#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1krw n GLN 2 N 0.00 -4.38 0.08 3.17 6.02 -1.26 -4.86 117.38 116.15 1krw n GLN 2 Ca 0.00 3.22 0.08 0.00 -0.01 0.00 0.00 57.00 60.29 1krw n GLN 2 Cb 0.00 -3.59 -0.03 0.00 1.02 0.00 0.00 30.24 27.64 1krw n GLN 2 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1krw n ARG 3 N -0.37 0.61 -1.55 -1.09 0.00 -1.26 -5.05 116.66 107.95 1krw n ARG 3 Ca 0.00 0.14 -0.01 0.00 -0.00 0.00 0.00 57.85 57.99 1krw n ARG 3 Cb 0.00 -1.81 -0.00 0.00 -0.00 0.00 0.00 32.46 30.64 1krw n ARG 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1krw n GLY 4 N 1.25 -3.17 3.11 2.89 0.00 -1.26 -4.40 105.19 103.61 1krw n GLY 4 Ca -0.03 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.07 2.34 -0.18 -0.61 1.09 -1.26 0.16 121.20 122.66 1krw s ILE 5 Ca -0.03 -1.35 -0.06 0.00 -1.10 0.00 0.00 60.65 58.12 1krw s ILE 5 Cb 0.00 -2.25 -0.03 0.00 -1.06 0.00 0.00 42.46 39.12 1krw s ILE 5 CO 0.07 0.14 0.03 0.54 -0.10 0.00 0.00 174.94 175.62 1krw s VAL 6 N 1.20 4.40 -0.10 2.92 0.11 0.37 0.25 120.40 129.54 1krw s VAL 6 Ca -0.04 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 1krw s VAL 6 Cb -0.18 -2.98 -0.02 0.00 -1.53 0.00 0.00 36.38 31.68 1krw s VAL 6 CO -0.06 0.45 -0.15 0.26 -3.33 0.00 0.00 175.10 172.27 1krw s TRP 7 N 0.57 2.75 0.00 1.54 0.52 -0.98 -1.74 118.94 121.60 1krw s TRP 7 Ca 0.01 -0.54 0.07 0.00 0.02 0.00 0.00 56.10 55.66 1krw s TRP 7 Cb -0.13 -1.77 -0.02 0.00 -1.15 0.00 0.00 33.47 30.40 1krw s TRP 7 CO 0.02 -0.12 -0.21 0.08 0.02 0.00 0.00 176.95 176.74 1krw s VAL 8 N 0.04 1.68 -0.23 4.03 1.01 0.70 -1.17 120.40 126.47 1krw s VAL 8 Ca -0.05 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 60.93 1krw s VAL 8 Cb -0.15 -1.42 0.06 0.00 0.00 0.00 0.00 36.38 34.87 1krw s VAL 8 CO 0.04 0.39 -0.08 0.68 0.00 0.00 0.00 175.10 176.13 1krw s VAL 9 N -0.60 1.72 0.00 2.92 -7.23 -0.32 0.98 120.40 117.87 1krw s VAL 9 Ca 0.08 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 58.99 1krw s VAL 9 Cb -0.08 -1.89 0.00 0.00 0.56 0.00 0.00 36.38 34.96 1krw s VAL 9 CO 0.00 -0.01 0.00 -0.67 -0.31 0.00 0.00 175.10 174.11 1krw n ASP 10 N 4.62 0.00 0.00 4.85 -0.08 -0.84 -2.13 116.55 122.97 1krw n ASP 10 Ca -0.13 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.16 1krw n ASP 10 Cb 0.44 0.00 0.05 0.00 2.34 0.00 0.00 41.12 43.95 1krw n ASP 10 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1krw n ASP 11 N 0.00 0.00 0.00 1.67 9.92 -1.26 -3.34 116.55 123.54 1krw n ASP 11 Ca 0.00 -1.15 0.00 0.00 -0.53 0.00 0.00 54.79 53.11 1krw n ASP 11 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1krw n ASP 11 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1krw n ASP 12 N -0.54 0.00 0.00 -2.24 5.68 -1.26 -4.53 116.55 113.66 1krw n ASP 12 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.30 1krw n ASP 12 Cb 0.01 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 1krw n ASP 12 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1krw n SER 13 N 0.29 0.00 0.03 -1.12 2.88 -1.26 0.12 113.62 114.57 1krw n SER 13 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 1krw n SER 13 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1krw n SER 13 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1krw h SER 14 N 0.00 0.55 -0.22 -3.46 0.87 -2.01 -3.16 113.55 106.12 1krw h SER 14 Ca 0.00 -0.85 -0.05 0.00 -1.23 0.00 0.00 61.79 59.66 1krw h SER 14 Cb 0.00 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.77 1krw h SER 14 CO 0.00 1.34 -0.01 0.40 -0.53 0.00 0.00 176.83 178.04 1krw h ILE 15 N -0.16 1.20 0.17 2.23 1.08 0.61 -2.87 117.51 119.77 1krw h ILE 15 Ca -0.12 -0.78 -0.01 0.00 -0.39 0.00 0.00 64.86 63.56 1krw h ILE 15 Cb 1.53 0.96 0.00 0.00 -3.07 0.00 0.00 36.82 36.24 1krw h ILE 15 CO 0.15 0.27 -0.08 0.08 -0.69 0.00 0.00 178.15 177.88 1krw h ARG 16 N 0.49 -0.22 -0.86 2.37 0.11 -1.64 -2.60 114.38 112.04 1krw h ARG 16 Ca 0.11 0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.30 1krw h ARG 16 Cb 0.33 0.05 -0.08 0.00 1.11 0.00 0.00 29.97 31.38 1krw h ARG 16 CO 0.01 0.14 0.50 2.35 0.10 0.00 0.00 179.97 183.08 1krw h TRP 17 N -0.62 0.91 -0.04 4.08 7.01 -1.50 0.86 115.95 126.64 1krw h TRP 17 Ca -0.02 