#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 -1.74 -3.64 0.00 8.00 -1.26 -5.00 116.55 112.92 1dmo n ASP 2 Ca 0.00 0.53 -0.05 0.00 0.71 0.00 0.00 54.79 55.99 1dmo n ASP 2 Cb 0.00 -1.17 -0.06 0.00 -0.02 0.00 0.00 41.12 39.87 1dmo n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dmo s GLN 3 N -2.74 0.20 -0.16 -1.24 -2.07 -1.26 -5.10 119.66 107.30 1dmo s GLN 3 Ca 0.62 0.15 -0.10 0.00 -1.82 0.00 0.00 55.36 54.21 1dmo s GLN 3 Cb -0.33 0.10 0.04 0.00 -1.09 0.00 0.00 33.01 31.73 1dmo s GLN 3 CO 0.61 -0.04 0.21 1.28 -1.32 0.00 0.00 175.29 176.03 1dmo n LEU 4 N 1.28 -5.93 -4.57 2.60 4.77 -1.26 -5.03 117.00 108.86 1dmo n LEU 4 Ca -0.08 2.09 -0.24 0.00 -0.03 0.00 0.00 56.01 57.76 1dmo n LEU 4 Cb 0.57 -3.00 -0.09 0.00 -2.33 0.00 0.00 43.42 38.58 1dmo n LEU 4 CO 0.05 -3.87 -0.40 0.42 -1.33 0.00 0.00 177.39 172.26 1dmo s THR 5 N -0.57 3.03 0.28 -5.08 -4.23 -1.26 -4.97 115.64 102.83 1dmo s THR 5 Ca -0.24 -2.10 0.01 0.00 -1.18 0.00 0.00 61.69 58.17 1dmo s THR 5 Cb 0.02 -2.60 0.28 0.00 1.34 0.00 0.00 72.50 71.54 1dmo s THR 5 CO 0.67 -0.37 1.67 -0.33 -0.54 0.00 0.00 174.62 175.72 1dmo h GLU 6 N 2.11 0.27 -0.25 3.99 5.08 -1.99 1.25 114.58 125.04 1dmo h GLU 6 Ca -0.43 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1dmo h GLU 6 Cb 1.25 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1dmo h GLU 6 CO 0.60 0.18 0.14 0.93 -1.00 0.00 0.00 179.01 179.86 1dmo h GLU 7 N 0.28 0.33 -0.78 2.33 5.08 -1.99 0.02 114.58 119.86 1dmo h GLU 7 Ca 0.52 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.81 1dmo h GLU 7 Cb 0.99 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 1dmo h GLU 7 CO -0.58 0.24 0.31 0.37 -1.00 0.00 0.00 179.01 178.35 1dmo h GLN 8 N 0.34 1.16 -0.00 2.33 5.75 0.12 -0.11 115.11 124.69 1dmo h GLN 8 Ca 0.09 -0.21 -0.09 0.00 -0.15 0.00 0.00 58.65 58.29 1dmo h GLN 8 Cb 0.01 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.36 1dmo h GLN 8 CO -0.02 0.94 -0.42 0.82 -2.65 0.00 0.00 178.83 177.51 1dmo h ILE 9 N 1.12 1.30 -0.21 2.39 5.03 -0.14 -0.49 117.51 126.53 1dmo h ILE 9 Ca 0.26 -1.44 -0.09 0.00 -0.12 0.00 0.00 64.86 63.47 1dmo h ILE 9 Cb 0.22 1.77 -0.00 0.00 -3.03 0.00 0.00 36.82 35.78 1dmo h ILE 9 CO -0.02 0.41 -0.20 0.00 -0.68 0.00 0.00 178.15 177.66 1dmo h ALA 10 N 1.58 0.30 -0.09 1.87 0.00 0.01 -1.39 119.26 121.54 1dmo h ALA 10 Ca -0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1dmo h ALA 10 Cb 0.74 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1dmo h ALA 10 CO 0.05 0.24 -0.25 0.93 0.00 0.00 0.00 179.25 180.23 1dmo h GLU 11 N 0.18 0.16 0.39 0.00 3.07 -0.82 -1.78 114.58 115.78 1dmo h GLU 11 Ca 0.03 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1dmo h GLU 11 Cb 0.75 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 1dmo h GLU 11 CO 0.05 0.41 -0.19 0.74 -1.40 0.00 0.00 179.01 178.62 1dmo h PHE 12 N 0.15 -0.48 -0.77 4.33 -1.00 -0.83 -2.39 116.94 115.94 1dmo h PHE 12 Ca 0.02 -0.01 0.12 0.00 2.81 0.00 0.00 57.97 60.91 1dmo h PHE 12 Cb 0.53 0.16 -0.05 0.00 3.61 0.00 0.00 35.95 40.20 1dmo h PHE 12 CO 0.01 -0.19 0.51 -0.22 -1.61 0.00 0.00 178.31 176.80 1dmo h LYS 13 N -0.73 0.57 0.36 1.51 3.64 -1.06 0.14 116.57 121.00 1dmo h LYS 13 Ca -0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1dmo h LYS 13 Cb 0.51 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 1dmo h LYS 13 CO 0.09 0.38 -0.44 1.49 -2.27 0.00 0.00 179.45 178.69 1dmo h GLU 14 N 0.58 -0.81 0.11 1.90 4.57 -0.93 0.73 114.58 120.74 1dmo h GLU 14 Ca 0.37 0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.60 1dmo h GLU 14 Cb 0.62 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.40 1dmo h GLU 14 CO -0.14 -0.54 -0.06 0.00 -1.18 0.00 0.00 179.01 177.10 1dmo h ALA 15 N -0.51 -0.15 -0.52 2.92 0.00 -0.84 0.30 119.26 120.46 1dmo h ALA 15 Ca -0.03 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.00 1dmo h ALA 15 Cb 0.76 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1dmo h ALA 15 CO -0.11 -0.59 0.52 0.35 0.00 0.00 0.00 179.25 179.42 1dmo h PHE 16 N -0.16 0.00 0.08 0.00 3.57 -0.35 0.05 116.94 120.13 1dmo h PHE 16 Ca -0.01 0.00 -0.34 0.00 3.53 0.00 0.00 57.97 61.15 1dmo h PHE 16 Cb 0.12 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 1dmo h PHE 16 CO -0.08 0.00 -1.90 0.45 -2.23 0.00 0.00 178.31 174.56 1dmo n SER 17 N -3.77 1.65 -0.04 0.41 2.88 0.25 -3.80 113.62 111.20 1dmo n SER 17 Ca 0.10 0.28 0.06 0.00 -1.33 0.00 0.00 58.87 57.98 1dmo n SER 17 Cb 0.73 -0.55 0.43 0.00 -0.75 0.00 0.00 64.21 64.07 1dmo n SER 17 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1dmo h LEU 18 N 0.05 0.47 -2.60 2.46 3.38 0.15 0.32 115.31 119.53 1dmo h LEU 18 Ca -0.38 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1dmo h LEU 18 Cb 2.03 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.67 1dmo h LEU 18 CO 0.08 0.32 0.00 0.49 0.09 0.00 0.00 178.44 179.43 1dmo n PHE 19 N -4.47 1.29 -1.24 1.13 3.72 -0.86 -4.92 117.46 112.12 1dmo n PHE 19 Ca 0.05 -0.48 -0.05 0.00 -0.05 0.00 0.00 57.45 56.93 1dmo n PHE 19 Cb 0.15 -0.29 