4.82 121.20 117.14 1dmo s ILE 130 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1dmo s ILE 130 Cb -0.18 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.23 1dmo s ILE 130 CO 0.94 -0.08 0.00 -0.90 0.00 0.00 0.00 174.94 174.90 1dmo n ASP 131 N -3.14 0.00 -2.80 3.58 5.75 -1.26 -5.02 116.55 113.66 1dmo n ASP 131 Ca 0.08 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.85 1dmo n ASP 131 Cb 0.60 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.76 1dmo n ASP 131 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dmo n GLY 132 N 4.71 1.82 2.10 6.12 0.00 -1.26 -4.94 105.19 113.73 1dmo n GLY 132 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1dmo n GLY 132 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dmo n ASP 133 N -0.76 -1.83 0.00 1.61 -0.08 -1.26 -5.06 116.55 109.18 1dmo n ASP 133 Ca 0.02 0.64 0.00 0.00 -1.51 0.00 0.00 54.79 53.95 1dmo n ASP 133 Cb 0.82 1.84 0.00 0.00 2.34 0.00 0.00 41.12 46.12 1dmo n ASP 133 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1dmo n GLY 134 N 0.25 0.00 3.93 0.27 0.00 -1.26 -5.06 105.19 103.31 1dmo n GLY 134 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1dmo n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dmo s GLN 135 N 0.00 3.52 -0.13 1.61 -1.52 -1.26 -0.32 119.66 121.56 1dmo s GLN 135 Ca 0.00 -0.11 -0.06 0.00 -1.95 0.00 0.00 55.36 53.24 1dmo s GLN 135 Cb 0.00 -2.56 0.05 0.00 -0.22 0.00 0.00 33.01 30.28 1dmo s GLN 135 CO 0.00 0.03 0.30 0.08 -0.25 0.00 0.00 175.29 175.45 1dmo s VAL 136 N -2.44 -0.09 -1.19 1.09 1.01 0.28 -4.44 120.40 114.63 1dmo s VAL 136 Ca 0.43 0.15 -0.23 0.00 0.00 0.00 0.00 61.98 62.33 1dmo s VAL 136 Cb -0.10 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 35.73 1dmo s VAL 136 CO 0.38 0.06 1.94 0.59 0.00 0.00 0.00 175.10 178.07 1dmo n ASN 137 N 4.38 3.05 -0.68 3.32 3.02 -1.26 -1.88 115.26 125.20 1dmo n ASN 137 Ca -0.22 -2.70 0.52 0.00 -0.03 0.00 0.00 54.58 52.15 1dmo n ASN 137 Cb 0.53 -1.74 0.81 0.00 -0.61 0.00 0.00 39.78 38.77 1dmo n ASN 137 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 1dmo h TYR 138 N 9.72 0.05 0.70 3.10 -0.00 -1.90 0.33 116.97 128.97 1dmo h TYR 138 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.91 1dmo h TYR 138 Cb 0.94 -0.01 0.01 0.00 0.00 0.00 0.00 36.73 37.66 1dmo h TYR 138 CO 1.21 -0.03 -0.34 0.93 -0.00 0.00 0.00 178.16 179.93 1dmo h GLU 139 N 0.00 -0.91 0.00 0.10 4.39 -1.89 0.53 114.58 116.81 1dmo h GLU 139 Ca 0.93 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 60.69 1dmo h GLU 139 Cb 3.67 0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 32.53 1dmo h GLU 139 CO -0.06 -0.58 -0.02 0.93 -1.16 0.00 0.00 179.01 178.12 1dmo h GLU 140 N -1.09 0.00 0.00 2.33 3.07 -0.81 0.33 114.58 118.41 1dmo h GLU 140 Ca -0.10 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.59 1dmo h GLU 140 Cb 0.75 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.63 1dmo h GLU 140 CO 0.16 0.02 -0.85 0.35 -1.40 0.00 0.00 179.01 177.29 1dmo h PHE 141 N 0.00 0.00 -0.03 4.33 3.57 -0.45 -2.21 116.94 122.15 1dmo h PHE 141 Ca -0.00 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 1dmo h PHE 141 Cb 0.09 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1dmo h PHE 141 CO 0.00 0.85 -0.51 0.28 -2.23 0.00 0.00 178.31 176.70 1dmo h VAL 142 N 0.00 1.36 0.00 1.41 2.07 0.23 -2.49 116.25 118.83 1dmo h VAL 142 Ca -0.01 -1.74 -0.16 0.00 0.82 0.00 0.00 66.70 65.60 1dmo h VAL 142 Cb 1.59 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 33.24 1dmo h VAL 142 CO 0.11 0.50 -1.38 1.56 0.02 0.00 0.00 177.57 178.39 1dmo h GLN 143 N 0.06 0.00 -0.00 1.57 7.50 -1.52 -3.32 115.11 119.41 1dmo h GLN 143 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1dmo h GLN 143 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.45 1dmo h GLN 143 CO 0.07 0.29 -0.04 -0.12 -1.50 0.00 0.00 178.83 177.52 1dmo n MET 144 N -2.90 0.02 0.07 1.46 1.56 -0.83 -2.33 117.12 114.16 1dmo n MET 144 Ca -0.09 -0.00 -0.15 0.00 -0.27 0.00 0.00 57.70 57.18 1dmo n MET 144 Cb 0.83 -1.50 -0.14 0.00 2.15 0.00 0.00 33.22 34.56 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 0.22 0.00 2.12 2.86 -1.54 -3.42 114.93 115.17 1dmo h MET 145 Ca 0.00 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1dmo h MET 145 Cb 0.49 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.29 1dmo h MET 145 CO 0.00 1.09 0.00 2.41 1.06 0.00 0.00 176.91 181.47 1dmo n THR 146 N -3.43 0.00 -3.35 2.22 -1.04 -1.22 -5.06 114.28 102.40 1dmo n THR 146 Ca -0.14 0.41 0.00 0.00 -2.04 0.00 0.00 64.05 62.28 1dmo n THR 146 Cb 1.03 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.15 1dmo n THR 146 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dmo n ALA 147 N -2.25 0.00 0.00 2.41 0.00 -0.98 -5.13 120.51 114.55 1dmo n ALA 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dmo n ALA 147 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dmo n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13