#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1haj s VAL 2 N 0.00 1.17 0.09 9.51 1.01 -1.26 -1.65 120.40 129.28 1haj s VAL 2 Ca 0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1haj s VAL 2 Cb 0.00 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1haj s VAL 2 CO 0.00 0.28 0.07 0.00 0.00 0.00 0.00 175.10 175.45 1haj s HIS 4 N -3.95 3.44 0.11 0.00 3.76 -1.26 -2.09 115.29 115.31 1haj s HIS 4 Ca 0.12 1.38 0.01 0.00 -0.15 0.00 0.00 55.06 56.42 1haj s HIS 4 Cb 0.07 -2.65 -0.04 0.00 1.11 0.00 0.00 32.58 31.07 1haj s HIS 4 CO -0.06 0.11 -0.04 -0.08 -0.85 0.00 0.00 174.74 173.83 1haj s THR 5 N -1.90 0.59 -0.06 1.30 -1.32 0.45 -2.46 115.64 112.24 1haj s THR 5 Ca 0.53 -1.93 0.03 0.00 -1.21 0.00 0.00 61.69 59.11 1haj s THR 5 Cb -0.12 -1.80 -0.05 0.00 -1.51 0.00 0.00 72.50 69.03 1haj s THR 5 CO 0.18 -0.76 0.10 0.35 -2.21 0.00 0.00 174.62 172.28 1haj n THR 6 N -0.08 0.00 -0.32 5.08 -2.24 -1.13 -2.69 114.28 112.89 1haj n THR 6 Ca -0.10 -0.21 0.19 0.00 -2.27 0.00 0.00 64.05 61.66 1haj n THR 6 Cb 0.62 0.65 0.40 0.00 -2.10 0.00 0.00 70.33 69.89 1haj n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1haj h ALA 7 N 0.37 1.71 -1.92 6.98 0.00 -1.93 -3.41 119.26 121.06 1haj h ALA 7 Ca 0.00 0.19 -0.41 0.00 0.00 0.00 0.00 54.91 54.69 1haj h ALA 7 Cb 0.12 0.18 0.20 0.00 0.00 0.00 0.00 17.79 18.30 1haj h ALA 7 CO 0.00 -0.49 0.12 0.95 0.00 0.00 0.00 179.25 179.83 1haj s THR 8 N -5.77 1.50 -0.01 0.00 -4.23 -1.26 -5.00 115.64 100.88 1haj s THR 8 Ca -0.11 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.25 1haj s THR 8 Cb 0.28 -2.49 -0.08 0.00 1.34 0.00 0.00 72.50 71.55 1haj s THR 8 CO 0.78 0.00 0.77 -1.28 -0.54 0.00 0.00 174.62 174.35 1haj h SER 9 N -2.74 -0.46 -3.22 3.99 0.87 -1.97 -3.44 113.55 106.58 1haj h SER 9 Ca -0.42 0.02 -0.54 0.00 -1.23 0.00 0.00 61.79 59.61 1haj h SER 9 Cb 1.28 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 63.34 1haj h SER 9 CO 0.28 -0.16 -0.20 -2.16 -0.53 0.00 0.00 176.83 174.06 1haj s PRO 10 N -3.44 3.66 0.57 2.24 0.05 -1.26 -5.05 135.00 131.76 1haj s PRO 10 Ca -0.08 0.01 -0.20 0.00 0.05 0.00 0.00 61.00 60.78 1haj s PRO 10 Cb 0.01 -2.72 -0.04 0.00 0.05 0.00 0.00 34.50 31.79 1haj s PRO 10 CO 0.24 0.33 1.24 0.42 0.05 0.00 0.00 177.00 179.27 1haj s ILE 11 N -1.87 2.55 0.17 0.56 1.01 -1.26 -4.90 121.20 117.46 1haj s ILE 11 Ca 0.43 0.37 -0.18 0.00 0.00 0.00 0.00 60.65 61.27 1haj s ILE 11 Cb -0.11 -3.16 0.06 0.00 0.01 0.00 0.00 42.46 39.26 1haj s ILE 11 CO 0.26 -0.05 0.86 -1.54 0.00 0.00 0.00 174.94 174.47 1haj n SER 12 N -1.34 -1.51 -3.92 3.58 3.41 -1.10 -4.99 113.62 107.75 1haj n SER 12 Ca 0.12 -1.82 -0.10 0.00 -0.26 0.00 0.00 58.87 56.81 1haj n SER 12 Cb 0.48 2.47 -0.10 0.00 -0.26 0.00 0.00 64.21 66.80 1haj n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1haj s ALA 13 N -1.88 -0.11 0.26 7.33 0.00 -1.26 0.17 