0.03 0.00 -0.94 0.00 0.00 39.48 38.43 1dmo n PHE 19 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1dmo n ASP 20 N 0.62 0.03 -2.86 4.37 2.03 0.10 -4.80 116.55 116.04 1dmo n ASP 20 Ca 0.19 -1.09 -0.12 0.00 0.52 0.00 0.00 54.79 54.30 1dmo n ASP 20 Cb 0.80 -0.17 0.03 0.00 -0.72 0.00 0.00 41.12 41.07 1dmo n ASP 20 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1dmo n LYS 21 N -1.46 0.86 -3.31 -0.67 5.02 -1.26 -5.04 118.16 112.31 1dmo n LYS 21 Ca 0.03 -2.21 -0.27 0.00 -2.02 0.00 0.00 58.31 53.84 1dmo n LYS 21 Cb 0.10 -1.32 0.03 0.00 -0.02 0.00 0.00 35.03 33.81 1dmo n LYS 21 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1dmo n ASP 22 N 1.06 -5.55 0.00 4.39 8.00 -1.26 -4.91 116.55 118.28 1dmo n ASP 22 Ca 0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1dmo n ASP 22 Cb 0.64 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.22 1dmo n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dmo n GLY 23 N 0.26 -0.02 0.00 0.44 0.00 -1.26 -5.04 105.19 99.57 1dmo n GLY 23 Ca -0.06 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1dmo n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dmo n ASP 24 N 0.00 0.00 0.00 1.61 5.68 -1.26 -5.07 116.55 117.51 1dmo n ASP 24 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1dmo n ASP 24 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1dmo n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dmo n GLY 25 N 0.00 0.62 3.69 6.12 0.00 -1.26 -5.12 105.19 109.25 1dmo n GLY 25 Ca 0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 0.22 2.61 -4.23 -1.26 -4.03 115.64 108.95 1dmo s THR 26 Ca 0.00 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 1dmo s THR 26 Cb 0.00 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 71.65 1dmo s THR 26 CO 0.00 0.00 0.14 0.27 -0.54 0.00 0.00 174.62 174.49 1dmo s ILE 27 N -3.93 0.08 -0.07 2.99 -4.36 -0.40 -4.46 121.20 111.04 1dmo s ILE 27 Ca 0.18 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.52 1dmo s ILE 27 Cb -0.03 -2.52 -0.04 0.00 1.25 0.00 0.00 42.46 41.13 1dmo s ILE 27 CO 0.09 0.00 0.15 0.42 0.24 0.00 0.00 174.94 175.84 1dmo s THR 28 N -4.03 5.45 0.54 8.37 -4.23 -1.26 0.04 115.64 120.52 1dmo s THR 28 Ca 0.39 0.04 0.46 0.00 -1.18 0.00 0.00 61.69 61.40 1dmo s THR 28 Cb 0.07 -3.44 0.68 0.00 1.34 0.00 0.00 72.50 71.14 1dmo s THR 28 CO 0.14 0.50 1.62 0.71 -0.54 0.00 0.00 174.62 177.04 1dmo h THR 29 N 3.50 0.08 0.18 3.99 1.35 -1.88 0.48 112.91 120.60 1dmo h THR 29 Ca -0.52 -0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.32 1dmo h THR 29 Cb 1.21 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1dmo h THR 29 CO 0.62 0.00 -0.08 0.50 -0.25 0.00 0.00 175.52 176.31 1dmo h LYS 30 N 0.01 -0.23 0.00 4.72 3.64 -1.93 -2.72 116.57 120.07 1dmo h LYS 30 Ca 0.87 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 60.26 1dmo h LYS 30 Cb 3.39 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 35.26 1dmo h LYS 30 CO -0.07 0.18 0.00 0.39 -2.27 0.00 0.00 179.45 177.68 1dmo n GLU 31 N -4.98 0.02 0.15 1.90 4.71 0.15 -3.09 120.64 119.51 1dmo n GLU 31 Ca -0.08 0.37 -0.14 0.00 -0.01 0.00 0.00 57.16 57.30 1dmo n GLU 31 Cb 0.26 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 29.11 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 -1.22 -0.94 -4.62 5.85 -0.84 -0.17 115.31 113.36 1dmo h LEU 32 Ca 0.00 0.12 0.25 0.00 0.84 0.00 0.00 57.88 59.08 1dmo h LEU 32 Cb 0.08 0.43 -0.13 0.00 0.37 0.00 0.00 40.66 41.42 1dmo h LEU 32 CO 0.00 -0.49 0.46 1.23 -0.34 0.00 0.00 178.44 179.30 1dmo h GLY 33 N -0.70 1.71 0.97 3.75 0.00 -1.70 0.21 103.07 107.32 1dmo h GLY 33 Ca -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 1dmo h GLY 33 CO -0.16 -0.31 0.21 -0.84 0.00 0.00 0.00 176.54 175.44 1dmo h THR 34 N 0.42 1.21 -0.23 4.70 2.02 -1.50 -2.35 112.91 117.17 1dmo h THR 34 Ca 0.61 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 1dmo h THR 34 Cb 1.22 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1dmo h THR 34 CO -0.54 0.24 0.09 0.58 0.37 0.00 0.00 175.52 176.25 1dmo h VAL 35 N 0.66 1.18 -0.88 3.16 2.07 0.11 -2.15 116.25 120.40 1dmo h VAL 35 Ca 0.17 -0.55 0.18 0.00 0.82 0.00 0.00 66.70 67.32 1dmo h VAL 35 Cb 0.18 1.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1dmo h VAL 35 CO -0.02 0.18 0.58 0.24 0.02 0.00 0.00 177.57 178.57 1dmo h MET 36 N 0.22 0.45 -0.01 1.57 2.86 -0.86 0.17 114.93 119.32 1dmo h MET 36 Ca 0.08 -0.03 -0.16 0.00 -2.06 0.00 0.00 59.70 57.53 1dmo h MET 36 Cb 0.20 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1dmo h MET 36 CO -0.00 0.30 -0.75 -0.09 1.06 0.00 0.00 176.91 177.42 1dmo h ARG 37 N 0.46 0.09 0.00 1.72 2.43 -0.92 -3.11 114.38 115.06 1dmo h ARG 37 Ca 0.45 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.44 1dmo h ARG 37 Cb 1.04 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 1dmo h ARG 37 CO -0.18 0.79 -0.48 1.03 -1.51 0.00 0.00 179.97 179.63 1dmo h SER 38 N 0.06 0.00 -0.98 -3.80 0.87 -0.07 -3.02 113.55 106.60 1dmo h SER 38 Ca -0.02 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1dmo