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1krw h TRP 17 Cb 0.46 -0.28 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 1krw h TRP 17 CO 0.04 0.36 -0.01 0.28 -2.79 0.00 0.00 178.44 176.32 1krw h VAL 18 N 0.82 1.30 0.00 2.65 2.07 -1.54 -3.01 116.25 118.55 1krw h VAL 18 Ca 0.42 -0.92 -0.14 0.00 0.82 0.00 0.00 66.70 66.88 1krw h VAL 18 Cb 0.41 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1krw h VAL 18 CO -0.26 0.25 -0.68 -0.07 0.02 0.00 0.00 177.57 176.83 1krw h LEU 19 N -0.27 0.00 0.54 2.57 3.38 -1.21 -3.07 115.31 117.25 1krw h LEU 19 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1krw h LEU 19 Cb 0.41 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1krw h LEU 19 CO 0.00 0.68 -0.26 1.05 0.09 0.00 0.00 178.44 180.01 1krw h GLU 20 N 0.00 -0.70 0.44 1.13 4.11 0.69 -1.74 114.58 118.51 1krw h GLU 20 Ca -0.01 0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.45 1krw h GLU 20 Cb 1.51 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.92 1krw h GLU 20 CO 0.09 -0.40 -0.21 0.00 0.07 0.00 0.00 179.01 178.56 1krw h ARG 21 N -1.06 -0.57 -0.48 1.06 2.47 -1.67 -0.46 114.38 113.67 1krw h ARG 21 Ca -0.07 0.04 0.06 0.00 -1.26 0.00 0.00 59.98 58.74 1krw h ARG 21 Cb 0.62 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 29.04 1krw h ARG 21 CO 0.12 -0.36 0.32 0.00 0.56 0.00 0.00 179.97 180.62 1krw h ALA 22 N -0.07 1.93 0.00 0.04 0.00 -1.65 -0.31 119.26 119.20 1krw h ALA 22 Ca -0.06 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1krw h ALA 22 Cb 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1krw h ALA 22 CO 0.10 -0.01 -0.81 1.25 0.00 0.00 0.00 179.25 179.77 1krw h LEU 23 N 0.40 0.03 -1.27 0.00 7.12 -1.11 -2.98 115.31 117.51 1krw h LEU 23 Ca 0.21 -0.03 -0.06 0.00 0.13 0.00 0.00 57.88 58.13 1krw h LEU 23 Cb 0.31 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.41 1krw h LEU 23 CO -0.05 0.83 -0.10 0.00 -0.13 0.00 0.00 178.44 178.99 1krw h ALA 24 N 1.17 1.40 0.00 1.25 0.00 0.65 -1.01 119.26 122.72 1krw h ALA 24 Ca -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1krw h ALA 24 Cb 1.43 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1krw h ALA 24 CO 0.11 0.42 -0.10 0.78 0.00 0.00 0.00 179.25 180.46 1krw h GLY 25 N 0.82 0.00 2.00 0.00 0.00 -1.23 0.04 103.07 104.71 1krw h GLY 25 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1krw h GLY 25 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1krw h ALA 26 N 1.90 1.00 0.00 3.60 0.00 -1.23 -3.47 119.26 121.06 1krw h ALA 26 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1krw h ALA 26 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1krw h ALA 26 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1krw n GLY 27 N 1.05 1.42 3.36 0.00 0.00 0.00 -5.11 105.19 105.92 1krw n GLY 27 Ca 0.05 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 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 1.79 -0.07 0.99 1.02 -1.19 -4.70 118.68 116.52 1krw s LEU 28 Ca 0.00 -1.42 -0.12 0.00 0.02 0.00 0.00 54.13 52.61 1krw s LEU 28 Cb 0.00 -0.07 -0.05 0.00 0.02 0.00 0.00 46.19 46.10 1krw s LEU 28 CO 0.00 -0.73 0.31 -0.89 0.02 0.00 0.00 176.35 175.06 1krw s THR 29 N -3.60 5.23 -0.14 5.49 2.01 0.12 -3.94 115.64 120.81 1krw s THR 29 Ca 0.37 0.60 0.00 0.00 0.31 0.00 0.00 61.69 62.97 1krw s THR 29 Cb 0.07 -3.61 0.02 0.00 0.01 0.00 0.00 72.50 69.00 1krw s THR 29 CO 0.15 0.54 -0.13 0.00 -0.69 0.00 0.00 174.62 174.49 1krw s THR 31 N 1.52 1.43 0.32 0.00 -1.32 -0.71 -4.82 115.64 112.06 1krw s THR 31 Ca 0.05 -0.68 0.07 0.00 -1.21 0.00 0.00 61.69 59.92 1krw s THR 31 Cb -0.13 -1.26 -0.02 0.00 -1.51 0.00 0.00 72.50 69.58 1krw s THR 31 CO -0.10 0.42 0.35 0.42 -2.21 0.00 0.00 174.62 173.50 1krw s THR 32 N 0.34 3.98 0.30 5.08 -4.23 -1.25 -0.21 115.64 119.64 1krw s THR 32 Ca -0.11 -1.21 0.03 0.00 -1.18 0.00 0.00 61.69 59.22 1krw s THR 32 Cb -0.14 -3.35 -0.04 0.00 1.34 0.00 0.00 72.50 70.30 1krw s THR 32 CO 0.04 -0.20 0.13 -0.36 -0.54 0.00 0.00 174.62 173.69 1krw s PHE 33 N -2.21 1.61 0.35 3.99 0.40 0.27 -4.88 117.98 117.53 1krw s PHE 33 Ca 0.41 -1.28 0.04 0.00 -0.60 0.00 0.00 56.93 55.51 1krw s PHE 33 Cb -0.08 -0.92 0.66 0.00 0.51 0.00 0.00 