#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1krw s GLN 2 N 0.00 1.67 0.00 2.12 -0.21 -1.26 -5.01 119.66 116.97 1krw s GLN 2 Ca 0.00 -1.79 0.14 0.00 0.02 0.00 0.00 55.36 53.73 1krw s GLN 2 Cb 0.00 -1.66 0.73 0.00 1.00 0.00 0.00 33.01 33.08 1krw s GLN 2 CO 0.00 0.26 1.36 2.89 -2.12 0.00 0.00 175.29 177.68 1krw n ARG 3 N -0.63 0.23 -0.73 2.91 1.85 -1.26 -4.87 116.66 114.16 1krw n ARG 3 Ca -0.05 0.13 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 1krw n ARG 3 Cb 0.61 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.52 1krw n ARG 3 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1krw n GLY 4 N -0.10 -0.21 3.42 2.89 0.00 -1.26 -4.68 105.19 105.25 1krw n GLY 4 Ca 0.07 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 1krw n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1krw s ILE 5 N -0.41 4.76 -0.19 -0.61 1.09 -1.26 -0.91 121.20 123.66 1krw s ILE 5 Ca 0.00 -0.63 -0.06 0.00 -1.10 0.00 0.00 60.65 58.86 1krw s ILE 5 Cb 0.00 -3.56 -0.03 0.00 -1.06 0.00 0.00 42.46 37.81 1krw s ILE 5 CO 0.00 -0.13 0.02 0.54 -0.10 0.00 0.00 174.94 175.27 1krw s VAL 6 N 1.61 4.23 -0.08 2.92 0.11 0.21 0.10 120.40 129.50 1krw s VAL 6 Ca 0.04 -0.22 0.01 0.00 -2.93 0.00 0.00 61.98 58.88 1krw s VAL 6 Cb -0.18 -2.91 -0.02 0.00 -1.53 0.00 0.00 36.38 31.74 1krw s VAL 6 CO 0.07 0.44 -0.11 0.26 -3.33 0.00 0.00 175.10 172.43 1krw s TRP 7 N 0.77 2.81 -0.02 1.54 0.52 -1.01 -2.32 118.94 121.23 1krw s TRP 7 Ca 0.01 -0.26 0.05 0.00 0.02 0.00 0.00 56.10 55.93 1krw s TRP 7 Cb -0.14 -1.73 -0.01 0.00 -1.15 0.00 0.00 33.47 30.44 1krw s TRP 7 CO 0.02 0.10 -0.18 0.08 0.02 0.00 0.00 176.95 176.99 1krw s VAL 8 N -0.37 1.44 -0.33 4.03 1.01 0.96 -1.40 120.40 125.74 1krw s VAL 8 Ca 0.04 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1krw s VAL 8 Cb -0.12 -1.21 0.08 0.00 0.00 0.00 0.00 36.38 35.13 1krw s VAL 8 CO 0.02 0.41 0.05 -0.69 0.00 0.00 0.00 175.10 174.90 1krw s VAL 9 N -0.31 2.88 -0.30 2.92 1.01 0.03 -1.43 120.40 125.21 1krw s VAL 9 Ca 0.04 -1.75 -0.15 0.00 0.00 0.00 0.00 61.98 60.12 1krw s VAL 9 Cb -0.08 -2.82 0.18 0.00 0.00 0.00 0.00 36.38 33.65 1krw s VAL 9 CO 0.00 -0.34 1.08 -0.62 0.00 0.00 0.00 175.10 175.22 1krw s ASP 10 N 1.35 -0.42 0.00 3.32 -1.08 -1.02 -2.07 116.67 116.74 1krw s ASP 10 Ca 0.01 0.48 0.00 0.00 -0.52 0.00 0.00 52.55 52.51 1krw s ASP 10 Cb -0.21 1.44 0.00 0.00 -1.46 0.00 0.00 42.92 42.69 1krw s ASP 10 CO -0.03 -0.08 0.00 -0.67 0.52 0.00 0.00 175.17 174.91 1krw n ASP 11 N 5.01 0.00 0.00 -0.34 2.03 -1.18 -4.22 116.55 117.85 1krw n ASP 11 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1krw n ASP 11 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 1krw n ASP 11 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1krw n ASP 12 N 1.27 0.00 -0.33 1.67 -0.08 -1.26 -4.13 116.55 113.70 1krw n ASP 12 Ca 0.00 0.00 0.25 0.00 -1.51 0.00 0.00 54.79 53.53 1krw n ASP 12 Cb 0.00 0.00 0.48 0.00 2.34 0.00 0.00 41.12 43.94 1krw n ASP 12 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1krw h SER 13 N 0.00 0.10 0.22 1.67 0.02 -1.94 0.57 113.55 114.19 1krw h SER 13 Ca 0.00 0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1krw h SER 13 Cb 0.00 0.32 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1krw h SER 13 CO 0.00 -0.37 -0.34 0.28 -1.14 0.00 0.00 176.83 175.26 1krw h SER 14 N 0.05 -0.98 1.01 3.07 0.02 -1.93 0.68 113.55 115.47 1krw h SER 14 Ca 0.75 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.79 1krw h SER 14 Cb 1.85 0.34 -0.00 0.00 0.14 0.00 0.00 62.40 64.73 1krw h SER 14 CO -0.79 -0.41 -0.03 0.40 -1.14 0.00 0.00 176.83 174.86 1krw h ILE 15 N -0.59 0.08 0.29 3.27 1.08 -1.29 -3.09 117.51 117.27 1krw h ILE 15 Ca -0.02 -0.60 -0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1krw h ILE 15 Cb 0.54 1.55 0.00 0.00 -3.07 0.00 0.00 36.82 35.84 1krw h ILE 15 CO -0.11 0.03 -0.14 -0.09 -0.69 0.00 0.00 178.15 177.15 1krw h ARG 16 N 0.00 -0.38 -0.66 2.37 2.43 0.92 -2.34 114.38 116.72 1krw h ARG 16 Ca -0.00 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.30 1krw h ARG 16 Cb 0.55 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.11 1krw h ARG 16 CO 0.00 -0.03 0.27 2.35 -1.51 0.00 0.00 179.97 181.05 1krw h TRP 17 N -0.88 0.47 -0.32 2.20 7.01 0.36 1.06 115.95 125.85 1krw h TRP 17 Ca -0.04 