h SER 38 Cb 1.32 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.22 1dmo h SER 38 CO 0.10 0.48 0.64 -0.07 -0.53 0.00 0.00 176.83 177.45 1dmo h LEU 39 N 0.00 1.07 0.00 2.23 4.07 -1.26 -3.46 115.31 117.95 1dmo h LEU 39 Ca -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1dmo h LEU 39 Cb 0.89 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.38 1dmo h LEU 39 CO 0.06 0.73 0.00 0.61 -1.08 0.00 0.00 178.44 178.76 1dmo n GLY 40 N -1.36 1.28 3.94 0.83 0.00 -1.14 -5.05 105.19 103.68 1dmo n GLY 40 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 1dmo n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1dmo s GLN 41 N 0.00 2.17 -0.39 1.61 2.00 -1.26 -5.05 119.66 118.74 1dmo s GLN 41 Ca 0.00 -0.34 -0.08 0.00 -2.00 0.00 0.00 55.36 52.95 1dmo s GLN 41 Cb 0.00 -2.19 0.07 0.00 0.80 0.00 0.00 33.01 31.68 1dmo s GLN 41 CO 0.00 -1.23 0.20 1.21 -0.50 0.00 0.00 175.29 174.97 1dmo s ASN 42 N -4.53 5.51 1.06 6.67 2.47 -1.26 -4.29 114.94 120.57 1dmo s ASN 42 Ca 0.60 -1.40 -0.14 0.00 0.42 0.00 0.00 52.86 52.34 1dmo s ASN 42 Cb -0.10 -1.94 0.22 0.00 -1.45 0.00 0.00 41.25 37.97 1dmo s ASN 42 CO 0.44 -0.46 1.11 -2.16 -3.72 0.00 0.00 177.10 172.31 1dmo s PRO 43 N 1.40 -0.03 -0.17 0.43 0.04 -1.26 -5.06 135.00 130.35 1dmo s PRO 43 Ca 0.02 0.28 -0.01 0.00 0.04 0.00 0.00 61.00 61.32 1dmo s PRO 43 Cb -0.22 -1.70 0.05 0.00 0.04 0.00 0.00 34.50 32.67 1dmo s PRO 43 CO 0.02 -2.99 -0.01 0.99 0.04 0.00 0.00 177.00 175.05 1dmo s THR 44 N -3.04 0.83 0.55 1.26 2.01 -1.26 -4.99 115.64 111.00 1dmo s THR 44 Ca 0.67 -0.55 0.46 0.00 0.31 0.00 0.00 61.69 62.58 1dmo s THR 44 Cb -0.15 -1.13 0.67 0.00 0.01 0.00 0.00 72.50 71.90 1dmo s THR 44 CO 0.57 0.00 1.48 -0.62 -0.69 0.00 0.00 174.62 175.36 1dmo n GLU 45 N 4.96 0.00 0.00 4.92 -0.58 -1.26 -0.20 120.64 128.48 1dmo n GLU 45 Ca -0.10 1.05 0.00 0.00 -0.42 0.00 0.00 57.16 57.69 1dmo n GLU 45 Cb 0.47 -2.46 0.00 0.00 -0.57 0.00 0.00 31.44 28.89 1dmo n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1dmo n ALA 46 N -2.79 -0.10 -0.25 0.62 0.00 -1.26 -2.29 120.51 114.45 1dmo n ALA 46 Ca 0.40 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.90 1dmo n ALA 46 Cb 1.90 0.00 0.18 0.00 0.00 0.00 0.00 19.45 21.53 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 0.23 -0.91 0.00 5.08 -1.74 1.02 114.58 118.26 1dmo h GLU 47 Ca 0.00 -0.01 0.23 0.00 -1.00 0.00 0.00 59.36 58.57 1dmo h GLU 47 Cb 0.00 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.07 1dmo h GLU 47 CO 0.00 0.15 0.42 1.25 -1.00 0.00 0.00 179.01 179.83 1dmo h LEU 48 N 0.23 0.38 -0.69 1.33 5.85 -0.70 0.49 115.31 122.21 1dmo h LEU 48 Ca 0.41 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 59.28 1dmo h LEU 48 Cb 0.71 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1dmo h LEU 48 CO -0.53 0.01 0.41 -0.61 -0.34 0.00 0.00 178.44 177.38 1dmo h GLN 49 N 0.42 0.93 -0.82 1.25 4.15 0.15 -2.01 115.11 119.19 1dmo h GLN 49 Ca 0.57 -0.09 0.13 0.00 0.77 0.00 0.00 58.65 60.04 1dmo h GLN 49 Cb 1.10 -0.19 -0.06 0.00 0.21 0.00 0.00 27.48 28.53 1dmo h GLN 49 CO -0.52 0.67 0.54 -0.44 -1.93 0.00 0.00 178.83 177.14 1dmo h ASP 50 N 0.94 0.57 -0.10 -0.69 3.32 0.68 -1.83 116.42 119.31 1dmo h ASP 50 Ca 0.25 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.27 1dmo h ASP 50 Cb -0.02 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 1dmo h ASP 50 CO -0.05 0.31 -0.15 0.24 -1.72 0.00 0.00 179.24 177.88 1dmo h MET 51 N 0.62 0.27 -0.48 3.56 2.86 -0.91 -3.10 114.93 117.74 1dmo h MET 51 Ca 0.40 -0.16 0.08 0.00 -2.06 0.00 0.00 59.70 57.96 1dmo h MET 51 Cb 0.68 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.30 1dmo h MET 51 CO -0.16 0.73 0.12 0.82 1.06 0.00 0.00 176.91 179.48 1dmo h ILE 52 N -0.17 0.76 0.00 -1.22 5.03 -0.94 0.32 117.51 121.29 1dmo h ILE 52 Ca 0.01 -0.09 0.00 0.00 -0.12 0.00 0.00 64.86 64.66 1dmo h ILE 52 Cb 0.70 0.47 0.00 0.00 -3.03 0.00 0.00 36.82 34.97 1dmo h ILE 52 CO 0.03 0.05 0.00 -3.20 -0.68 0.00 0.00 178.15 174.35 1dmo n ASN 53 N -5.08 0.00 -0.03 1.72 5.15 -0.79 -2.47 115.26 113.76 1dmo n ASN 53 Ca 0.05 0.48 -0.21 0.00 -0.60 0.00 0.00 54.58 54.29 1dmo n ASN 53 Cb 0.22 -0.49 -0.13 0.00 -0.53 0.00 0.00 39.78 38.86 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 0.16 0.00 1.20 4.81 -0.30 -3.46 114.58 116.99 1dmo h GLU 54 Ca 0.00 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1dmo h GLU 54 Cb 0.11 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1dmo h GLU 54 CO 0.00 1.13 0.00 1.33 -0.73 0.00 0.00 179.01 180.74 1dmo n VAL 55 N -3.96 0.00 -2.87 0.32 0.24 -0.94 -4.72 118.33 106.40 1dmo n VAL 55 Ca -0.30 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 61.92 1dmo n VAL 55 Cb 0.87 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 33.23 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 -1.36 0.00 -1.34 -0.08 -1.25 -4.71 116.55 107.81 1dmo n ASP 56 Ca 0.00 0.16 0.10 0.00 -1.51 0.00 0.00 54.79 53.55 1dmo n ASP 56 Cb 0.00 -1.28 -0.10 0.00 2.34 0.00 0.00 41.12 42.09 1dmo