43.02 43.19 1krw s PHE 33 CO 0.28 -0.41 1.94 1.05 0.70 0.00 0.00 175.22 178.78 1krw h GLU 34 N 2.23 0.60 0.00 0.44 4.11 -1.88 -2.25 114.58 117.84 1krw h GLU 34 Ca -0.36 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1krw h GLU 34 Cb 1.25 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1krw h GLU 34 CO 0.56 0.52 0.00 0.27 0.07 0.00 0.00 179.01 180.43 1krw n ASN 35 N -4.36 0.00 0.00 3.06 0.23 -1.21 -4.14 115.26 108.85 1krw n ASN 35 Ca 0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.08 1krw n ASN 35 Cb 0.16 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 1krw n ASN 35 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1krw n GLY 36 N -0.05 0.33 0.43 4.83 0.00 -1.26 -4.30 105.19 105.17 1krw n GLY 36 Ca 0.00 0.16 0.25 0.00 0.00 0.00 0.00 46.02 46.43 1krw n GLY 36 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1krw h ASN 37 N 0.00 0.30 -0.14 1.61 -0.00 -1.97 -0.64 115.58 114.74 1krw h ASN 37 Ca 0.00 0.05 0.04 0.00 -0.00 0.00 0.00 56.30 56.39 1krw h ASN 37 Cb 0.00 -0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 38.27 1krw h ASN 37 CO 0.00 0.08 -0.17 -0.08 -0.00 0.00 0.00 177.43 177.27 1krw h GLU 38 N 0.28 -0.20 -0.92 6.67 4.22 -1.98 -2.02 114.58 120.63 1krw h GLU 38 Ca 0.53 0.01 0.06 0.00 0.08 0.00 0.00 59.36 60.04 1krw h GLU 38 Cb 1.56 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.79 1krw h GLU 38 CO -0.17 -0.13 0.59 0.28 -2.18 0.00 0.00 179.01 177.39 1krw h VAL 39 N -0.20 1.09 -0.96 0.32 2.07 -1.51 0.16 116.25 117.22 1krw h VAL 39 Ca 0.10 -0.37 0.15 0.00 0.82 0.00 0.00 66.70 67.39 1krw h VAL 39 Cb 0.35 -0.10 -0.09 0.00 -1.52 0.00 0.00 31.29 29.93 1krw h VAL 39 CO -0.26 0.20 0.58 -0.07 0.02 0.00 0.00 177.57 178.04 1krw h LEU 40 N 1.09 0.79 0.01 2.57 3.38 -1.29 1.07 115.31 122.93 1krw h LEU 40 Ca 0.39 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.40 1krw h LEU 40 Cb 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1krw h LEU 40 CO -0.16 0.36 -0.15 0.00 0.09 0.00 0.00 178.44 178.58 1krw h ALA 41 N 1.57 0.00 0.00 1.53 0.00 -0.82 -3.25 119.26 118.30 1krw h ALA 41 Ca 0.51 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1krw h ALA 41 Cb 0.64 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1krw h ALA 41 CO -0.32 0.03 -0.04 0.00 0.00 0.00 0.00 179.25 178.92 1krw h ALA 42 N 0.16 1.44 0.00 0.00 0.00 -0.19 -1.37 119.26 119.30 1krw h ALA 42 Ca -0.02 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1krw h ALA 42 Cb 0.99 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1krw h ALA 42 CO 0.03 0.05 -0.09 -0.07 0.00 0.00 0.00 179.25 179.18 1krw h LEU 43 N 0.00 0.00 -2.12 0.00 3.38 0.11 -2.83 115.31 113.86 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 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1krw h LEU 43 CO 0.01 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.62 1krw h ALA 44 N 1.91 1.00 0.00 1.53 0.00 -1.33 -2.05 119.26 120.32 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 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1krw h ALA 44 CO 0.01 0.00 0.00 0.45 0.00 0.00 0.00 179.25 179.71 1krw n SER 45 N -2.62 0.59 -3.46 0.00 2.88 -1.08 -5.07 113.62 104.86 1krw n SER 45 Ca -0.02 -0.81 -0.11 0.00 -1.33 0.00 0.00 58.87 56.60 1krw n SER 45 Cb 0.05 0.31 -0.02 0.00 -0.75 0.00 0.00 64.21 63.80 1krw n SER 45 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1krw s LYS 46 N -0.31 1.09 -0.12 -1.46 2.20 -0.77 -5.16 119.74 115.20 1krw s LYS 46 Ca 0.00 -0.34 -0.04 0.00 -0.36 0.00 0.00 55.97 55.23 1krw s LYS 46 Cb 0.00 0.50 0.05 0.00 -1.51 0.00 0.00 37.83 36.87 1krw s LYS 46 CO 0.00 -0.46 0.07 0.99 -0.36 0.00 0.00 175.35 175.58 1krw s THR 47 N -3.28 -0.01 0.72 3.43 2.01 -1.26 -4.01 115.64 113.23 1krw s THR 47 Ca 0.01 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.92 1krw s THR 47 Cb -0.01 -0.47 0.02 0.00 0.01 0.00 0.00 72.50 72.05 1krw s THR 47 CO -0.10 -0.09 1.07 -2.16 -0.69 0.00 0.00 174.62 172.66 1krw s PRO 48 N 2.11 2.74 0.48 4.92 0.04 -1.26 -4.96 135.00 139.08 1krw s PRO 48 Ca 0.03 0.82 0.28 0.00 0.04 0.00 0.00 61.00 62.16 1krw s PRO 48 Cb -0.15 -1.98 0.92 0.00 0.04 0.00 0.00 34.50 33.34 1krw s PRO 48 CO -0.07 -1.20 1.82 -0.44 