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.95 1krw h TRP 17 Cb 0.52 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.45 1krw h TRP 17 CO 0.04 0.12 0.03 0.28 -2.79 0.00 0.00 178.44 176.13 1krw h VAL 18 N 0.46 1.24 0.00 2.65 2.07 -1.60 -3.08 116.25 117.99 1krw h VAL 18 Ca 0.34 -0.87 -0.17 0.00 0.82 0.00 0.00 66.70 66.82 1krw h VAL 18 Cb 0.42 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1krw h VAL 18 CO -0.32 0.29 -0.98 0.25 0.02 0.00 0.00 177.57 176.83 1krw h LEU 19 N 0.36 0.00 0.62 2.57 7.12 -1.02 -3.31 115.31 121.64 1krw h LEU 19 Ca 0.09 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 58.07 1krw h LEU 19 Cb 0.38 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.52 1krw h LEU 19 CO 0.01 0.69 -0.30 1.05 -0.13 0.00 0.00 178.44 179.77 1krw h GLU 20 N 0.00 -0.80 0.20 1.25 -0.00 0.11 -1.80 114.58 113.54 1krw h GLU 20 Ca -0.08 0.05 0.00 0.00 -0.00 0.00 0.00 59.36 59.34 1krw h GLU 20 Cb 1.59 0.18 -0.03 0.00 -0.00 0.00 0.00 28.75 30.50 1krw h GLU 20 CO 0.08 -0.53 -0.36 0.00 -0.00 0.00 0.00 179.01 178.20 1krw h ARG 21 N -1.13 -0.57 -0.28 1.06 2.47 -1.72 1.21 114.38 115.41 1krw h ARG 21 Ca -0.09 0.04 0.06 0.00 -1.26 0.00 0.00 59.98 58.74 1krw h ARG 21 Cb 0.64 0.13 -0.08 0.00 -1.65 0.00 0.00 29.97 29.01 1krw h ARG 21 CO 0.14 -0.38 -0.32 0.00 0.56 0.00 0.00 179.97 179.97 1krw h ALA 22 N -1.00 -0.27 0.00 0.04 0.00 -1.70 0.49 119.26 116.82 1krw h ALA 22 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1krw h ALA 22 Cb 0.56 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1krw h ALA 22 CO -0.13 -0.76 0.00 1.25 0.00 0.00 0.00 179.25 179.61 1krw h LEU 23 N -0.31 0.00 -0.61 0.00 5.85 -1.18 -1.24 115.31 117.81 1krw h LEU 23 Ca 0.14 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.71 1krw h LEU 23 Cb 0.54 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1krw h LEU 23 CO -0.45 0.00 -0.47 0.00 -0.34 0.00 0.00 178.44 177.17 1krw h ALA 24 N 2.02 0.79 -0.19 1.25 0.00 0.63 -2.45 119.26 121.31 1krw h ALA 24 Ca 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.49 1krw h ALA 24 Cb 0.31 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1krw h ALA 24 CO 0.00 0.67 0.16 0.78 0.00 0.00 0.00 179.25 180.86 1krw h GLY 25 N 1.08 0.00 2.00 0.00 0.00 0.16 0.58 103.07 106.89 1krw h GLY 25 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1krw h GLY 25 CO 0.09 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.63 1krw h ALA 26 N 1.85 1.00 0.00 3.60 0.00 -1.49 -3.47 119.26 120.75 1krw h ALA 26 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1krw h ALA 26 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1krw h ALA 26 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1krw n GLY 27 N 1.01 1.27 3.63 0.00 0.00 0.20 -5.10 105.19 106.21 1krw n GLY 27 Ca 0.05 -0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 1krw n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1krw s LEU 28 N 0.00 2.98 -0.29 0.99 1.02 -1.19 -4.77 118.68 117.42 1krw s LEU 28 Ca 0.00 -1.00 -0.16 0.00 0.02 0.00 0.00 54.13 52.99 1krw s LEU 28 Cb 0.00 -1.35 -0.03 0.00 0.02 0.00 0.00 46.19 44.84 1krw s LEU 28 CO 0.00 -0.24 0.44 -0.89 0.02 0.00 0.00 176.35 175.68 1krw s THR 29 N -2.52 5.11 -0.25 5.49 2.01 -0.09 -4.43 115.64 120.96 1krw s THR 29 Ca 0.35 0.57 -0.06 0.00 0.31 0.00 0.00 61.69 62.86 1krw s THR 29 Cb 0.00 -3.80 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1krw s THR 29 CO 0.19 0.04 0.04 0.00 -0.69 0.00 0.00 174.62 174.20 1krw s THR 31 N 1.54 1.76 0.29 0.00 -1.32 -0.98 -4.87 115.64 112.06 1krw s THR 31 Ca 0.05 -0.95 0.10 0.00 -1.21 0.00 0.00 61.69 59.68 1krw s THR 31 Cb -0.15 -1.47 -0.05 0.00 -1.51 0.00 0.00 72.50 69.32 1krw s THR 31 CO 0.01 0.50 -0.03 0.42 -2.21 0.00 0.00 174.62 173.32 1krw s THR 32 N -0.50 3.02 0.31 5.08 -4.23 -1.25 -0.03 115.64 118.04 1krw s THR 32 Ca 0.08 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.62 1krw s THR 32 Cb -0.09 -2.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 1krw s THR 32 CO -0.01 -0.32 0.17 -0.36 -0.54 0.00 0.00 174.62 173.56 1krw s PHE 33 N -2.42 1.60 0.12 3.99 0.40 -0.51 -4.95 117.98 116.21 1krw s PHE 33 Ca 0.32 -1.40 -0.19 0.00 -0.60 0.00 0.00 56.93 55.07 1krw s PHE 33 Cb -0.04 -0.84 -0.05 0.00 0.51 0.00 0.00 43.02 42.60 1krw s PHE 33 CO 0.19 -0.56 1.70 1.05 0.70 0.00 0.00 175.22 178.30 1krw h GLU 34 N 2.21 0.38 0.00 0.44 4.11 -1.90 -2.72 114.58 117.11 1krw h GLU 34 Ca -0.33 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.05 1krw h GLU 34 Cb 1.