n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1dmo n ALA 57 N -2.78 4.26 0.58 -1.67 0.00 -1.26 -4.14 120.51 115.50 1dmo n ALA 57 Ca 0.01 -0.56 0.10 0.00 0.00 0.00 0.00 53.44 53.00 1dmo n ALA 57 Cb 0.50 -0.80 0.42 0.00 0.00 0.00 0.00 19.45 19.57 1dmo n ALA 57 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1dmo n ASP 58 N -1.67 0.25 0.00 0.00 2.03 -1.26 -4.86 116.55 111.04 1dmo n ASP 58 Ca 0.03 0.55 0.00 0.00 0.52 0.00 0.00 54.79 55.88 1dmo n ASP 58 Cb 0.38 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.17 1dmo n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dmo n GLY 59 N 0.42 2.73 0.12 0.27 0.00 -1.26 -4.74 105.19 102.73 1dmo n GLY 59 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 0.00 1.61 -0.26 -1.90 -3.47 115.58 111.56 1dmo h ASN 60 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1dmo h ASN 60 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1dmo h ASN 60 CO 0.00 0.63 0.00 0.61 -1.06 0.00 0.00 177.43 177.61 1dmo n GLY 61 N 1.28 0.69 3.85 2.83 0.00 -1.26 -5.04 105.19 107.54 1dmo n GLY 61 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.23 4.84 0.08 2.61 -4.23 -1.26 -3.25 115.64 112.19 1dmo s THR 62 Ca 0.00 -0.84 0.05 0.00 -1.18 0.00 0.00 61.69 59.72 1dmo s THR 62 Cb 0.00 -3.44 -0.04 0.00 1.34 0.00 0.00 72.50 70.36 1dmo s THR 62 CO 0.00 -0.04 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.37 1dmo s ILE 63 N -1.67 3.76 0.42 2.99 1.01 0.11 -4.83 121.20 123.00 1dmo s ILE 63 Ca 0.32 -1.05 0.08 0.00 0.00 0.00 0.00 60.65 60.00 1dmo s ILE 63 Cb -0.11 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 1dmo s ILE 63 CO 0.25 0.15 0.43 1.51 0.00 0.00 0.00 174.94 177.28 1dmo s ASP 64 N -2.16 5.17 0.20 3.58 1.47 -1.26 -1.28 116.67 122.39 1dmo s ASP 64 Ca 0.23 -0.69 -0.10 0.00 1.18 0.00 0.00 52.55 53.17 1dmo s ASP 64 Cb -0.11 -0.54 0.23 0.00 -0.34 0.00 0.00 42.92 42.15 1dmo s ASP 64 CO 0.15 -0.70 1.80 0.15 0.68 0.00 0.00 175.17 177.25 1dmo h PHE 65 N 0.92 0.62 0.56 2.11 3.57 -1.97 -1.79 116.94 120.96 1dmo h PHE 65 Ca -0.41 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.10 1dmo h PHE 65 Cb 1.27 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 1dmo h PHE 65 CO 0.50 0.29 -0.45 -1.35 -2.23 0.00 0.00 178.31 175.07 1dmo h PRO 66 N 0.63 -0.95 -0.88 6.41 0.10 -1.96 -2.26 132.00 133.09 1dmo h PRO 66 Ca 0.29 0.07 0.14 0.00 0.10 0.00 0.00 66.00 66.59 1dmo h PRO 66 Cb 0.20 0.22 -0.09 0.00 0.10 0.00 0.00 31.00 31.42 1dmo h PRO 66 CO -0.19 -0.64 0.49 0.93 0.10 0.00 0.00 178.00 178.70 1dmo h GLU 67 N -0.99 0.71 -0.83 1.05 5.08 -1.95 0.31 114.58 117.96 1dmo h GLU 67 Ca -0.07 -0.04 0.18 0.00 -1.00 0.00 0.00 59.36 58.43 1dmo h GLU 67 Cb 0.84 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 1dmo h GLU 67 CO -0.00 0.47 0.55 0.35 -1.00 0.00 0.00 179.01 179.38 1dmo h PHE 68 N 0.73 0.47 0.09 4.33 3.57 -0.77 -0.07 116.94 125.29 1dmo h PHE 68 Ca 0.47 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.98 1dmo h PHE 68 Cb 0.60 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.19 1dmo h PHE 68 CO -0.06 0.15 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.05 1dmo h LEU 69 N 0.37 -0.11 -0.73 0.59 3.38 0.14 -0.90 115.31 118.05 1dmo h LEU 69 Ca 0.42 -0.30 0.13 0.00 0.09 0.00 0.00 57.88 58.21 1dmo h LEU 69 Cb 1.06 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.75 1dmo h LEU 69 CO -0.14 0.25 0.31 0.74 0.09 0.00 0.00 178.44 179.70 1dmo h THR 70 N -0.48 0.71 -0.27 0.22 2.02 -0.78 0.20 112.91 114.53 1dmo h THR 70 Ca -0.01 -0.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.91 1dmo h THR 70 Cb 0.40 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1dmo h THR 70 CO 0.02 0.09 -0.22 0.24 0.37 0.00 0.00 175.52 176.01 1dmo h MET 71 N 0.48 0.50 -0.41 6.66 2.86 -0.98 -2.74 114.93 121.29 1dmo h MET 71 Ca 0.39 -0.18 -0.09 0.00 -2.06 0.00 0.00 59.70 57.76 1dmo h MET 71 Cb 0.55 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 1dmo h MET 71 CO -0.37 0.69 -0.11 0.52 1.06 0.00 0.00 176.91 178.71 1dmo h MET 72 N 0.44 0.80 -0.64 1.72 2.07 0.64 -2.36 114.93 117.61 1dmo h MET 72 Ca 0.07 -0.31 0.08 0.00 -2.07 0.00 0.00 59.70 57.47 1dmo h MET 72 Cb 0.64 -0.04 -0.06 0.00 -1.87 0.00 0.00 31.60 30.26 1dmo h MET 72 CO 0.05 0.93 0.30 0.00 1.07 0.00 0.00 176.91 179.26 1dmo h ALA 73 N 0.85 0.85 0.20 6.32 0.00 -0.49 0.48 119.26 127.47 1dmo h ALA 73 Ca 0.10 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1dmo h ALA 73 Cb 0.64 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1dmo h ALA 73 CO 0.04 -0.08 -0.15 -0.09 0.00 0.00 0.00 179.25 178.97 1dmo h ARG 74 N 0.54 -0.34 -0.03 0.00 2.43 -1.29 0.27 114.38 115.97 1dmo h ARG 74 Ca 0.31 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.51 1dmo h ARG 74 Cb 0.30 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1dmo h ARG 74 CO -0.25 -0.23 0.03 -0.22 -1.51 0.00 0.00 179.97 177.80 1dmo h LYS 75 N -0.35 0.00 -0.60 0.20 3.64 -0.80 0.29 116.57 118.95 1dmo h LYS 75 Ca -0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1dmo h LYS 75 Cb 0.31 