121.76 126.27 1haj s ALA 13 Ca 0.19 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 1haj s ALA 13 Cb -0.03 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1haj s ALA 13 CO 0.05 -0.19 0.36 1.55 0.00 0.00 0.00 175.76 177.53 1haj n VAL 14 N 1.51 0.00 -2.93 0.00 3.14 -0.89 -4.91 118.33 114.25 1haj n VAL 14 Ca -0.23 -1.38 -0.43 0.00 -2.96 0.00 0.00 64.34 59.33 1haj n VAL 14 Cb 0.55 0.84 -0.04 0.00 -1.06 0.00 0.00 33.84 34.13 1haj n VAL 14 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1haj s THR 15 N -2.75 4.48 0.28 1.55 2.01 -1.26 -2.13 115.64 117.82 1haj s THR 15 Ca 0.23 -0.41 -0.30 0.00 0.31 0.00 0.00 61.69 61.51 1haj s THR 15 Cb -0.01 -4.59 -0.11 0.00 0.01 0.00 0.00 72.50 67.80 1haj s THR 15 CO 0.16 -1.28 1.61 0.00 -0.69 0.00 0.00 174.62 174.42 1haj s PRO 17 N -0.23 -1.85 0.61 0.00 0.04 -1.26 -4.53 135.00 127.77 1haj s PRO 17 Ca 0.65 0.07 0.27 0.00 0.04 0.00 0.00 61.00 62.02 1haj s PRO 17 Cb -0.48 -1.51 1.15 0.00 0.04 0.00 0.00 34.50 33.70 1haj s PRO 17 CO 0.45 -4.15 1.56 -1.35 0.04 0.00 0.00 177.00 173.55 1haj h PRO 18 N -2.90 0.00 0.05 0.56 0.11 -2.01 -0.57 132.00 127.24 1haj h PRO 18 Ca -0.45 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.66 1haj h PRO 18 Cb 1.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1haj h PRO 18 CO 0.33 0.00 -0.08 0.78 -0.21 0.00 0.00 178.00 178.82 1haj h GLY 19 N 0.00 -0.14 -4.83 -0.55 0.00 -2.01 -3.43 103.07 92.11 1haj h GLY 19 Ca 0.34 0.10 -0.69 0.00 0.00 0.00 0.00 47.33 47.07 1haj h GLY 19 CO -0.00 -0.09 -0.79 -0.54 0.00 0.00 0.00 176.54 175.12 1haj s GLU 20 N -6.16 2.41 0.00 4.80 8.01 -0.22 -4.06 118.70 123.47 1haj s GLU 20 Ca -0.14 -0.75 0.00 0.00 0.01 0.00 0.00 54.97 54.09 1haj s GLU 20 Cb 0.07 -2.31 0.00 0.00 -4.31 0.00 0.00 34.13 27.58 1haj s GLU 20 CO 0.66 0.61 0.00 0.09 0.01 0.00 0.00 175.26 176.63 1haj n ASN 21 N 2.27 3.01 -4.80 -0.19 4.13 -1.11 -4.30 115.26 114.26 1haj n ASN 21 Ca -0.17 -0.06 -0.26 0.00 1.68 0.00 0.00 54.58 55.77 1haj n ASN 21 Cb 0.52 0.72 -0.05 0.00 -1.54 0.00 0.00 39.78 39.43 1haj n ASN 21 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1haj s LEU 22 N -2.05 2.86 0.20 3.41 1.43 0.29 -4.80 118.68 120.01 1haj s LEU 22 Ca 0.00 -1.22 0.09 0.00 -1.03 0.00 0.00 54.13 51.98 1haj s LEU 22 Cb 0.00 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 1haj s LEU 22 CO 0.00 -0.77 -0.10 0.00 0.23 0.00 0.00 176.35 175.70 1haj s TYR 24 N -1.83 0.33 -0.25 0.00 -0.85 -0.13 -1.68 117.35 112.94 1haj s TYR 24 Ca 0.26 -0.56 -0.03 0.00 -0.52 0.00 0.00 57.07 56.21 1haj s TYR 24 Cb -0.08 -0.23 0.11 0.00 0.38 0.00 0.00 41.96 42.14 1haj s TYR 24 CO 0.15 -0.19 0.22 1.03 -1.52 0.00 0.00 175.55 175.25 1haj s ARG 25 N -1.65 0.23 0.04 -3.49 1.81 -0.34 -2.55 118.95 113.01 1haj s ARG 25 Ca -0.14 -0.07 -0.09 0.00 -1.72 0.00 0.00 55.73 53.72 1haj s ARG 25 Cb -0.09 -1.04 -0.05 0.00 -0.45 0.00 0.00 34.95 33.32 1haj s ARG 25 CO -0.01 -0.85 0.34 0.21 -0.68 0.00 0.00 175.30 174.31 1haj s LYS 26 N 2.29 3.70 -0.14 3.54 2.20 0.47 -1.80 119.74 129.99 1haj s LYS 26 Ca 0.08 0.09 -0.12 0.00 -0.36 0.00 0.00 55.97 55.66 1haj s LYS 26 Cb -0.15 -3.05 0.04 0.00 -1.51 0.00 0.00 37.83 33.16 1haj s LYS 26 CO -0.24 0.61 0.37 -1.64 -0.36 0.00 0.00 175.35 174.09 1haj s MET 27 N -1.76 0.41 -0.30 4.03 -1.94 0.05 -1.87 119.30 117.93 1haj s MET 27 Ca 0.30 0.57 -0.16 0.00 -1.71 0.00 0.00 55.69 54.69 1haj s MET 27 Cb -0.14 0.15 0.16 0.00 2.01 0.00 0.00 34.83 37.01 1haj s MET 27 CO 0.17 -0.08 1.01 1.67 -0.01 0.00 0.00 175.02 177.78 1haj s TRP 28 N 0.49 -0.57 -0.51 -0.03 1.48 -1.11 -3.38 118.94 115.30 1haj s TRP 28 Ca -0.02 1.05 -0.41 0.00 -1.06 0.00 0.00 56.10 55.66 1haj s TRP 28 Cb -0.04 0.34 -0.18 0.00 -1.16 0.00 0.00 33.47 32.43 1haj s TRP 28 CO -0.03 -0.28 2.21 0.00 -4.06 0.00 0.00 176.95 174.79 1haj s ASP 30 N 6.64 6.69 0.00 0.00 1.47 0.57 -4.57 116.67 127.47 1haj s ASP 30 Ca 1.19 2.48 0.00 0.00 1.18 0.00 0.00 52.55 57.40 1haj s ASP 30 Cb -1.32 -2.63 0.00 0.00 -0.34 0.00 0.00 42.92 38.63 1haj s ASP 30 CO 0.60 -0.57 0.00 0.00 0.68 0.00 0.00 175.17 175.88 1haj n ALA 31 N 0.48 0.00 -1.56 2.11 0.00 -1.26 -1.30 120.51 118.98 1haj n ALA 31 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 1haj n ALA 31 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.88 1haj n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1haj n PHE 32 N 1.59 0.00 -0.51 0.00 3.72 -1.26 -4.93 117.46 116.07 1haj n PHE 32 Ca 0.00 -0.11 0.41 0.00 -0.05 0.00 0.00 57.45 57.70 1haj n PHE 32 Cb 0.00 0.28 0.63 0.00 -0.94 0.00 0.00 39.48 39.45 1haj n PHE 32 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1haj h SER 34 N 0.00 0.02 0.00 0.00 0.02 -1.94 -3.39 113.55 108.26 1haj h SER 34 Ca 0.72 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1haj h SER 34 Cb 3.15 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 65.68 1haj h SER 34 CO -0.01 0.94 0.00 -0.24 -1.14 0.00 0.00 176.83 176.38 1haj n SER 35 N -4.62 0.00 0.00 3.07 2.88 0.41 -4.89 113.62 110.47 1haj n SER 35 Ca -0.10 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1haj n SER 35 Cb 0.46 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 1haj n SER 35 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1haj n ARG 36 N -1.91 0.00 0.00 -1.46 5.12 0.97 -5.04 116.66 114.35 1haj n ARG 36 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1haj n ARG 36 Cb 0.00 -0.69 0.00 0.00 -1.16 0.00 0.00 32.46 30.61 1haj n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1haj n GLY 37 N 0.96 -1.19 3.32 -0.13 0.00 -0.33 -4.78 105.19 103.03 1haj n GLY 37 Ca 0.00 -2.11 -0.48 0.00 0.00 0.00 0.00 46.02 43.43 1haj n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1haj n LYS 38 N 0.00 0.00 -1.67 1.61 5.02 -1.26 0.21 118.16 