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1krw h GLU 34 CO 0.50 0.36 0.00 0.27 0.07 0.00 0.00 179.01 180.21 1krw n ASN 35 N -4.82 0.00 0.00 3.06 6.94 -1.26 -3.13 115.26 116.05 1krw n ASN 35 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.54 1krw n ASN 35 Cb 0.09 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.51 1krw n ASN 35 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1krw n GLY 36 N -0.23 -1.01 0.45 4.83 0.00 -1.26 -4.66 105.19 103.31 1krw n GLY 36 Ca 0.00 0.44 0.28 0.00 0.00 0.00 0.00 46.02 46.73 1krw n GLY 36 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1krw h ASN 37 N 0.00 0.30 0.57 1.61 -0.26 -1.98 0.37 115.58 116.19 1krw h ASN 37 Ca 0.00 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.78 1krw h ASN 37 Cb 0.00 0.02 0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1krw h ASN 37 CO 0.00 0.04 -0.27 -0.08 -1.06 0.00 0.00 177.43 176.05 1krw h GLU 38 N 0.25 -0.74 -0.71 0.81 4.81 -1.97 0.10 114.58 117.13 1krw h GLU 38 Ca 0.61 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.99 1krw h GLU 38 Cb 1.82 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 31.29 1krw h GLU 38 CO -0.23 -0.49 0.33 0.28 -0.73 0.00 0.00 179.01 178.18 1krw h VAL 39 N -0.78 0.80 -0.77 0.32 2.07 -1.35 0.39 116.25 116.93 1krw h VAL 39 Ca -0.08 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.30 1krw h VAL 39 Cb 0.59 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1krw h VAL 39 CO 0.13 0.10 0.47 -0.07 0.02 0.00 0.00 177.57 178.22 1krw h LEU 40 N 0.55 0.74 0.01 2.57 3.38 -1.06 0.86 115.31 122.36 1krw h LEU 40 Ca 0.36 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.34 1krw h LEU 40 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1krw h LEU 40 CO -0.30 0.49 -0.00 0.00 0.09 0.00 0.00 178.44 178.71 1krw h ALA 41 N 1.36 -0.01 0.00 1.53 0.00 0.73 -3.08 119.26 119.79 1krw h ALA 41 Ca 0.33 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1krw h ALA 41 Cb 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1krw h ALA 41 CO -0.16 -0.24 -0.13 0.00 0.00 0.00 0.00 179.25 178.72 1krw h ALA 42 N 0.45 1.54 0.00 0.00 0.00 -0.06 -1.71 119.26 119.47 1krw h ALA 42 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1krw h ALA 42 Cb 0.53 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1krw h ALA 42 CO 0.00 0.17 -0.14 -0.07 0.00 0.00 0.00 179.25 179.21 1krw h LEU 43 N 0.00 0.00 -1.85 0.00 3.38 0.83 -2.63 115.31 115.04 1krw h LEU 43 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1krw h LEU 43 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1krw h LEU 43 CO 0.02 0.14 0.07 0.00 0.09 0.00 0.00 178.44 178.75 1krw h ALA 44 N 1.86 1.05 -0.00 1.53 0.00 -1.24 -0.54 119.26 121.92 1krw h ALA 44 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1krw h ALA 44 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1krw h ALA 44 CO 0.02 -0.05 -0.04 0.43 0.00 0.00 0.00 179.25 179.60 1krw n SER 45 N -2.52 0.87 -3.58 0.00 7.64 -1.00 -5.07 113.62 109.97 1krw n SER 45 Ca -0.02 -0.94 -0.07 0.00 1.01 0.00 0.00 58.87 58.86 1krw n SER 45 Cb 0.11 0.34 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 1krw n SER 45 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1krw s LYS 46 N -0.60 0.91 -0.14 1.43 2.36 -0.21 -5.15 119.74 118.34 1krw s LYS 46 Ca 0.03 -0.40 -0.04 0.00 -2.55 0.00 0.00 55.97 53.01 1krw s LYS 46 Cb 0.02 0.38 0.05 0.00 -1.05 0.00 0.00 37.83 37.23 1krw s LYS 46 CO 0.06 -0.41 0.07 0.99 1.55 0.00 0.00 175.35 177.62 1krw s THR 47 N -3.14 0.01 0.86 3.43 2.01 -1.26 -4.12 115.64 113.42 1krw s THR 47 Ca 0.07 -0.