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1dmo h LYS 75 CO -0.01 0.00 0.02 -1.33 -2.27 0.00 0.00 179.45 175.86 1dmo n MET 76 N -3.90 4.84 -2.25 1.90 2.81 0.16 -4.99 117.12 115.68 1dmo n MET 76 Ca -0.02 -3.15 -0.03 0.00 -1.81 0.00 0.00 57.70 52.68 1dmo n MET 76 Cb 0.12 -2.27 -0.03 0.00 -0.71 0.00 0.00 33.22 30.33 1dmo n MET 76 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1dmo n LYS 77 N 0.57 -3.80 0.00 0.03 4.76 0.10 -4.68 118.16 115.15 1dmo n LYS 77 Ca 0.29 2.93 0.00 0.00 -2.87 0.00 0.00 58.31 58.65 1dmo n LYS 77 Cb 1.22 -4.08 0.00 0.00 -1.84 0.00 0.00 35.03 30.33 1dmo n LYS 77 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1dmo n ASP 78 N 1.38 0.00 -2.27 4.39 5.75 -1.01 -4.81 116.55 119.98 1dmo n ASP 78 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.56 1dmo n ASP 78 Cb 0.34 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1dmo n ASP 78 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1dmo n THR 79 N 0.00 0.00 -2.55 2.12 5.66 -1.26 -4.89 114.28 113.37 1dmo n THR 79 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1dmo n THR 79 Cb 0.00 -0.86 -0.01 0.00 -1.55 0.00 0.00 70.33 67.90 1dmo n THR 79 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1dmo s ASP 80 N -1.00 6.63 0.44 1.09 2.15 -1.26 -4.74 116.67 119.98 1dmo s ASP 80 Ca 0.00 -2.03 0.30 0.00 0.43 0.00 0.00 52.55 51.25 1dmo s ASP 80 Cb 0.00 -2.58 1.24 0.00 -0.30 0.00 0.00 42.92 41.28 1dmo s ASP 80 CO 0.00 -1.38 1.89 0.28 -0.17 0.00 0.00 175.17 175.79 1dmo h SER 81 N 8.52 0.00 -1.08 -0.34 0.02 -2.00 -3.13 113.55 115.54 1dmo h SER 81 Ca 0.34 0.00 0.30 0.00 -0.84 0.00 0.00 61.79 61.60 1dmo h SER 81 Cb 0.93 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.35 1dmo h SER 81 CO 1.44 0.00 0.68 -0.33 -1.14 0.00 0.00 176.83 177.48 1dmo h GLU 82 N 0.00 0.34 0.17 3.45 5.08 -1.99 0.27 114.58 121.91 1dmo h GLU 82 Ca 0.00 -0.02 -0.26 0.00 -1.00 0.00 0.00 59.36 58.08 1dmo h GLU 82 Cb 0.45 -0.08 0.03 0.00 0.50 0.00 0.00 28.75 29.65 1dmo h GLU 82 CO 0.00 0.23 -1.14 0.93 -1.00 0.00 0.00 179.01 178.03 1dmo h GLU 83 N 0.35 0.47 0.00 2.33 5.08 -1.96 -2.53 114.58 118.32 1dmo h GLU 83 Ca 0.66 -0.73 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1dmo h GLU 83 Cb 1.69 0.26 -0.00 0.00 0.50 0.00 0.00 28.75 31.20 1dmo h GLU 83 CO -0.38 1.34 -0.04 1.49 -1.00 0.00 0.00 179.01 180.41 1dmo h GLU 84 N -0.03 0.00 0.02 2.33 4.81 -0.95 -2.46 114.58 118.30 1dmo h GLU 84 Ca -0.19 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.04 1dmo h GLU 84 Cb 1.88 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.26 1dmo h GLU 84 CO 0.22 0.04 -0.01 0.82 -0.73 0.00 0.00 179.01 179.35 1dmo h ILE 85 N 0.00 0.03 -1.18 2.32 2.04 -0.61 -2.64 117.51 117.47 1dmo h ILE 85 Ca -0.00 -1.00 0.39 0.00 1.00 0.00 0.00 64.86 65.25 1dmo h ILE 85 Cb 0.10 0.05 -0.13 0.00 -0.74 0.00 0.00 36.82 36.10 1dmo h ILE 85 CO 0.01 0.01 0.74 -0.09 0.00 0.00 0.00 178.15 178.81 1dmo h ARG 86 N -1.01 0.17 -0.06 2.37 2.43 -1.33 0.48 114.38 117.42 1dmo h ARG 86 Ca -0.00 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1dmo h ARG 86 Cb 0.04 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1dmo h ARG 86 CO 0.00 0.11 -0.25 1.49 -1.51 0.00 0.00 179.97 179.81 1dmo h GLU 87 N 0.17 0.28 -1.59 0.20 4.57 -1.54 -2.64 114.58 114.03 1dmo h GLU 87 Ca 0.77 -0.22 0.46 0.00 -1.18 0.00 0.00 59.36 59.19 1dmo h GLU 87 Cb 2.20 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 30.77 1dmo h GLU 87 CO -0.47 0.86 1.15 0.00 -1.18 0.00 0.00 179.01 179.36 1dmo h ALA 88 N 0.43 3.51 0.04 2.92 0.00 0.34 0.33 119.26 126.83 1dmo h ALA 88 Ca -0.01 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1dmo h ALA 88 Cb 0.89 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1dmo h ALA 88 CO 0.05 -1.97 -0.86 0.74 0.00 0.00 0.00 179.25 177.21 1dmo h PHE 89 N 0.00 0.17 -1.10 0.00 0.04 -1.36 -3.33 116.94 111.35 1dmo h PHE 89 Ca 0.75 -0.12 0.31 0.00 2.80 0.00 0.00 57.97 61.71 1dmo h PHE 89 Cb 3.05 -0.01 -0.06 0.00 2.20 0.00 0.00 35.95 41.13 1dmo h PHE 89 CO 0.00 1.34 0.76 -0.09 -0.60 0.00 0.00 178.31 179.72 1dmo h ARG 90 N -0.76 0.13 -0.83 1.51 2.43 -0.01 0.34 114.38 117.19 1dmo h ARG 90 Ca -0.21 -0.01 0.24 0.00 -0.81 0.00 0.00 59.98 59.19 1dmo h ARG 90 Cb 1.36 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.85 1dmo h ARG 90 CO -0.04 0.09 1.03 0.28 -1.51 0.00 0.00 179.97 179.82 1dmo h VAL 91 N 0.14 0.07 0.00 0.20 2.07 -1.40 0.80 116.25 118.13 1dmo h VAL 91 Ca 0.56 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.08 1dmo h VAL 91 Cb 1.94 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1dmo h VAL 91 CO -0.11 0.00 -0.29 0.49 0.02 0.00 0.00 177.57 177.68 1dmo n PHE 92 N -3.29 0.00 -1.65 1.57 3.72 0.10 -4.83 117.46 113.07 1dmo n PHE 92 Ca 0.18 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.19 1dmo n PHE 92 Cb 1.29 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 39.78 1dmo n PHE 92 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1dmo n ASP 93 N -1.15 3.13 0.01 4.37 -0.08 0.28 -4.55 