0.04 0.00 0.00 177.00 177.15 1krw h ASP 49 N -0.79 0.00 -5.27 6.66 5.19 -0.59 -3.46 116.42 118.17 1krw h ASP 49 Ca -0.45 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.87 1krw h ASP 49 Cb 1.23 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 40.62 1krw h ASP 49 CO 0.58 0.08 -0.26 0.54 -3.12 0.00 0.00 179.24 177.06 1krw s VAL 50 N -3.50 0.04 -0.19 -1.35 0.11 -1.14 -4.58 120.40 109.79 1krw s VAL 50 Ca 0.03 -1.38 -0.11 0.00 -2.93 0.00 0.00 61.98 57.59 1krw s VAL 50 Cb 0.08 -1.95 0.06 0.00 -1.53 0.00 0.00 36.38 33.04 1krw s VAL 50 CO 0.61 -0.19 0.46 -0.22 -3.33 0.00 0.00 175.10 172.43 1krw s LEU 51 N -2.99 -0.21 -0.21 2.54 2.96 0.25 -2.31 118.68 118.72 1krw s LEU 51 Ca 0.19 1.00 -0.03 0.00 -0.22 0.00 0.00 54.13 55.07 1krw s LEU 51 Cb 0.02 1.54 -0.01 0.00 0.50 0.00 0.00 46.19 48.24 1krw s LEU 51 CO 0.03 -0.20 -0.06 -0.22 -1.32 0.00 0.00 176.35 174.58 1krw s LEU 52 N 1.35 2.86 -0.16 -0.68 0.20 -0.32 0.15 118.68 122.08 1krw s LEU 52 Ca -0.09 -0.38 -0.05 0.00 0.69 0.00 0.00 54.13 54.29 1krw s LEU 52 Cb -0.07 -1.72 -0.03 0.00 -0.43 0.00 0.00 46.19 43.93 1krw s LEU 52 CO -0.13 0.01 0.01 -0.44 -0.29 0.00 0.00 176.35 175.51 1krw s SER 53 N 1.31 5.25 0.44 3.68 0.01 0.80 -1.17 113.70 124.01 1krw s SER 53 Ca 0.04 0.00 0.24 0.00 1.31 0.00 0.00 55.95 57.54 1krw s SER 53 Cb -0.14 -1.85 0.80 0.00 0.21 0.00 0.00 66.02 65.03 1krw s SER 53 CO -0.03 0.19 1.77 -0.78 0.41 0.00 0.00 173.24 174.81 1krw h ASP 54 N 6.55 0.00 -5.94 2.44 3.58 -1.63 -2.92 116.42 118.50 1krw h ASP 54 Ca -0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.10 1krw h ASP 54 Cb 1.18 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.20 1krw h ASP 54 CO 0.66 0.18 -0.38 0.00 -2.88 0.00 0.00 179.24 176.83 1krw n ILE 55 N -3.26 -3.49 -2.76 2.25 0.00 -1.26 -4.61 119.36 106.23 1krw n ILE 55 Ca 0.01 0.59 -0.04 0.00 0.00 0.00 0.00 62.75 63.31 1krw n ILE 55 Cb 0.46 -3.36 0.05 0.00 0.00 0.00 0.00 39.64 36.80 1krw n ILE 55 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 1krw n ARG 56 N 2.30 1.47 -3.52 9.51 1.85 -1.25 -4.79 116.66 122.23 1krw n ARG 56 Ca -0.08 -3.15 -0.19 0.00 -1.00 0.00 0.00 57.85 53.42 1krw n ARG 56 Cb 0.15 -1.24 0.08 0.00 -1.05 0.00 0.00 32.46 30.40 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 -0.49 -6.53 0.00 2.89 0.00 -0.60 -4.93 117.12 107.46 1krw n MET 57 Ca 0.05 0.80 0.00 0.00 -0.00 0.00 0.00 57.70 58.55 1krw n MET 57 Cb 0.82 -5.75 0.00 0.00 0.00 0.00 0.00 33.22 28.29 1krw n MET 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1krw n PRO 58 N -4.31 0.00 -0.03 2.12 -0.04 -1.26 -4.57 135.00 126.91 1krw n PRO 58 Ca -0.23 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1krw n PRO 58 Cb 0.65 -0.84 -0.10 0.00 -0.04 0.00 0.00 33.50 33.17 1krw n PRO 58 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1krw n GLY 59 N 0.67 -0.61 2.70 0.55 0.00 -1.26 -4.83 105.19 102.42 1krw n GLY 59 Ca 0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 1krw n GLY 59 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1krw n MET 60 N -2.22 0.90 0.00 1.61 0.00 -1.26 -4.93 117.12 111.22 1krw n MET 60 Ca -0.12 -1.92 0.00 0.00 -0.00 0.00 0.00 57.70 55.66 1krw n MET 60 Cb 0.63 -1.26 0.00 0.00 0.00 0.00 0.00 33.22 32.59 1krw n MET 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1krw n ASP 61 N 1.00 0.00 0.00 6.12 8.00 -1.26 -2.20 116.55 128.21 1krw n ASP 61 Ca 0.09 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1krw n ASP 61 Cb 0.66 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.55 1krw n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1krw n GLY 62 N -1.33 1.00 0.17 0.44 0.00 -1.26 -1.56 105.19 102.64 1krw n GLY 62 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.79 0.99 4.07 -1.83 -2.91 115.31 113.84 1krw h LEU 63 Ca 0.00 0.00 0.18 0.00 0.08 0.00 0.00 57.88 58.14 1krw h LEU 63 Cb 0.00 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.70 1krw h LEU 63 CO 0.00 0.00 0.50 0.00 -1.08 0.00 0.00 178.44 177.86 1krw h ALA 64 N 2.21 2.40 -0.62 1.53 0.00 -1.87 0.18 119.26 123.09 1krw h ALA 64 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1krw h ALA 64 Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1krw