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 1krw s THR 47 Cb -0.01 -0.54 0.11 0.00 0.01 0.00 0.00 72.50 72.06 1krw s THR 47 CO -0.06 -0.15 1.10 -2.16 -0.69 0.00 0.00 174.62 172.66 1krw s PRO 48 N 2.10 1.59 0.39 4.92 0.04 -1.26 -4.96 135.00 137.82 1krw s PRO 48 Ca 0.02 0.68 0.21 0.00 0.04 0.00 0.00 61.00 61.96 1krw s PRO 48 Cb -0.15 -1.86 0.64 0.00 0.04 0.00 0.00 34.50 33.17 1krw s PRO 48 CO -0.07 -1.98 1.71 -0.44 0.04 0.00 0.00 177.00 176.25 1krw h ASP 49 N -1.35 0.00 -5.35 6.66 5.19 0.30 -3.46 116.42 118.40 1krw h ASP 49 Ca -0.49 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 55.79 1krw h ASP 49 Cb 1.28 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.66 1krw h ASP 49 CO 0.57 0.31 -0.42 0.54 -3.12 0.00 0.00 179.24 177.12 1krw s VAL 50 N -3.45 0.06 -0.18 -1.35 0.11 -1.15 -4.36 120.40 110.07 1krw s VAL 50 Ca 0.02 -1.60 -0.12 0.00 -2.93 0.00 0.00 61.98 57.35 1krw s VAL 50 Cb 0.09 -2.02 0.06 0.00 -1.53 0.00 0.00 36.38 32.98 1krw s VAL 50 CO 0.67 -0.26 0.46 -0.22 -3.33 0.00 0.00 175.10 172.42 1krw s LEU 51 N -3.02 -0.12 -0.04 2.54 2.96 -0.37 -2.40 118.68 118.23 1krw s LEU 51 Ca 0.22 0.98 0.05 0.00 -0.22 0.00 0.00 54.13 55.17 1krw s LEU 51 Cb 0.04 1.54 -0.02 0.00 0.50 0.00 0.00 46.19 48.25 1krw s LEU 51 CO 0.03 -0.19 -0.19 -0.22 -1.32 0.00 0.00 176.35 174.46 1krw s LEU 52 N 1.14 2.46 -0.08 -0.68 0.20 -0.49 -0.02 118.68 121.20 1krw s LEU 52 Ca -0.07 -0.31 0.02 0.00 0.69 0.00 0.00 54.13 54.46 1krw s LEU 52 Cb -0.07 -1.47 0.01 0.00 -0.43 0.00 0.00 46.19 44.23 1krw s LEU 52 CO -0.10 0.32 -0.14 -0.44 -0.29 0.00 0.00 176.35 175.70 1krw s SER 53 N -0.61 2.08 0.37 3.68 0.01 0.42 -0.79 113.70 118.86 1krw s SER 53 Ca 0.09 -0.35 0.28 0.00 1.31 0.00 0.00 55.95 57.27 1krw s SER 53 Cb -0.11 -0.95 1.16 0.00 0.21 0.00 0.00 66.02 66.34 1krw s SER 53 CO 0.00 0.03 1.82 -0.78 0.41 0.00 0.00 173.24 174.73 1krw h ASP 54 N 7.11 0.00 -6.47 2.44 3.58 -1.68 -2.97 116.42 118.42 1krw h ASP 54 Ca -0.29 0.00 -0.38 0.00 0.42 0.00 0.00 57.03 56.77 1krw h ASP 54 Cb 1.19 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.24 1krw h ASP 54 CO 0.47 0.00 -0.96 0.00 -2.88 0.00 0.00 179.24 175.88 1krw n ILE 55 N -2.56 -4.71 0.00 2.25 3.06 -1.26 -4.63 119.36 111.52 1krw n ILE 55 Ca 0.01 0.02 0.00 0.00 -2.50 0.00 0.00 62.75 60.28 1krw n ILE 55 Cb 0.25 -3.79 0.00 0.00 0.54 0.00 0.00 39.64 36.64 1krw n ILE 55 CO 0.00 0.00 0.00 -2.11 -2.50 0.00 0.00 176.55 171.94 1krw n ARG 56 N -1.89 0.00 0.13 9.51 1.85 -0.49 -4.37 116.66 121.39 1krw n ARG 56 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.64 1krw n ARG 56 Cb 0.66 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.07 1krw n ARG 56 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1krw n MET 57 N 0.00 0.00 0.00 2.89 1.56 -0.79 -5.04 117.12 115.75 1krw n MET 57 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1krw n MET 57 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1krw n MET 57 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1krw n PRO 58 N -3.00 -0.51 0.12 2.12 -0.04 -1.19 -4.87 135.00 127.63 1krw n PRO 58 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 1krw n PRO 58 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 1krw n PRO 58 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1krw h GLY 59 N -0.48 -0.33 -4.13 0.55 0.00 -1.99 -3.19 103.07 93.51 1krw h GLY 59 Ca 0.00 0.12 -0.25 0.00 0.00 0.00 0.00 47.33 47.20 1krw h GLY 59 CO 0.00 -0.12 0.13 1.03 0.00 0.00 0.00 176.54 177.58 1krw n MET 60 N -2.95 2.20 0.00 4.80 2.81 -1.26 -4.85 117.12 117.87 1krw n MET 60 Ca -0.04 -1.14 0.00 0.00 -1.81 0.00 0.00 57.70 54.71 1krw n MET 60 Cb 0.12 -2.10 0.00 0.00 -0.71 0.00 0.00 33.22 30.54 1krw n MET 60 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1krw n ASP 61 N 2.63 0.00 0.00 7.83 9.92 -1.21 -1.54 116.55 134.19 1krw n ASP 61 Ca 0.47 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.73 1krw n ASP 61 Cb 0.83 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.31 1krw n ASP 61 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1krw n GLY 62 N 0.00 0.03 0.36 0.44 0.00 -1.26 -1.39 105.19 103.37 1krw n GLY 62 Ca 0.00 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.18 1krw n GLY 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1krw h LEU 63 N 0.00 0.00 -1.36 0.99 4.07 -1.64 0.32 115.31 117.70 1krw h LEU 63 Ca 0.00 0.00 0.14 0.00 0.08 0.00 0.00 57.88 58.10 1krw h LEU 63 Cb 0.00 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.68 1krw h LEU 63 CO 0.00 0.00 0.56 0.00 -1.08 0.00 0.00 178.44 177.92 1krw h ALA 64 N 1.51 1.89 0.52 1.53 0.00 -1.85 -1.69 119.26 121.17 1krw h ALA 64 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1krw h ALA 64 Cb 0.79 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1krw