116.55 118.56 1dmo n ASP 93 Ca 0.01 -2.73 0.13 0.00 -1.51 0.00 0.00 54.79 50.68 1dmo n ASP 93 Cb 0.08 -1.44 0.41 0.00 2.34 0.00 0.00 41.12 42.51 1dmo n ASP 93 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1dmo n LYS 94 N 7.40 0.03 0.06 -0.67 5.02 -1.26 -3.89 118.16 124.85 1dmo n LYS 94 Ca 0.49 0.01 -0.20 0.00 -2.02 0.00 0.00 58.31 56.58 1dmo n LYS 94 Cb 0.43 -1.52 -0.15 0.00 -0.02 0.00 0.00 35.03 33.77 1dmo n LYS 94 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1dmo h ASP 95 N 0.00 0.49 0.00 4.39 1.82 -1.93 -3.48 116.42 117.71 1dmo h ASP 95 Ca 0.00 -0.95 0.00 0.00 -0.39 0.00 0.00 57.03 55.69 1dmo h ASP 95 Cb 0.52 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.37 1dmo h ASP 95 CO 0.00 1.43 0.00 0.61 -1.61 0.00 0.00 179.24 179.67 1dmo n GLY 96 N 1.68 0.70 0.00 -0.78 0.00 -1.25 -4.99 105.19 100.55 1dmo n GLY 96 Ca -0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.87 1dmo n GLY 96 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1dmo h ASN 97 N 0.00 0.00 0.00 1.61 4.21 -1.93 -3.49 115.58 115.98 1dmo h ASN 97 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1dmo h ASN 97 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1dmo h ASN 97 CO 0.00 0.04 0.00 0.61 -1.29 0.00 0.00 177.43 176.79 1dmo n GLY 98 N 1.96 0.00 2.86 2.83 0.00 -1.26 -5.15 105.19 106.43 1dmo n GLY 98 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 0.46 0.23 1.61 1.51 -1.26 -3.90 117.35 116.00 1dmo s TYR 99 Ca 0.00 -0.07 0.12 0.00 -1.01 0.00 0.00 57.07 56.10 1dmo s TYR 99 Cb 0.00 -0.47 -0.05 0.00 -0.11 0.00 0.00 41.96 41.34 1dmo s TYR 99 CO 0.00 -0.13 -0.21 0.96 -1.11 0.00 0.00 175.55 175.05 1dmo s ILE 100 N 0.85 2.45 0.30 2.71 -4.36 -0.48 -4.85 121.20 117.81 1dmo s ILE 100 Ca -0.09 -2.19 -0.29 0.00 -0.26 0.00 0.00 60.65 57.82 1dmo s ILE 100 Cb -0.13 -2.23 -0.10 0.00 1.25 0.00 0.00 42.46 41.26 1dmo s ILE 100 CO -0.01 -0.24 1.24 -0.44 0.24 0.00 0.00 174.94 175.73 1dmo s SER 101 N -3.06 6.94 0.53 4.36 0.01 -1.26 -0.08 113.70 121.14 1dmo s SER 101 Ca 0.25 2.53 0.18 0.00 1.31 0.00 0.00 55.95 60.22 1dmo s SER 101 Cb -0.07 -2.64 1.34 0.00 0.21 0.00 0.00 66.02 64.87 1dmo s SER 101 CO 0.12 -0.41 2.16 0.00 0.41 0.00 0.00 173.24 175.52 1dmo h ALA 102 N 3.69 1.92 0.52 1.44 0.00 -1.90 -1.54 119.26 123.39 1dmo h ALA 102 Ca -0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1dmo h ALA 102 Cb 1.22 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.01 1dmo h ALA 102 CO 0.67 0.01 -0.25 0.00 0.00 0.00 0.00 179.25 179.68 1dmo h ALA 103 N 1.99 -1.01 -0.86 0.00 0.00 -1.95 -0.71 119.26 116.73 1dmo h ALA 103 Ca -0.00 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 54.94 1dmo h ALA 103 Cb 0.01 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1dmo h ALA 103 CO 0.00 -0.95 0.57 0.93 0.00 0.00 0.00 179.25 179.80 1dmo h GLU 104 N -0.82 0.41 -0.39 0.00 4.39 -1.92 0.60 114.58 116.86 1dmo h GLU 104 Ca -0.07 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1dmo h GLU 104 Cb 0.54 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1dmo h GLU 104 CO 0.12 0.27 0.19 1.25 -1.16 0.00 0.00 179.01 179.68 1dmo h LEU 105 N 0.42 0.50 -1.50 1.33 6.46 -1.07 -1.54 115.31 119.90 1dmo h LEU 105 Ca 0.44 -0.12 0.18 0.00 -0.12 0.00 0.00 57.88 58.27 1dmo h LEU 105 Cb 1.06 -0.13 -0.06 0.00 -0.73 0.00 0.00 40.66 40.80 1dmo h LEU 105 CO -0.16 0.48 0.57 -0.09 -0.62 0.00 0.00 178.44 178.62 1dmo h ARG 106 N 0.49 0.43 -0.22 1.25 2.43 0.69 0.45 114.38 119.89 1dmo h ARG 106 Ca 0.13 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 1dmo h ARG 106 Cb 0.10 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1dmo h ARG 106 CO -0.02 0.28 -0.35 1.25 -1.51 0.00 0.00 179.97 179.62 1dmo h HIS 107 N 0.44 0.56 -0.51 2.20 2.76 -1.07 -2.94 115.15 116.58 1dmo h HIS 107 Ca 0.44 -0.14 0.04 0.00 -2.20 0.00 0.00 60.37 58.51 1dmo h HIS 107 Cb 1.04 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 29.84 1dmo h HIS 107 CO -0.00 0.77 0.28 0.28 -1.30 0.00 0.00 177.93 177.96 1dmo h VAL 108 N 0.40 0.99 -0.32 5.26 2.07 0.43 0.28 116.25 125.36 1dmo h VAL 108 Ca 0.04 -0.19 0.09 0.00 0.82 0.00 0.00 66.70 67.47 1dmo h VAL 108 Cb 0.81 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1dmo h VAL 108 CO 0.07 0.10 0.24 0.24 0.02 0.00 0.00 177.57 178.23 1dmo h MET 109 N 0.54 0.00 -0.09 1.57 2.07 -1.28 0.13 114.93 117.87 1dmo h MET 109 Ca 0.22 0.00 -0.19 0.00 -2.07 0.00 0.00 59.70 57.66 1dmo h MET 109 Cb 0.09 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.82 1dmo h MET 109 CO -0.13 0.00 -0.73 1.15 1.07 0.00 0.00 176.91 178.27 1dmo h THR 110 N 0.00 1.36 -0.21 2.22 2.02 -0.92 0.75 112.91 118.14 1dmo h THR 110 Ca 0.15 -2.10 -0.03 0.00 0.77 0.00 0.00 66.41 65.20 1dmo h THR 110 Cb 0.62 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.11 1dmo h THR 110 CO -0.00 0.64 0.01 -1.13 0.37 0.00 0.00 175.52 175.40 1dmo h ASN 111 N 0.32 0.35 -0.05 4.18 -0.73 0.06 -3.21 115.58 116.50 1dmo h ASN 111 Ca -0.03 -0.30 -0.03 0.00 1.87 0.00 0.00 56.30 57.81 1dmo h ASN 111 Cb 1.31 -0.09 -0.00 0.00 0.27 0.00 0.00 38.32 39.80 1dmo h ASN 111 CO 0.13 0.56 -0.09 -0.07 -0.37 0.00 0.00 177.43 177.60 1dmo h LEU 112 N 0.13 0.17 -2.90 0.34 3.38 -1.34 -3.49 115.31 111.61 1dmo h LEU 112 Ca 0.06 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 1dmo h LEU 112 Cb 0.38 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1dmo h LEU 112 CO 0.01 0.68 -1.00 0.61 0.09 0.00 0.00 178.44 178.83 1dmo n GLY 113 N 0.37 -1.61 0.00 0.83 0.00 0.25 -5.01 105.19 100.02 1dmo n GLY 113 Ca -0.08 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 0.95 0.00 -1.21 1.61 4.71 -1.26 -4.98 120.64 120.46 1dmo n GLU 114 Ca -0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.16 57.19 1dmo n GLU 114 Cb 0.33 0.00 0.04 0.00 -1.01 0.00 0.00 31.44 30.79 1dmo n GLU 114 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1dmo n LYS 115 N 0.00 0.17 -3.62 3.49 5.02 -1.26 -4.99 118.16 116.97 1dmo n LYS 115 Ca 0.00 -1.94 -0.39 0.00 -2.02 0.00 0.00 58.31 53.96 1dmo n LYS 115 Cb 0.00 -0.27 -0.07 0.00 -0.02 0.00 0.00 35.03 34.67 1dmo n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dmo s LEU 116 N -0.35 5.60 0.68 -0.35 1.43 -1.26 -5.07 118.68 119.36 1dmo s LEU 116 Ca 0.28 -3.03 -0.17 0.00 -1.03 0.00 0.00 54.13 50.18 1dmo s LEU 116 Cb 0.31 -1.94 -0.10 0.00 0.03 0.00 0.00 46.19 44.49 1dmo s LEU 116 CO -0.13 -0.36 0.07 0.41 0.23 0.00 0.00 176.35 176.57 1dmo n THR 117 N 3.30 0.87 -0.02 5.49 -1.04 -1.26 -4.30 114.28 117.32 1dmo n THR 117 Ca 0.12 -0.46 0.24 0.00 -2.04 0.00 0.00 64.05 61.91 1dmo n THR 117 Cb 0.39 -0.34 0.72 0.00 -1.82 0.00 0.00 70.33 69.28 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 -0.29 0.00 0.55 8.00 5.19 -1.99 0.35 116.42 128.23 1dmo h ASP 118 Ca -0.44 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 55.74 1dmo h ASP 118 Cb 1.38 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.89 1dmo h ASP 118 CO 0.39 0.00 -1.04 -0.33 -3.12 0.00 0.00 179.24 175.15 1dmo h GLU 119 N 0.00 0.28 -0.01 3.56 5.08 -2.00 -2.57 114.58 118.91 1dmo h GLU 119 Ca 0.29 -0.37 -0.19 0.00 -1.00 0.00 0.00 59.36 58.10 1dmo h GLU 119 Cb 1.40 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 1dmo h GLU 119 CO -0.00 1.10 -0.83 1.49 -1.00 0.00 0.00 179.01 179.77 1dmo h GLU 120 N 0.13 0.24 -0.36 2.33 4.57 -0.68 -2.41 114.58 118.40 1dmo h GLU 120 Ca -0.09 -0.24 -0.15 0.00 -1.18 0.00 0.00 59.36 57.70 1dmo h GLU 120 Cb 1.71 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 30.36 1dmo h GLU 120 CO 0.17 0.94 -0.37 0.28 -1.18 0.00 0.00 179.01 178.85 1dmo h VAL 121 N 0.14 1.28 -0.18 0.32 2.07 -1.07 -2.04 116.25 116.77 1dmo h VAL 121 Ca -0.04 -1.54 -0.12 0.00 0.82 0.00 0.00 66.70 65.82 1dmo h VAL 121 Cb 1.44 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 1dmo h VAL 121 CO 0.13 0.51 -0.39 -0.78 0.02 0.00 0.00 177.57 177.06 1dmo h ASP 122 N 0.69 0.41 -0.46 0.57 1.82 -1.47 -0.79 116.42 117.19 1dmo h ASP 122 Ca 0.06 -0.17 -0.13 0.00 -0.39 0.00 0.00 57.03 56.40 1dmo h ASP 122 Cb 0.96 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.84 1dmo h ASP 122 CO 0.09 0.77 -0.20 -0.08 -1.61 0.00 0.00 179.24 178.21 1dmo h GLU 123 N 0.33 0.97 -0.11 0.28 4.57 -1.30 -1.86 114.58 117.46 1dmo h GLU 123 Ca 0.03 -0.40 -0.11 0.00 -1.18 0.00 0.00 59.36 57.70 1dmo h GLU 123 Cb 0.84 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1dmo h GLU 123 CO 0.07 1.07 -0.37 1.98 -1.18 0.00 0.00 179.01 180.58 1dmo h MET 124 N 0.84 0.45 -0.79 1.92 4.05 -1.20 -3.20 114.93 116.99 1dmo h MET 124 Ca 0.11 -0.33 0.05 0.00 -0.28 0.00 0.00 59.70 59.25 1dmo h MET 124 Cb 0.76 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.57 1dmo h MET 124 CO 0.06 0.96 0.49 0.82 0.23 0.00 0.00 176.91 179.47 1dmo h ILE 125 N 0.03 1.05 0.00 1.77 2.04 -1.12 0.35 117.51 121.63 1dmo h ILE 125 Ca -0.01 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1dmo h ILE 125 Cb 1.00 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1dmo h ILE 125 CO 0.08 0.17 0.00 -1.14 0.00 0.00 0.00 178.15 177.26 1dmo n ARG 126 N -4.65 0.00 -1.62 2.37 0.63 -0.70 -1.54 116.66 111.15 1dmo n ARG 126 Ca 0.10 0.44 -0.01 0.00 -0.92 0.00 0.00 57.85 57.47 1dmo n ARG 126 Cb 0.15 -1.50 0.08 0.00 0.45 0.00 0.00 32.46 31.63 1dmo n ARG 126 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1dmo n GLU 127 N -1.50 1.36 -0.82 -0.14 2.13 0.11 -4.90 120.64 116.89 1dmo n GLU 127 Ca 0.01 -3.01 -0.09 0.00 0.66 0.00 0.00 57.16 54.73 1dmo n GLU 127 Cb 0.04 -1.13 -0.12 0.00 0.27 0.00 0.00 31.44 30.49 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 -0.36 5.47 -4.26 4.31 0.00 -0.53 -4.69 120.51 120.44 1dmo n ALA 128 Ca 0.16 -1.32 -0.31 0.00 0.00 0.00 0.00 53.44 51.96 1dmo n ALA 128 Cb 0.92 -2.05 -0.09 0.00 0.00 0.00 0.00 19.45 18.23 1dmo n ALA 128 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1dmo n ASN 129 N 2.33 0.48 0.00 0.00 6.94 -1.26 -4.78 115.26 118.97 1dmo n ASN 129 Ca 0.31 -1.22 0.00 0.00 -0.02 0.00 0.00 54.58 53.65 1dmo n ASN 129 Cb 0.76 -1.52 0.00 0.00 -2.36 0.00 0.00 39.78 36.66 1dmo n ASN 129 