122.07 1haj n LYS 38 Ca 0.00 0.00 -0.47 0.00 -2.02 0.00 0.00 58.31 55.82 1haj n LYS 38 Cb 0.00 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.50 1haj n LYS 38 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1haj n VAL 39 N 6.92 0.28 -3.57 -0.18 0.31 0.50 -4.51 118.33 118.07 1haj n VAL 39 Ca 0.60 -0.05 -0.40 0.00 -0.01 0.00 0.00 64.34 64.47 1haj n VAL 39 Cb -0.00 -1.72 -0.11 0.00 -0.91 0.00 0.00 33.84 31.10 1haj n VAL 39 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1haj s VAL 40 N 2.42 4.88 0.05 2.52 1.01 -1.26 -2.77 120.40 127.26 1haj s VAL 40 Ca 0.85 -0.54 0.09 0.00 0.00 0.00 0.00 61.98 62.38 1haj s VAL 40 Cb -0.67 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1haj s VAL 40 CO 0.44 -0.11 -0.25 -0.70 0.00 0.00 0.00 175.10 174.48 1haj s GLU 41 N 1.64 1.69 0.04 2.72 -6.30 -0.78 -5.01 118.70 112.69 1haj s GLU 41 Ca 0.04 -1.09 -0.28 0.00 -2.50 0.00 0.00 54.97 51.14 1haj s GLU 41 Cb -0.18 -1.88 0.09 0.00 0.00 0.00 0.00 34.13 32.16 1haj s GLU 41 CO 0.08 0.48 0.92 -0.48 0.02 0.00 0.00 175.26 176.28 1haj s LEU 42 N -1.28 -0.30 0.00 2.70 2.34 -1.26 -0.40 118.68 120.48 1haj s LEU 42 Ca 0.11 -0.13 0.00 0.00 0.06 0.00 0.00 54.13 54.17 1haj s LEU 42 Cb -0.10 2.05 0.00 0.00 -0.56 0.00 0.00 46.19 47.58 1haj s LEU 42 CO 0.02 -0.70 0.00 0.61 -1.06 0.00 0.00 176.35 175.22 1haj n GLY 43 N -0.32 -1.29 3.89 -3.48 0.00 -1.03 -2.85 105.19 100.11 1haj n GLY 43 Ca -0.08 -1.17 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1haj n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haj s ALA 45 N -3.44 -1.97 0.11 0.00 0.00 0.19 -4.69 121.76 111.96 1haj s ALA 45 Ca 0.60 2.03 0.03 0.00 0.00 0.00 0.00 51.96 54.62 1haj s ALA 45 Cb -0.11 -1.42 -0.23 0.00 0.00 0.00 0.00 23.12 21.36 1haj s ALA 45 CO 0.51 -0.30 1.24 0.00 0.00 0.00 0.00 175.76 177.21 1haj h ALA 46 N 5.02 0.27 -2.95 0.00 0.00 -1.81 0.83 119.26 120.62 1haj h ALA 46 Ca -0.29 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 53.73 1haj h ALA 46 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1haj h ALA 46 CO 0.11 1.14 0.00 -2.37 0.00 0.00 0.00 179.25 178.13 1haj n THR 47 N -3.43 0.00 -3.23 0.00 5.66 -1.26 -4.62 114.28 107.40 1haj n THR 47 Ca -0.03 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.55 1haj n THR 47 Cb 0.96 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.67 1haj n THR 47 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1haj n PRO 49 N 5.76 -3.26 -0.52 0.00 -0.04 -1.26 -5.00 135.00 130.69 1haj n PRO 49 Ca -0.05 -1.35 -0.29 0.00 -0.04 0.00 0.00 63.50 61.77 1haj n PRO 49 Cb 0.49 -1.40 0.24 0.00 -0.04 0.00 0.00 33.50 32.79 1haj n PRO 49 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1haj n SER 50 N -4.77 -1.90 -3.40 3.54 3.41 -1.26 -5.03 113.62 104.21 1haj n SER 50 Ca 0.12 -0.16 -0.23 0.00 -0.26 0.00 0.00 58.87 58.35 1haj n SER 50 Cb 0.48 -1.19 -0.10 0.00 -0.26 0.00 0.00 64.21 63.14 1haj n SER 50 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1haj s LYS 51 N -4.18 0.61 0.57 4.33 3.01 -1.26 -4.69 119.74 118.12 1haj s LYS 51 Ca 0.66 -1.12 -0.16 0.00 -1.01 0.00 0.00 55.97 54.34 1haj s LYS 51 Cb -0.23 -1.00 -0.05 0.00 -1.01 0.00 0.00 37.83 35.54 1haj s LYS 51 CO 0.65 -1.21 1.05 0.21 0.51 0.00 0.00 175.35 176.56 1haj s LYS 52 N 1.22 3.46 0.13 1.68 2.47 0.33 -4.96 119.74 124.07 1haj s LYS 52 Ca 0.18 1.19 -0.33 0.00 -1.56 0.00 0.00 55.97 55.45 1haj s LYS 52 Cb -0.19 -2.05 -0.11 0.00 -1.46 0.00 0.00 37.83 34.02 1haj s LYS 52 CO -0.01 -0.69 1.55 -1.35 0.16 0.00 0.00 175.35 175.01 1haj h PRO 53 N 0.64 -0.43 0.06 4.03 0.11 -2.02 -3.08 132.00 131.31 1haj h PRO 53 Ca -0.47 0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1haj h PRO 53 Cb 1.22 0.10 0.01 0.00 0.11 0.00 0.00 31.00 32.43 1haj h PRO 53 CO 0.58 -0.28 -0.36 1.88 -0.21 0.00 0.00 178.00 179.60 1haj h TYR 54 N -0.44 0.25 -2.99 0.65 0.05 -1.98 -3.42 116.97 109.09 1haj h TYR 54 Ca 0.07 -0.18 -0.58 0.00 0.05 0.00 0.00 58.73 58.09 1haj h TYR 54 Cb 0.62 -0.01 -0.10 0.00 1.01 0.00 0.00 36.73 38.25 1haj h TYR 54 CO -0.69 1.12 0.79 -2.00 -1.05 0.00 0.00 178.16 176.34 1haj s GLU 55 N -2.40 3.35 0.18 4.88 2.12 -1.16 -4.67 118.70 120.99 1haj s GLU 55 Ca -0.16 -0.14 0.11 0.00 0.36 0.00 0.00 54.97 55.13 1haj s GLU 55 Cb -0.01 -4.08 -0.04 0.00 0.26 0.00 0.00 34.13 30.26 1haj s GLU 55 CO 0.75 -1.71 -0.24 -1.21 -0.54 0.00 0.00 175.26 172.32 1haj s GLU 56 N 4.62 1.51 0.05 4.30 2.02 -1.22 -0.51 118.70 129.48 1haj s GLU 56 Ca 0.35 -1.49 -0.08 0.00 0.02 0.00 0.00 54.97 53.76 1haj s GLU 56 Cb -0.10 -1.86 -0.00 0.00 0.10 0.00 0.00 34.13 32.26 1haj s GLU 56 CO 0.20 0.41 0.18 0.54 0.02 0.00 0.00 175.26 176.60 1haj s VAL 57 N -1.57 0.13 -0.03 2.63 0.11 -1.26 -0.77 120.40 119.63 1haj s VAL 57 Ca 0.20 -1.03 0.06 0.00 -2.93 0.00 0.00 61.98 58.28 1haj s VAL 57 Cb -0.08 -1.06 -0.01 0.00 -1.53 0.00 0.00 36.38 33.70 1haj s VAL 57 CO 0.09 -0.57 -0.23 0.28 -3.33 0.00 0.00 175.10 171.35 1haj s THR 58 N -3.00 1.83 -0.19 5.04 -1.32 -0.75 -4.94 115.64 112.32 1haj s THR 58 Ca -0.02 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 59.49 1haj s THR 58 Cb 0.01 -1.54 0.02 0.00 -1.51 0.00 0.00 72.50 69.48 1haj s THR 58 CO -0.06 0.52 -0.17 0.00 -2.21 0.00 0.00 174.62 172.70 1haj n SER 61 N -1.32 1.15 -3.36 0.00 3.41 -1.26 -2.08 113.62 110.16 1haj n SER 61 Ca -0.16 -2.59 -0.35 0.00 -0.26 0.00 0.00 58.87 55.52 1haj n SER 61 Cb 0.67 -0.36 -0.01 0.00 -0.26 0.00 0.00 64.21 64.25 1haj n SER 61 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1haj n THR 62 N -0.14 4.66 -3.26 6.66 -1.04 -1.26 -5.04 114.28 114.86 1haj n THR 62 Ca 0.09 -5.79 0.00 0.00 -2.04 0.00 0.00 64.05 56.32 1haj n THR 62 Cb 0.93 -1.54 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 1haj n THR 62 