h ALA 64 CO -0.00 -0.12 -0.28 -0.07 0.00 0.00 0.00 179.25 178.78 1krw h LEU 65 N 0.63 -0.67 -0.95 0.00 4.07 -0.68 -2.60 115.31 115.11 1krw h LEU 65 Ca 0.43 0.03 0.29 0.00 0.08 0.00 0.00 57.88 58.71 1krw h LEU 65 Cb 0.74 0.18 -0.15 0.00 1.08 0.00 0.00 40.66 42.51 1krw h LEU 65 CO -0.18 -0.45 0.37 -0.07 -1.08 0.00 0.00 178.44 177.03 1krw h LEU 66 N -0.74 0.19 -0.36 1.67 3.38 -1.42 0.67 115.31 118.70 1krw h LEU 66 Ca -0.07 0.21 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1krw h LEU 66 Cb 0.58 0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1krw h LEU 66 CO 0.10 -0.19 0.17 0.11 0.09 0.00 0.00 178.44 178.71 1krw h LYS 67 N 0.22 0.34 -0.02 1.13 1.57 -1.25 -0.46 116.57 118.10 1krw h LYS 67 Ca 0.65 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 59.33 1krw h LYS 67 Cb 1.45 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.67 1krw h LYS 67 CO -0.67 0.22 -0.39 1.96 -0.57 0.00 0.00 179.45 180.00 1krw h GLN 68 N 0.35 0.03 -0.33 3.15 1.08 0.37 -2.90 115.11 116.85 1krw h GLN 68 Ca 0.15 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.30 1krw h GLN 68 Cb 0.08 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 1krw h GLN 68 CO -0.12 0.42 0.05 0.82 -0.95 0.00 0.00 178.83 179.06 1krw h ILE 69 N 0.03 1.24 0.00 2.54 2.04 0.63 -2.11 117.51 121.88 1krw h ILE 69 Ca 0.00 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 64.99 1krw h ILE 69 Cb 0.71 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1krw h ILE 69 CO 0.05 0.27 -0.22 0.07 0.00 0.00 0.00 178.15 178.32 1krw h LYS 70 N 0.38 0.00 -0.13 2.37 2.10 -1.00 0.90 116.57 121.19 1krw h LYS 70 Ca 0.10 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.57 1krw h LYS 70 Cb 0.35 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.68 1krw h LYS 70 CO 0.01 0.22 -0.68 1.96 -2.00 0.00 0.00 179.45 178.96 1krw h GLN 71 N 0.00 0.54 0.00 0.07 4.20 -1.29 -3.30 115.11 115.33 1krw h GLN 71 Ca -0.00 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.30 1krw h GLN 71 Cb 0.41 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1krw h GLN 71 CO 0.03 1.03 0.00 0.54 -0.67 0.00 0.00 178.83 179.76 1krw n ARG 72 N -3.90 0.00 -3.75 1.46 1.74 -0.82 -4.86 116.66 106.53 1krw n ARG 72 Ca -0.05 0.06 -0.30 0.00 -0.77 0.00 0.00 57.85 56.80 1krw n ARG 72 Cb 0.68 -0.52 -0.10 0.00 -1.02 0.00 0.00 32.46 31.51 1krw n ARG 72 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1krw n HIS 73 N -2.33 3.50 -0.98 -1.55 1.44 0.31 -4.98 115.22 110.62 1krw n HIS 73 Ca 0.00 -4.22 -0.24 0.00 -2.01 0.00 0.00 57.72 51.25 1krw n HIS 73 Cb 0.00 -0.72 -0.07 0.00 0.12 0.00 0.00 29.99 29.32 1krw n HIS 73 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1krw n PRO 74 N 1.79 2.53 0.00 -1.40 -0.04 -0.81 -3.39 135.00 133.68 1krw n PRO 74 Ca 0.22 -1.50 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 1krw n PRO 74 Cb 0.36 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1krw n PRO 74 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1krw n MET 75 N 3.37 0.00 -1.67 0.54 2.81 -0.97 -4.57 117.12 116.64 1krw n MET 75 Ca 0.54 0.00 -0.49 0.00 -1.81 0.00 0.00 57.70 55.94 1krw n MET 75 Cb 0.40 -0.09 -0.05 0.00 -0.71 0.00 0.00 33.22 32.77 1krw n MET 75 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1krw n LEU 76 N -1.80 2.89 -4.72 4.03 0.00 -1.22 -4.60 117.00 111.59 1krw n LEU 76 Ca 0.00 1.05 -0.42 0.00 0.00 0.00 0.00 56.01 56.64 1krw n LEU 76 Cb 0.00 -1.33 -0.03 0.00 0.00 0.00 0.00 43.42 42.06 1krw n LEU 76 CO 0.00 -0.35 1.32 -2.84 0.00 0.00 0.00 177.39 175.53 1krw s PRO 77 N 2.33 4.16 -0.08 1.96 0.02 -1.25 -4.64 135.00 137.51 1krw s PRO 77 Ca 0.87 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.41 1krw s PRO 77 Cb -0.78 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 30.57 1krw s PRO 77 CO 0.48 -0.70 -0.06 0.08 -0.33 0.00 0.00 177.00 176.46 1krw s VAL 78 N 1.28 3.74 -0.21 3.83 1.01 -1.26 -1.24 120.40 127.54 1krw s VAL 78 Ca 0.73 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.27 1krw s VAL 78 Cb -0.47 -2.54 0.05 0.00 0.00 0.00 0.00 36.38 33.42 1krw s VAL 78 CO 0.32 0.59 -0.10 -0.63 0.00 0.00 0.00 175.10 175.28 1krw s ILE 79 N -0.68 1.71 -0.01 2.22 1.01 0.98 -0.95 121.20 125.47 1krw s ILE 79 Ca 0.10 -1.14 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 