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1dmo n ILE 130 N -4.34 0.00 -0.94 1.53 5.41 -1.26 -4.74 119.36 115.02 1dmo n ILE 130 Ca -0.24 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.51 1dmo n ILE 130 Cb 0.63 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.56 1dmo n ILE 130 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1dmo n ASP 131 N 0.00 -1.05 -0.03 4.38 -0.08 -1.26 -4.89 116.55 113.62 1dmo n ASP 131 Ca 0.00 0.00 -0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1dmo n ASP 131 Cb 0.00 -0.59 -0.00 0.00 2.34 0.00 0.00 41.12 42.87 1dmo n ASP 131 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1dmo h GLY 132 N 0.00 -0.02 0.00 0.27 0.00 -1.87 -3.45 103.07 98.01 1dmo h GLY 132 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1dmo h GLY 132 CO 0.00 -0.01 0.00 2.09 0.00 0.00 0.00 176.54 178.62 1dmo n ASP 133 N -3.87 0.00 0.00 0.19 5.68 -1.26 -5.00 116.55 112.29 1dmo n ASP 133 Ca -0.00 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.29 1dmo n ASP 133 Cb 0.01 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 1dmo n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dmo n GLY 134 N 0.00 2.47 3.89 6.12 0.00 -1.26 -5.06 105.19 111.35 1dmo n GLY 134 Ca 0.00 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 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 1.30 -0.15 1.61 -0.21 -1.26 -4.55 119.66 116.40 1dmo s GLN 135 Ca 0.00 -0.05 0.02 0.00 0.02 0.00 0.00 55.36 55.35 1dmo s GLN 135 Cb 0.00 -1.89 0.01 0.00 1.00 0.00 0.00 33.01 32.14 1dmo s GLN 135 CO 0.00 -2.02 -0.20 0.08 -2.12 0.00 0.00 175.29 171.02 1dmo s VAL 136 N -3.63 1.98 -1.08 1.09 1.01 0.89 -4.77 120.40 115.88 1dmo s VAL 136 Ca 0.67 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 61.49 1dmo s VAL 136 Cb -0.09 -1.77 -0.07 0.00 0.00 0.00 0.00 36.38 34.44 1dmo s VAL 136 CO 0.51 0.53 1.94 0.54 0.00 0.00 0.00 175.10 178.63 1dmo s ASN 137 N 1.01 5.05 0.64 3.32 2.20 -1.26 -1.38 114.94 124.51 1dmo s ASN 137 Ca -0.03 -1.30 0.13 0.00 -0.94 0.00 0.00 52.86 50.73 1dmo s ASN 137 Cb -0.15 -2.58 0.49 0.00 -2.00 0.00 0.00 41.25 37.01 1dmo s ASN 137 CO -0.06 -2.99 1.18 0.10 -2.94 0.00 0.00 177.10 172.40 1dmo h TYR 138 N 10.32 0.00 0.21 1.54 -0.00 -1.88 0.48 116.97 127.64 1dmo h TYR 138 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.89 1dmo h TYR 138 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.69 1dmo h TYR 138 CO 1.21 0.00 -0.10 0.93 -0.00 0.00 0.00 178.16 180.20 1dmo h GLU 139 N 0.00 -0.27 -1.17 0.10 5.08 -1.84 0.72 114.58 117.20 1dmo h GLU 139 Ca 0.22 0.02 0.33 0.00 -1.00 0.00 0.00 59.36 58.93 1dmo h GLU 139 Cb 2.35 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 31.59 1dmo h GLU 139 CO -0.00 -0.18 0.80 0.93 -1.00 0.00 0.00 179.01 179.56 1dmo h GLU 140 N -0.43 0.14 -0.33 2.33 5.08 -1.31 1.04 114.58 121.11 1dmo h GLU 140 Ca -0.03 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1dmo h GLU 140 Cb 0.22 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1dmo h GLU 140 CO 0.05 0.09 0.08 0.35 -1.00 0.00 0.00 179.01 178.58 1dmo h PHE 141 N 0.14 0.54 0.00 4.33 3.57 -1.22 -1.77 116.94 122.54 1dmo h PHE 141 Ca 0.60 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 62.04 1dmo h PHE 141 Cb 2.07 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.65 1dmo h PHE 141 CO -0.00 0.56 0.01 0.28 -2.23 0.00 0.00 178.31 176.92 1dmo h VAL 142 N 0.37 0.00 0.10 1.41 2.07 0.36 0.47 116.25 121.03 1dmo h VAL 142 Ca 0.10 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.29 1dmo h VAL 142 Cb 0.29 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1dmo h VAL 142 CO 0.00 0.00 -1.83 0.00 0.02 0.00 0.00 177.57 175.76 1dmo n GLN 143 N -2.69 0.72 0.00 1.57 1.13 -0.73 -3.80 117.38 113.59 1dmo n GLN 143 Ca -0.02 0.33 0.12 0.00 -1.94 0.00 0.00 57.00 55.50 1dmo n GLN 143 Cb 0.06 -1.72 0.34 0.00 0.11 0.00 0.00 30.24 29.02 1dmo n GLN 143 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 1dmo n MET 144 N -3.70 0.05 0.03 -1.09 1.56 -0.81 -3.59 117.12 109.56 1dmo n MET 144 Ca -0.32 -0.02 0.12 0.00 -0.27 0.00 0.00 57.70 57.21 1dmo n MET 144 Cb 0.97 -1.50 0.17 0.00 2.15 0.00 0.00 33.22 35.00 1dmo n MET 144 CO 0.00 0.00 0.00 -0.12 -0.73 0.00 0.00 175.97 175.12 1dmo n MET 145 N -1.46 0.17 0.00 2.12 0.00 0.16 -4.47 117.12 113.65 1dmo n MET 145 Ca 0.06 0.03 0.00 0.00 -0.00 0.00 0.00 57.70 57.79 1dmo n MET 145 Cb 0.34 -1.59 0.00 0.00 0.00 0.00 0.00 33.22 31.97 1dmo n MET 145 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1dmo n THR 146 N -1.83 0.00 -1.45 1.12 -1.04 -1.24 -4.87 114.28 104.98 1dmo n THR 146 Ca 0.04 0.35 -0.44 0.00 -2.04 0.00 0.00 64.05 61.96 1dmo n THR 146 Cb 0.40 -1.05 -0.01 0.00 -1.82 0.00 0.00 70.33 67.85 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 -1.54 -1.76 1.39 2.41 0.00 -1.26 -5.15 120.51 114.61 1dmo n ALA 147 Ca 0.00 0.29 0.14 0.00 0.00 0.00 0.00 53.44 53.86 1dmo n ALA 147 Cb 0.00 -1.75 0.43 0.00 0.00 0.00 0.00 19.45 18.13 1dmo n ALA 147 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67