h ALA 64 CO 0.00 -0.60 0.36 -0.07 0.00 0.00 0.00 179.25 178.93 1krw h LEU 65 N 0.19 0.76 -0.52 0.00 4.07 -1.85 -2.73 115.31 115.23 1krw h LEU 65 Ca 0.35 -0.08 0.04 0.00 0.08 0.00 0.00 57.88 58.27 1krw h LEU 65 Cb 1.11 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 42.61 1krw h LEU 65 CO -0.07 0.61 0.28 -0.07 -1.08 0.00 0.00 178.44 178.12 1krw h LEU 66 N 0.84 0.43 -0.40 1.67 -0.00 -0.85 -1.77 115.31 115.21 1krw h LEU 66 Ca 0.22 0.02 0.06 0.00 -0.00 0.00 0.00 57.88 58.18 1krw h LEU 66 Cb 0.01 -0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 40.56 1krw h LEU 66 CO -0.04 0.29 0.11 0.11 -0.00 0.00 0.00 178.44 178.91 1krw h LYS 67 N 0.55 0.24 0.00 1.13 1.57 -1.28 -0.00 116.57 118.78 1krw h LYS 67 Ca 0.22 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1krw h LYS 67 Cb 0.10 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1krw h LYS 67 CO -0.14 0.16 -0.00 1.96 -0.57 0.00 0.00 179.45 180.86 1krw h GLN 68 N 0.25 0.00 -0.23 3.15 1.08 -1.16 -2.44 115.11 115.76 1krw h GLN 68 Ca 0.19 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.42 1krw h GLN 68 Cb 0.21 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 1krw h GLN 68 CO -0.23 0.00 0.04 0.82 -0.95 0.00 0.00 178.83 178.51 1krw h ILE 69 N 0.00 0.88 -0.29 2.54 2.04 -0.14 -1.29 117.51 121.25 1krw h ILE 69 Ca -0.00 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1krw h ILE 69 Cb 0.00 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 1krw h ILE 69 CO 0.00 0.02 0.03 0.07 0.00 0.00 0.00 178.15 178.27 1krw h LYS 70 N 0.12 0.43 -0.06 2.37 2.10 -1.31 0.89 116.57 121.11 1krw h LYS 70 Ca 0.11 -0.07 -0.16 0.00 -2.00 0.00 0.00 60.65 58.52 1krw h LYS 70 Cb 0.11 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 31.36 1krw h LYS 70 CO -0.15 0.44 -0.66 1.96 -2.00 0.00 0.00 179.45 179.05 1krw h GLN 71 N 0.42 0.25 0.00 0.07 4.20 -1.32 -3.41 115.11 115.32 1krw h GLN 71 Ca 0.10 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1krw h GLN 71 Cb 0.24 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1krw h GLN 71 CO 0.00 0.81 -0.24 0.54 -0.67 0.00 0.00 178.83 179.28 1krw n ARG 72 N -3.83 0.13 -2.02 1.46 1.74 -0.54 -5.07 116.66 108.52 1krw n ARG 72 Ca -0.03 0.05 -0.28 0.00 -0.77 0.00 0.00 57.85 56.82 1krw n ARG 72 Cb 0.65 -0.60 0.07 0.00 -1.02 0.00 0.00 32.46 31.57 1krw n ARG 72 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1krw s HIS 73 N -1.65 3.00 -0.01 -1.55 3.76 0.31 -5.07 115.29 114.08 1krw s HIS 73 Ca -0.07 0.68 -0.00 0.00 -0.15 0.00 0.00 55.06 55.51 1krw s HIS 73 Cb 0.01 -3.31 -0.00 0.00 1.11 0.00 0.00 32.58 30.39 1krw s HIS 73 CO 0.10 -1.53 -0.01 -1.00 -0.85 0.00 0.00 174.74 171.45 1krw h PRO 74 N -0.81 0.00 -0.34 8.40 0.13 -1.84 -3.34 132.00 134.19 1krw h PRO 74 Ca -0.45 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.43 1krw h PRO 74 Cb 1.31 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.18 1krw h PRO 74 CO 0.64 0.00 -0.70 -1.33 -0.23 0.00 0.00 178.00 176.38 1krw n MET 75 N -2.38 1.32 -1.61 0.86 2.81 -1.23 -4.42 117.12 112.48 1krw n MET 75 Ca -0.00 -2.37 -0.46 0.00 -1.81 0.00 0.00 57.70 53.05 1krw n MET 75 Cb 0.01 -0.54 -0.04 0.00 -0.71 0.00 0.00 33.22 31.94 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 -0.68 3.26 -4.68 4.03 7.94 -1.26 -4.39 117.00 121.23 1krw n LEU 76 Ca -0.01 0.59 -0.42 0.00 -1.11 0.00 0.00 56.01 55.06 1krw n LEU 76 Cb 0.84 -1.44 -0.03 0.00 0.53 0.00 0.00 43.42 43.32 1krw n LEU 76 CO 0.02 -0.35 1.53 -0.81 -1.11 0.00 0.00 177.39 176.68 1krw n PRO 77 N 7.81 2.84 -4.32 1.96 -0.04 -1.26 -3.19 135.00 138.80 1krw n PRO 77 Ca 0.28 1.04 -0.23 0.00 -0.04 0.00 0.00 63.50 64.55 1krw n PRO 77 Cb 0.35 -2.96 -0.12 0.00 -0.04 0.00 0.00 33.50 30.74 1krw n PRO 77 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1krw s VAL 78 N 3.43 1.83 -0.18 0.52 1.01 -1.24 -0.58 120.40 125.19 1krw s VAL 78 Ca 0.85 -1.