1krw s ILE 79 Cb -0.11 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1krw s ILE 79 CO 0.02 0.10 0.16 -0.63 0.00 0.00 0.00 174.94 174.58 1krw s ILE 80 N 1.35 5.26 0.11 2.92 -1.09 -1.15 -0.44 121.20 128.17 1krw s ILE 80 Ca -0.03 -0.22 0.07 0.00 -2.23 0.00 0.00 60.65 58.24 1krw s ILE 80 Cb -0.17 -3.45 -0.21 0.00 -1.58 0.00 0.00 42.46 37.05 1krw s ILE 80 CO -0.07 0.34 1.25 0.00 -1.23 0.00 0.00 174.94 175.22 1krw h MET 81 N 3.90 0.01 -3.19 2.79 -0.00 -1.78 0.33 114.93 116.99 1krw h MET 81 Ca -0.49 -0.01 -0.14 0.00 -0.00 0.00 0.00 59.70 59.06 1krw h MET 81 Cb 1.19 0.00 -0.22 0.00 -0.00 0.00 0.00 31.60 32.57 1krw h MET 81 CO 0.67 0.98 -0.38 0.99 -0.00 0.00 0.00 176.91 179.17 1krw s THR 82 N -2.70 0.04 -0.56 -0.10 2.01 -1.19 -3.83 115.64 109.32 1krw s THR 82 Ca 0.01 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 61.66 1krw s THR 82 Cb 0.10 -0.48 0.41 0.00 0.01 0.00 0.00 72.50 72.54 1krw s THR 82 CO 0.82 -0.20 1.46 0.00 -0.69 0.00 0.00 174.62 176.01 1krw n ALA 83 N 1.90 5.58 -2.91 7.40 0.00 -1.26 -4.84 120.51 126.40 1krw n ALA 83 Ca -0.19 -4.13 -0.13 0.00 0.00 0.00 0.00 53.44 48.99 1krw n ALA 83 Cb 0.57 -1.03 0.04 0.00 0.00 0.00 0.00 19.45 19.03 1krw n ALA 83 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1krw n HIS 84 N -0.56 -2.73 0.00 0.00 1.44 -1.26 -4.13 115.22 107.98 1krw n HIS 84 Ca 0.46 -1.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.07 1krw n HIS 84 Cb 0.58 -0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.37 1krw n HIS 84 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1krw n SER 85 N -2.70 0.00 -3.20 4.39 7.64 -1.26 -3.90 113.62 114.59 1krw n SER 85 Ca 0.09 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.74 1krw n SER 85 Cb 0.32 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.46 1krw n SER 85 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1krw n ASP 86 N 3.16 0.48 0.04 6.43 9.92 -1.26 -4.95 116.55 130.36 1krw n ASP 86 Ca 0.00 -2.79 0.20 0.00 -0.53 0.00 0.00 54.79 51.67 1krw n ASP 86 Cb 0.00 -0.64 0.51 0.00 -0.64 0.00 0.00 41.12 40.36 1krw n ASP 86 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1krw h LEU 87 N 3.82 0.00 -0.74 0.64 6.46 -1.72 -1.63 115.31 122.14 1krw h LEU 87 Ca 0.08 0.00 0.16 0.00 -0.12 0.00 0.00 57.88 58.01 1krw h LEU 87 Cb 0.88 0.00 -0.11 0.00 -0.73 0.00 0.00 40.66 40.70 1krw h LEU 87 CO 0.49 0.00 0.14 0.44 -0.62 0.00 0.00 178.44 178.89 1krw h ASP 88 N 0.00 -0.06 0.51 1.25 3.32 -1.92 0.35 116.42 119.85 1krw h ASP 88 Ca 0.26 0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.47 1krw h ASP 88 Cb 1.93 0.23 -0.00 0.00 0.22 0.00 0.00 39.33 41.71 1krw h ASP 88 CO -0.00 -0.07 -0.00 0.00 -1.72 0.00 0.00 179.24 177.44 1krw h ALA 89 N 1.63 1.00 -0.27 3.45 0.00 -1.66 -2.38 119.26 121.03 1krw h ALA 89 Ca 0.42 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.20 1krw h ALA 89 Cb 0.73 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1krw h ALA 89 CO -0.55 0.00 -0.35 0.00 0.00 0.00 0.00 179.25 178.36 1krw h ALA 90 N 2.00 0.89 -0.72 0.00 0.00 -0.48 -2.82 119.26 118.13 1krw h ALA 90 Ca -0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1krw h ALA 90 Cb 0.25 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1krw h ALA 90 CO 0.00 0.63 0.30 0.28 0.00 0.00 0.00 179.25 180.46 1krw h VAL 91 N 0.51 1.25 -0.42 0.00 2.07 -1.37 -2.27 116.25 116.01 1krw h VAL 91 Ca 0.05 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 1krw h VAL 91 Cb 0.84 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1krw h VAL 91 CO 0.07 0.31 0.09 0.28 0.02 0.00 0.00 177.57 178.33 1krw h SER 92 N 1.02 0.58 -0.98 0.57 0.02 -1.60 -2.36 113.55 110.81 1krw h SER 92 Ca 0.24 -0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 1krw h SER 92 Cb 0.19 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 1krw h SER 92 CO -0.02 0.60 0.63 0.00 -1.14 0.00 0.00 176.83 176.90 1krw h ALA 93 N 1.48 1.41 0.00 3.77 0.00 -1.16 0.16 119.26 124.93 1krw h ALA 93 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1krw h ALA 93 Cb 0.26 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1krw h ALA 93 CO -0.00 0.46 -0.02 1.88 0.00 0.00 0.00 179.25 181.57 1krw h TYR 94 N 1.17 0.00 -0.09 0.00 0.05 -1.24 0.30 116.97 117.15 1krw h TYR 94 Ca 0.41 