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1haj n ASP 63 N -0.02 -1.58 -3.29 8.00 2.03 -1.26 -3.02 116.55 117.40 1haj n ASP 63 Ca 0.38 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.44 1haj n ASP 63 Cb 0.32 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.66 1haj n ASP 63 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1haj n LYS 64 N 0.00 0.25 -0.09 -0.67 2.85 0.32 -4.35 118.16 116.46 1haj n LYS 64 Ca 0.00 -0.90 0.11 0.00 -1.05 0.00 0.00 58.31 56.47 1haj n LYS 64 Cb 0.00 -2.33 0.36 0.00 -0.65 0.00 0.00 35.03 32.41 1haj n LYS 64 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1haj n ASN 66 N 0.42 6.00 -4.73 0.00 6.94 -1.26 -5.04 115.26 117.59 1haj n ASN 66 Ca 0.16 -3.72 -0.40 0.00 -0.02 0.00 0.00 54.58 50.61 1haj n ASN 66 Cb 0.35 -0.84 -0.05 0.00 -2.36 0.00 0.00 39.78 36.88 1haj n ASN 66 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1haj s PRO 67 N -3.89 4.49 0.15 -0.53 0.04 -1.26 -4.59 135.00 129.42 1haj s PRO 67 Ca 0.46 1.07 -0.31 0.00 0.04 0.00 0.00 61.00 62.26 1haj s PRO 67 Cb 0.29 -3.40 -0.18 0.00 0.04 0.00 0.00 34.50 31.25 1haj s PRO 67 CO -0.18 0.19 0.65 1.58 0.04 0.00 0.00 177.00 179.28 1haj n HIS 68 N 3.18 -0.20 0.02 0.56 -0.00 -1.26 -4.75 115.22 112.77 1haj n HIS 68 Ca -0.01 0.98 0.01 0.00 0.46 0.00 0.00 57.72 59.16 1haj n HIS 68 Cb 0.51 -1.97 0.06 0.00 -0.12 0.00 0.00 29.99 28.46 1haj n HIS 68 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1haj n PRO 69 N 1.12 0.02 0.00 1.57 -0.02 -1.26 -1.29 135.00 135.13 1haj n PRO 69 Ca 0.18 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1haj n PRO 69 Cb 0.20 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1haj n PRO 69 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1haj n LYS 70 N -1.56 0.93 -0.50 -0.52 0.00 -1.26 -5.09 118.16 110.16 1haj n LYS 70 Ca -0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 58.31 57.21 1haj n LYS 70 Cb 0.03 -0.76 0.28 0.00 0.00 0.00 0.00 35.03 34.58 1haj n LYS 70 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1haj s GLN 71 N -0.36 -2.56 -0.47 1.64 -0.21 -0.41 -4.93 119.66 112.35 1haj s GLN 71 Ca 0.00 0.14 -0.24 0.00 0.02 0.00 0.00 55.36 55.28 1haj s GLN 71 Cb 0.00 -1.42 0.03 0.00 1.00 0.00 0.00 33.01 32.62 1haj s GLN 71 CO 0.00 -4.63 0.88 0.50 -2.12 0.00 0.00 175.29 169.92 1haj s ARG 72 N -5.09 3.46 0.60 2.91 3.52 -1.26 -5.00 118.95 118.08 1haj s ARG 72 Ca 0.69 0.01 -0.17 0.00 -0.13 0.00 0.00 55.73 56.13 1haj s ARG 72 Cb -0.13 -3.95 -0.03 0.00 -1.56 0.00 0.00 34.95 29.28 1haj s ARG 72 CO 0.58 -1.23 1.11 -1.25 -0.81 0.00 0.00 175.30 173.70 1haj s PRO 73 N 3.63 3.12 0.00 5.12 0.04 -1.26 -5.12 135.00 140.53 1haj s PRO 73 Ca 0.34 1.46 0.21 0.00 0.04 0.00 0.00 61.00 63.04 1haj s PRO 73 Cb -0.11 -1.99 0.16 0.00 0.04 0.00 0.00 34.50 32.60 1haj s PRO 73 CO 0.24 -1.01 1.15 0.41 0.04 0.00 0.00 177.00 177.84