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 1krw s VAL 78 Cb -0.46 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.21 1krw s VAL 78 CO 0.39 -0.20 -0.05 -0.63 0.00 0.00 0.00 175.10 174.61 1krw s ILE 79 N -1.67 1.18 0.01 2.22 1.01 0.39 0.88 121.20 125.23 1krw s ILE 79 Ca 0.13 -0.73 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 1krw s ILE 79 Cb -0.08 -1.37 -0.06 0.00 0.01 0.00 0.00 42.46 40.97 1krw s ILE 79 CO 0.06 0.09 0.39 -0.63 0.00 0.00 0.00 174.94 174.86 1krw s ILE 80 N 1.59 5.07 0.09 2.92 -1.09 -1.00 -0.14 121.20 128.63 1krw s ILE 80 Ca -0.00 0.73 0.00 0.00 -2.23 0.00 0.00 60.65 59.15 1krw s ILE 80 Cb -0.16 -3.68 -0.26 0.00 -1.58 0.00 0.00 42.46 36.79 1krw s ILE 80 CO -0.08 0.52 1.18 0.00 -1.23 0.00 0.00 174.94 175.34 1krw h MET 81 N 4.52 0.17 -3.13 2.79 -0.00 -1.77 0.63 114.93 118.14 1krw h MET 81 Ca -0.51 -0.28 -0.14 0.00 -0.00 0.00 0.00 59.70 58.76 1krw h MET 81 Cb 1.22 0.11 -0.23 0.00 -0.00 0.00 0.00 31.60 32.69 1krw h MET 81 CO 0.62 1.13 -0.37 0.99 -0.00 0.00 0.00 176.91 179.28 1krw s THR 82 N -2.67 0.03 -0.11 -0.10 2.01 -1.25 -3.96 115.64 109.60 1krw s THR 82 Ca -0.02 -0.27 0.15 0.00 0.31 0.00 0.00 61.69 61.86 1krw s THR 82 Cb 0.08 -0.47 -0.10 0.00 0.01 0.00 0.00 72.50 72.02 1krw s THR 82 CO 0.86 -0.15 1.00 0.00 -0.69 0.00 0.00 174.62 175.64 1krw h ALA 83 N 4.87 0.65 -6.68 7.40 0.00 -1.91 -3.47 119.26 120.12 1krw h ALA 83 Ca -0.28 -0.80 -0.54 0.00 0.00 0.00 0.00 54.91 53.29 1krw h ALA 83 Cb 1.19 0.17 -0.15 0.00 0.00 0.00 0.00 17.79 19.00 1krw h ALA 83 CO 0.37 0.92 -0.86 0.72 0.00 0.00 0.00 179.25 180.39 1krw n HIS 84 N -3.02 -1.68 -2.96 0.00 8.25 -1.26 -3.32 115.22 111.24 1krw n HIS 84 Ca -0.07 0.77 -0.08 0.00 -0.26 0.00 0.00 57.72 58.09 1krw n HIS 84 Cb 0.84 -3.24 0.01 0.00 1.12 0.00 0.00 29.99 28.71 1krw n HIS 84 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1krw n SER 85 N -2.80 -7.40 0.00 0.41 7.64 -1.26 -4.97 113.62 105.24 1krw n SER 85 Ca -0.10 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.56 1krw n SER 85 Cb 0.58 -4.13 0.00 0.00 -1.01 0.00 0.00 64.21 59.65 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 0.42 0.00 0.22 6.43 8.00 -1.21 -5.00 116.55 125.41 1krw n ASP 86 Ca 0.02 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.67 1krw n ASP 86 Cb 0.32 0.00 0.59 0.00 -0.02 0.00 0.00 41.12 42.01 1krw n ASP 86 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1krw h LEU 87 N 0.00 0.00 -0.20 0.64 -0.00 -1.94 -2.59 115.31 111.23 1krw h LEU 87 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.91 1krw h LEU 87 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.60 1krw h LEU 87 CO 0.00 0.00 -0.49 -2.24 -0.00 0.00 0.00 178.44 175.71 1krw h ASP 88 N 0.00 -1.59 1.40 -0.43 2.03 -1.98 0.35 116.42 116.20 1krw h ASP 88 Ca 0.10 0.19 -0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1krw h ASP 88 Cb 1.27 0.63 -0.00 0.00 -0.83 0.00 0.00 39.33 40.40 1krw h ASP 88 CO -0.00 -0.41 -0.00 0.00 -1.03 0.00 0.00 179.24 177.80 1krw h ALA 89 N -0.35 1.00 -0.21 4.15 0.00 -1.86 -3.20 119.26 118.80 1krw h ALA 89 Ca 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1krw h ALA 89 Cb 0.59 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1krw h ALA 89 CO -0.44 0.00 0.10 0.00 0.00 0.00 0.00 179.25 178.92 1krw h ALA 90 N 2.00 0.27 -0.49 0.00 0.00 -0.96 -1.69 119.26 118.39 1krw h ALA 90 Ca -0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1krw h ALA 90 Cb 0.70 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1krw h ALA 90 CO 0.00 -0.17 -0.10 0.28 0.00 0.00 0.00 179.25 179.26 1krw h VAL 91 N 0.21 1.27 0.00 0.00 2.07 -1.06 -1.62 116.25 117.12 1krw h VAL 91 Ca 0.07 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1krw h VAL 91 Cb 0.12 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1krw h VAL 91 CO -0.01 0.43 0.00 0.28 0.02 0.00 0.00 177.57 178.29 1krw h SER 92 N 0.79 0.00 0.13 0.57 0.02 -1.52 -2.98 113.55 110.55 1krw h SER 92 Ca 0.13 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1krw h SER 92 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1krw h SER 92 CO 0.05 0.00 -0.06 0.00 -1.14 0.00 0.00 176.83 175.67 1krw h ALA 93 N 2.05 -0.25 -0.96 3.77 0.00 -0.33 -1.94 119.26 121.60 1krw h ALA 93 Ca 0.00 -0.04 0.30 0.00 0.00 0.00 0.00 54.91 55.17 1krw h ALA 93 Cb 0.09 0.07 -0.17 0.00 0.00 0.00 0.00 17.79 17.77 1krw h ALA 93 CO 0.00 -0.24 0.21 1.88 0.00 0.00 0.00 179.25 181.10 1krw h TYR 94 N -0.65 0.28 -0.06 0.00 0.05 -1.39 2.29 116.97 117.50 1krw h TYR 94 