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.98 1krw h TYR 94 Cb 0.12 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.87 1krw h TYR 94 CO -0.00 0.02 -0.75 -0.56 -1.05 0.00 0.00 178.16 175.82 1krw h GLN 95 N 0.00 0.67 0.00 4.88 3.07 -0.67 -3.20 115.11 119.85 1krw h GLN 95 Ca -0.00 -0.60 0.00 0.00 0.09 0.00 0.00 58.65 58.14 1krw h GLN 95 Cb 0.17 0.14 0.00 0.00 0.08 0.00 0.00 27.48 27.87 1krw h GLN 95 CO 0.00 1.21 0.00 -0.56 0.09 0.00 0.00 178.83 179.57 1krw h GLN 96 N 0.34 0.00 0.00 0.06 3.07 -1.23 -3.46 115.11 113.88 1krw h GLN 96 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.67 1krw h GLN 96 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.96 1krw h GLN 96 CO 0.15 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.48 1krw n GLY 97 N 1.00 1.80 3.77 0.06 0.00 -0.77 -2.28 105.19 108.76 1krw n GLY 97 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1krw n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1krw s ALA 98 N -1.80 3.19 -0.04 4.61 0.00 0.98 -3.85 121.76 124.85 1krw s ALA 98 Ca 0.00 1.29 -0.22 0.00 0.00 0.00 0.00 51.96 53.02 1krw s ALA 98 Cb 0.00 -3.52 -0.16 0.00 0.00 0.00 0.00 23.12 19.44 1krw s ALA 98 CO 0.00 -0.97 0.98 0.35 0.00 0.00 0.00 175.76 176.12 1krw h PHE 99 N 2.42 -0.21 0.00 0.00 3.57 -1.34 -3.43 116.94 117.94 1krw h PHE 99 Ca -0.50 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 60.99 1krw h PHE 99 Cb 1.26 0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.07 1krw h PHE 99 CO 0.52 0.21 0.00 -3.47 -2.23 0.00 0.00 178.31 173.34 1krw n ASP 100 N -4.95 0.00 -4.18 0.41 2.03 -1.14 -5.01 116.55 103.70 1krw n ASP 100 Ca -0.08 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.05 1krw n ASP 100 Cb 0.27 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.55 1krw n ASP 100 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1krw s TYR 101 N -3.00 1.23 -0.14 -0.67 1.51 -1.26 -2.92 117.35 112.10 1krw s TYR 101 Ca 0.00 -0.49 -0.06 0.00 -1.01 0.00 0.00 57.07 55.51 1krw s TYR 101 Cb 0.00 -0.68 -0.04 0.00 -0.11 0.00 0.00 41.96 41.13 1krw s TYR 101 CO 0.00 0.06 0.08 -1.17 -1.11 0.00 0.00 175.55 173.41 1krw s LEU 102 N -1.88 3.99 0.00 -1.29 2.96 0.12 -4.94 118.68 117.63 1krw s LEU 102 Ca -0.00 0.24 0.00 0.00 -0.22 0.00 0.00 54.13 54.15 1krw s LEU 102 Cb -0.09 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.62 1krw s LEU 102 CO 0.02 0.30 0.00 -0.81 -1.32 0.00 0.00 176.35 174.54 1krw n PRO 103 N 2.70 2.39 -0.28 0.98 -0.04 -1.26 -3.15 135.00 136.34 1krw n PRO 103 Ca -0.18 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.21 1krw n PRO 103 Cb 0.53 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.97 1krw n PRO 103 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1krw h LYS 104 N 0.00 -0.13 -7.02 0.54 1.57 -2.00 -3.42 116.57 106.11 1krw h LYS 104 Ca 0.00 0.01 -0.50 0.00 -1.87 0.00 0.00 60.65 58.29 1krw h LYS 104 Cb 0.00 0.03 0.21 0.00 0.08 0.00 0.00 32.23 32.55 1krw h LYS 104 CO 0.00 -0.09 -0.24 -0.35 -0.57 0.00 0.00 179.45 178.20 1krw n PRO 105 N -5.40 -1.03 0.00 3.15 -0.04 -1.26 -4.96 135.00 125.46 1krw n PRO 105 Ca 0.04 -0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 1krw n PRO 105 Cb 0.35 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1krw n PRO 105 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1krw n PHE 106 N -4.27 0.00 -0.34 0.54 7.35 -1.26 -4.95 117.46 114.53 1krw n PHE 106 Ca 0.07 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.79 1krw n PHE 106 Cb 0.54 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.36 1krw n PHE 106 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 1krw n ASP 107 N 0.00 -1.59 -0.15 -2.13 5.75 -1.26 -1.87 116.55 115.30 1krw n ASP 107 Ca 0.00 0.27 -0.11 0.00 -0.01 0.00 0.00 54.79 54.94 1krw n ASP 107 Cb 0.00 -1.12 -0.01 0.00 -1.03 0.00 0.00 41.12 38.96 1krw n ASP 107 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 1krw h ILE 108 N -0.23 1.27 -0.01 2.12 5.03 -1.96 0.28 117.51 124.01 1krw h ILE 108 Ca 0.01 -1.30 0.03 0.00 -0.12 0.00 0.00 64.86 63.48 1krw h ILE 108 Cb 0.23 1.16 -0.06 0.00 -3.03 0.00 0.00 36.82 35.12 1krw h ILE 108 CO 0.00 0.44 -0.48 -0.78 -0.68 0.00 0.00 178.15 176.66 1krw h ASP 109 N 0.75 -1.46 0.79 1.72 3.58 -1.98 0.96 116.42 120.76 1krw h ASP 109 Ca 0.11 0.17 -0.19 0.00 0.42 0.00 0.00 