Ca -0.02 0.06 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 1krw h TYR 94 Cb 0.13 0.04 -0.00 0.00 1.01 0.00 0.00 36.73 37.91 1krw h TYR 94 CO 0.02 -0.38 -0.06 -0.56 -1.05 0.00 0.00 178.16 176.13 1krw h GLN 95 N 0.07 0.15 0.00 4.88 3.07 -1.67 -2.98 115.11 118.62 1krw h GLN 95 Ca 0.65 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 59.31 1krw h GLN 95 Cb 1.45 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.01 1krw h GLN 95 CO -0.81 0.60 0.00 1.04 0.09 0.00 0.00 178.83 179.75 1krw n GLN 96 N -4.73 0.01 0.00 0.06 6.02 0.13 -4.82 117.38 114.05 1krw n GLN 96 Ca -0.08 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1krw n GLN 96 Cb 0.30 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.06 1krw n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1krw n GLY 97 N 0.88 0.44 3.64 1.08 0.00 0.73 -3.52 105.19 108.45 1krw n GLY 97 Ca 0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 -2.14 -0.06 4.61 0.00 -0.95 -3.62 121.76 119.60 1krw s ALA 98 Ca 0.00 2.09 -0.22 0.00 0.00 0.00 0.00 51.96 53.83 1krw s ALA 98 Cb 0.00 -1.60 -0.17 0.00 0.00 0.00 0.00 23.12 21.35 1krw s ALA 98 CO 0.00 -0.30 0.90 0.35 0.00 0.00 0.00 175.76 176.71 1krw h PHE 99 N 5.39 -0.14 0.00 0.00 3.57 0.20 -3.33 116.94 122.63 1krw h PHE 99 Ca -0.28 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1krw h PHE 99 Cb 1.19 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1krw h PHE 99 CO 0.19 0.35 0.00 -3.47 -2.23 0.00 0.00 178.31 173.15 1krw n ASP 100 N -4.87 0.00 -4.56 0.41 2.03 -1.17 -4.95 116.55 103.43 1krw n ASP 100 Ca -0.08 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.95 1krw n ASP 100 Cb 0.28 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.58 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 -2.89 2.64 -0.11 -0.67 1.51 -1.26 -2.38 117.35 114.18 1krw s TYR 101 Ca 0.00 -0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1krw s TYR 101 Cb 0.00 -1.32 -0.03 0.00 -0.11 0.00 0.00 41.96 40.49 1krw s TYR 101 CO 0.00 0.48 0.03 -1.17 -1.11 0.00 0.00 175.55 173.78 1krw s LEU 102 N -2.61 3.71 0.00 -1.29 2.96 0.22 -4.92 118.68 116.76 1krw s LEU 102 Ca 0.23 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.30 1krw s LEU 102 Cb -0.09 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.72 1krw s LEU 102 CO 0.14 0.33 0.00 -0.81 -1.32 0.00 0.00 176.35 174.69 1krw n PRO 103 N 2.49 0.63 -0.01 0.98 -0.04 -1.26 -3.78 135.00 134.00 1krw n PRO 103 Ca -0.18 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.13 1krw n PRO 103 Cb 0.53 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.91 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 -0.54 -6.51 0.54 1.57 -2.00 -3.43 116.57 106.19 1krw h LYS 104 Ca 0.00 0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 58.31 1krw h LYS 104 Cb 0.00 0.12 0.23 0.00 0.08 0.00 0.00 32.23 32.66 1krw h LYS 104 CO 0.00 -0.36 -1.24 -2.30 -0.57 0.00 0.00 179.45 174.97 1krw n PRO 105 N -5.44 -0.61 0.00 3.15 -0.02 -1.26 -4.98 135.00 125.85 1krw n PRO 105 Ca -0.06 -0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1krw n PRO 105 Cb 0.38 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1krw n PRO 105 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1krw n PHE 106 N -3.65 0.00 -0.18 6.00 7.35 -1.26 -4.96 117.46 120.76 1krw n PHE 106 Ca 0.02 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.73 1krw n PHE 106 Cb 0.60 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.42 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 -0.91 -0.14 -2.13 5.75 -1.26 -1.73 116.55 116.13 1krw n ASP 107 Ca 0.00 0.06 -0.11 0.00 -0.01 0.00 0.00 54.79 54.73 1krw n ASP 107 Cb 0.00 -0.98 -0.02 0.00 -1.03 0.00 0.00 41.12 39.10 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 -0.20 1.28 0.12 2.12 5.03 -1.99 0.31 117.51 124.17 1krw h ILE 108 Ca 0.00 -1.23 0.02 0.00 -0.12 0.00 0.00 64.86 63.53 1krw h ILE 108 Cb 1.04 1.23 -0.05 0.00 -3.03 0.00 0.00 36.82 36.01 1krw h ILE 108 CO 0.00 0.41 -0.48 -0.78 -0.68 0.00 0.00 178.15 176.63 1krw h ASP 109 N 0.61 -1.42 0.96 1.72 1.82 -1.98 1.10 116.42 119.22 1krw h ASP 109 Ca 0.10 0.15 -0.13 0.00 -0.39 0.00 0.00 57.03 56.77 1krw h ASP 109 Cb 0.66 0.53 -0.02 0.00 0.68 0.00 0.00 39.33 41.18 1krw h ASP 109 CO 0.04 -0.53 -0.60 -0.33 -1.61 0.00 0.00 179.24 176.21 1krw h GLU 110 N -0.71 0.00 0.24 0.28 4.39 -1.46 -2.07 114.58 115.25 1krw h GLU 110 Ca 0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1krw h GLU 110 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1krw h GLU 110 CO -0.27 0.60 -0.11 0.00 -1.16 0.00 0.00 179.01 178.07 1krw h ALA 111 N 1.40 -0.39 -0.43 3.43 0.00 -0.05 -2.29 119.26 120.92 1krw h ALA 111 Ca -0.01 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1krw h ALA 111 Cb 1.24 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1krw h ALA 111 CO 0.08 -0.37 0.31 0.28 0.00 0.00 0.00 179.25 179.55 1krw h VAL 112 N -0.83 0.77 0.08 0.00 2.07 0.11 0.13 116.25 118.59 1krw h VAL 112 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1krw h VAL 112 Cb 0.24 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1krw h VAL 112 CO 0.05 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.60 1krw h ALA 113 N 1.78 -0.11 0.00 1.67 0.00 -1.41 -1.49 119.26 119.71 1krw h ALA 113 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1krw h ALA 113 Cb 0.83 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1krw h ALA 113 CO -0.00 -0.47 -0.04 1.25 0.00 0.00 0.00 179.25 179.98 1krw h LEU 114 N -0.28 0.00 0.05 0.00 5.85 -0.48 -2.84 115.31 117.60 1krw h LEU 114 Ca -0.01 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 1krw h LEU 114 Cb 0.24 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.28 1krw h LEU 114 CO 0.02 0.04 -0.33 1.62 -0.34 0.00 0.00 178.44 179.45 1krw h VAL 115 N 0.00 1.66 -0.53 1.05 3.04 -0.56 -2.97 116.25 117.94 1krw h VAL 115 Ca -0.00 -2.36 -0.05 0.00 -1.01 0.00 0.00 66.70 63.29 1krw h VAL 115 Cb 0.65 3.24 -0.02 0.00 -2.01 0.00 0.00 31.29 33.15 1krw h VAL 115 CO 0.01 0.64 0.15 -0.33 -1.01 0.00 0.00 177.57 177.03 1krw h GLU 116 N -0.70 0.84 0.00 4.17 5.08 -1.32 -1.92 114.58 120.73 1krw h GLU 116 Ca -0.06 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1krw h GLU 116 Cb 1.23 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 1krw h GLU 116 CO 0.06 0.78 -0.06 0.00 -1.00 0.00 0.00 179.01 178.79 1krw h ARG 117 N 0.74 0.00 -0.05 2.33 3.08 -1.63 -1.31 114.38 117.54 1krw h ARG 117 Ca 0.17 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1krw h ARG 117 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1krw h ARG 117 CO -0.00 0.06 -0.05 0.00 -1.07 0.00 0.00 179.97 178.91 1krw h ALA 118 N 1.94 0.07 -0.10 0.04 0.00 -1.18 0.45 119.26 120.47 1krw h ALA 118 Ca -0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1krw h ALA 118 Cb 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1krw h ALA 118 CO 0.01 -0.13 -0.37 0.82 0.00 0.00 0.00 179.25 179.58 1krw h ILE 119 N -0.35 1.29 -0.01 0.00 2.04 -1.17 -2.67 117.51 116.64 1krw h ILE 119 Ca 0.01 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.46 1krw h ILE 119 Cb 0.57 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1krw h ILE 119 CO 0.01 0.41 -0.08 0.77 0.00 0.00 0.00 178.15 179.26 1krw h SER 120 N 0.17 0.09 -0.03 1.72 4.64 -1.24 -1.34 113.55 117.56 1krw h SER 120 Ca 0.02 -0.70 0.01 0.00 -0.47 0.00 0.00 61.79 60.65 1krw h SER 120 Cb 0.73 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1krw h SER 120 CO 0.06 0.77 0.03 0.45 -0.87 0.00 0.00 176.83 177.27 1krw h HIS 121 N -0.59 0.00 0.00 4.77 3.86 -0.88 -2.98 115.15 119.33 1krw h HIS 121 Ca -0.01 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1krw h HIS 121 Cb 0.78 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.24 1krw h HIS 121 CO 0.17 0.00 -0.29 1.88 0.86 0.00 0.00 177.93 180.54 1krw h TYR 122 N 0.00 0.00 -3.14 2.45 0.05 -1.49 -3.51 116.97 111.34 1krw h TYR 122 Ca 0.02 0.00 0.37 0.00 0.05 0.00 0.00 58.73 59.16 1krw h TYR 122 Cb 0.07 0.00 -0.09 0.00 1.01 0.00 0.00 36.73 37.72 1krw h TYR 122 CO 0.00 0.68 -0.49 0.94 -1.05 0.00 0.00 178.16 178.24 1krw n GLN 123 N -4.63 -2.73 0.00 4.88 0.00 -0.51 -5.11 117.38 109.28 1krw n GLN 123 Ca -0.11 1.80 0.14 0.00 -0.00 0.00 0.00 57.00 58.83 1krw n GLN 123 Cb 0.35 -3.33 0.54 0.00 0.00 0.00 0.00 30.24 27.80 1krw n GLN 123 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21