57.03 57.54 1krw h ASP 109 Cb 0.72 0.56 -0.02 0.00 1.72 0.00 0.00 39.33 42.31 1krw h ASP 109 CO 0.05 -0.49 -0.88 -0.33 -2.88 0.00 0.00 179.24 174.71 1krw h GLU 110 N -0.62 0.06 0.52 0.28 4.39 -1.43 -2.18 114.58 115.60 1krw h GLU 110 Ca 0.03 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 1krw h GLU 110 Cb 0.69 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1krw h GLU 110 CO -0.34 0.90 -0.25 0.00 -1.16 0.00 0.00 179.01 178.16 1krw h ALA 111 N 1.07 -0.77 -0.28 3.43 0.00 -0.44 -1.25 119.26 121.03 1krw h ALA 111 Ca -0.02 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1krw h ALA 111 Cb 1.54 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1krw h ALA 111 CO 0.12 -0.72 0.20 0.28 0.00 0.00 0.00 179.25 179.13 1krw h VAL 112 N -1.08 0.89 -0.28 0.00 2.07 0.82 0.38 116.25 119.05 1krw h VAL 112 Ca -0.07 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1krw h VAL 112 Cb 0.54 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1krw h VAL 112 CO 0.12 0.01 0.09 0.00 0.02 0.00 0.00 177.57 177.81 1krw h ALA 113 N 1.86 0.37 0.00 1.67 0.00 -1.33 -1.13 119.26 120.70 1krw h ALA 113 Ca 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1krw h ALA 113 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1krw h ALA 113 CO -0.01 -0.01 -0.21 1.25 0.00 0.00 0.00 179.25 180.27 1krw h LEU 114 N 0.29 0.00 0.08 0.00 5.85 0.11 -2.83 115.31 118.82 1krw h LEU 114 Ca 0.09 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 1krw h LEU 114 Cb 0.23 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.27 1krw h LEU 114 CO -0.00 0.21 -0.51 1.62 -0.34 0.00 0.00 178.44 179.42 1krw h VAL 115 N 0.00 1.60 -0.36 1.05 3.04 -0.72 -3.15 116.25 117.70 1krw h VAL 115 Ca -0.00 -2.40 -0.03 0.00 -1.01 0.00 0.00 66.70 63.26 1krw h VAL 115 Cb 0.90 3.19 -0.02 0.00 -2.01 0.00 0.00 31.29 33.35 1krw h VAL 115 CO 0.03 0.66 0.12 -0.33 -1.01 0.00 0.00 177.57 177.04 1krw h GLU 116 N -0.56 0.56 -0.06 4.17 5.08 -1.28 -2.34 114.58 120.14 1krw h GLU 116 Ca -0.09 -0.11 0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1krw h GLU 116 Cb 1.38 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 1krw h GLU 116 CO 0.10 0.57 0.06 0.07 -1.00 0.00 0.00 179.01 178.80 1krw h ARG 117 N 0.43 0.00 -0.12 2.33 0.11 -1.64 0.16 114.38 115.66 1krw h ARG 117 Ca 0.12 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.17 1krw h ARG 117 Cb 0.24 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.31 1krw h ARG 117 CO -0.01 0.00 -0.04 0.00 0.10 0.00 0.00 179.97 180.02 1krw h ALA 118 N 1.94 0.17 -0.01 0.08 0.00 -1.38 0.09 119.26 120.14 1krw h ALA 118 Ca 0.03 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 1krw h ALA 118 Cb 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1krw h ALA 118 CO -0.00 -0.07 -0.73 0.82 0.00 0.00 0.00 179.25 179.27 1krw h ILE 119 N -0.09 1.48 -0.32 0.00 2.04 -1.19 -3.09 117.51 116.34 1krw h ILE 119 Ca 0.03 -2.38 -0.13 0.00 1.00 0.00 0.00 64.86 63.38 1krw h ILE 119 Cb 0.48 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 1krw h ILE 119 CO 0.01 0.69 -0.30 -1.28 0.00 0.00 0.00 178.15 177.28 1krw h SER 120 N 0.06 0.81 0.50 1.72 0.87 -0.66 -2.86 113.55 113.98 1krw h SER 120 Ca -0.02 -0.46 -0.02 0.00 -1.23 0.00 0.00 61.79 60.06 1krw h SER 120 Cb 1.28 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1krw h SER 120 CO 0.10 1.10 -0.08 0.45 -0.53 0.00 0.00 176.83 177.87 1krw h HIS 121 N 0.52 0.00 -0.02 2.24 3.86 -0.98 0.11 115.15 120.88 1krw h HIS 121 Ca 0.05 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.22 1krw h HIS 121 Cb 0.87 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.34 1krw h HIS 121 CO 0.07 0.08 -0.14 1.88 0.86 0.00 0.00 177.93 180.68 1krw h TYR 122 N 0.00 0.19 0.09 2.45 0.05 -1.42 -3.36 116.97 114.97 1krw h TYR 122 Ca -0.00 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 58.69 1krw h TYR 122 Cb 0.35 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1krw h TYR 122 CO 0.00 0.80 -0.04 -0.56 -1.05 0.00 0.00 178.16 177.31 1krw h GLN 123 N -0.47 -0.11 0.00 4.88 -0.00 -1.33 -3.52 115.11 114.55 1krw h GLN 123 Ca -0.01 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1krw h GLN 123 Cb 0.82 0.03 0.00 0.00 -0.00 0.00 0.00 27.48 28.33 1krw h GLN 123 CO 0.03 0.41 0.00 -1.91 -0.00 0.00 0.00 178.83 177.36