#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 2.01 0.28 9.51 1.01 -1.26 -1.69 120.40 130.27 1haj s VAL 2 Ca 0.00 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.01 1haj s VAL 2 Cb 0.00 -1.71 -0.06 0.00 0.00 0.00 0.00 36.38 34.61 1haj s VAL 2 CO 0.00 0.56 -0.04 0.00 0.00 0.00 0.00 175.10 175.62 1haj s HIS 4 N -3.09 3.64 0.17 0.00 3.76 -1.26 -1.92 115.29 116.57 1haj s HIS 4 Ca 0.30 0.85 0.10 0.00 -0.15 0.00 0.00 55.06 56.16 1haj s HIS 4 Cb 0.05 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 1haj s HIS 4 CO 0.12 0.52 -0.22 -0.08 -0.85 0.00 0.00 174.74 174.23 1haj s THR 5 N -0.56 2.05 0.00 1.30 -1.32 0.29 -2.74 115.64 114.66 1haj s THR 5 Ca 0.22 -1.90 0.00 0.00 -1.21 0.00 0.00 61.69 58.80 1haj s THR 5 Cb -0.15 -1.93 0.00 0.00 -1.51 0.00 0.00 72.50 68.91 1haj s THR 5 CO 0.10 -0.17 0.42 0.35 -2.21 0.00 0.00 174.62 173.12 1haj n THR 6 N 0.44 0.18 0.30 5.08 -2.24 -1.19 -2.21 114.28 114.62 1haj n THR 6 Ca -0.14 -0.33 0.18 0.00 -2.27 0.00 0.00 64.05 61.48 1haj n THR 6 Cb 0.56 1.24 0.93 0.00 -2.10 0.00 0.00 70.33 70.95 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 0.00 1.11 -3.63 6.98 0.00 -1.91 -3.44 119.26 118.38 1haj h ALA 7 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1haj h ALA 7 Cb 0.43 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1haj h ALA 7 CO 0.00 0.04 0.03 0.25 0.00 0.00 0.00 179.25 179.57 1haj n THR 8 N -3.29 0.00 0.16 0.00 -2.24 -1.26 -5.04 114.28 102.61 1haj n THR 8 Ca -0.02 -0.17 -0.07 0.00 -2.27 0.00 0.00 64.05 61.52 1haj n THR 8 Cb 0.18 -1.51 -0.03 0.00 -2.10 0.00 0.00 70.33 66.87 1haj n THR 8 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1haj h SER 9 N -0.11 -0.38 -3.35 3.42 0.87 -1.98 -3.44 113.55 108.57 1haj h SER 9 Ca -0.04 0.01 -0.54 0.00 -1.23 0.00 0.00 61.79 59.99 1haj h SER 9 Cb 0.15 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1haj h SER 9 CO 0.04 -0.13 -0.14 -2.16 -0.53 0.00 0.00 176.83 173.91 1haj s PRO 10 N -3.20 3.74 -0.05 2.24 0.05 -1.26 -5.05 135.00 131.46 1haj s PRO 10 Ca -0.07 0.17 -0.28 0.00 0.05 0.00 0.00 61.00 60.87 1haj s PRO 10 Cb 0.01 -2.66 -0.03 0.00 0.05 0.00 0.00 34.50 31.87 1haj s PRO 10 CO 0.20 0.30 0.93 0.96 0.05 0.00 0.00 177.00 179.43 1haj s ILE 11 N -1.88 4.88 0.22 0.56 -4.36 -1.26 -4.85 121.20 114.51 1haj s ILE 11 Ca 0.46 1.92 0.05 0.00 -0.26 0.00 0.00 60.65 62.81 1haj s ILE 11 Cb -0.11 -4.26 -0.02 0.00 1.25 0.00 0.00 42.46 39.32 1haj s ILE 11 CO 0.24 0.13 0.18 -1.54 0.24 0.00 0.00 174.94 174.18 1haj n SER 12 N 4.27 -0.31 -3.81 4.36 3.41 -0.94 -4.97 113.62 115.64 1haj n SER 12 Ca 0.05 -2.43 -0.12 0.00 -0.26 0.00 0.00 58.87 56.11 1haj n SER 12 Cb 0.50 1.05 -0.12 0.00 -0.26 0.00 0.00 64.21 65.39 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 -2.87 -0.48 0.32 7.33 0.00 -1.26 0.10 121.76 124.91 1haj s ALA 13 Ca 0.25 0.51 0.06 0.00 0.00 0.00 0.00 51.96 52.79 1haj s ALA 13 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1haj s ALA 13 CO 0.18 -0.10 0.23 1.55 0.00 0.00 0.00 175.76 177.62 1haj n VAL 14 N 2.86 0.00 -3.17 0.00 3.14 -0.81 -4.90 118.33 115.46 1haj n VAL 14 Ca -0.13 -2.23 -0.44 0.00 -2.96 0.00 0.00 64.34 58.58 1haj n VAL 14 Cb 0.58 1.05 -0.06 0.00 -1.06 0.00 0.00 33.84 34.35 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 -3.18 4.89 0.27 1.55 2.01 -1.26 -1.40 115.64 118.52 1haj s THR 15 Ca 0.33 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 1haj s THR 15 Cb 0.02 -4.33 -0.10 0.00 0.01 0.00 0.00 72.50 68.09 1haj s THR 15 CO 0.23 -0.87 1.38 0.00 -0.69 0.00 0.00 174.62 174.67 1haj s PRO 17 N -0.76 -2.12 0.60 0.00 0.04 -1.26 -4.30 135.00 127.19 1haj s PRO 17 Ca 0.56 0.29 0.29 0.00 0.04 0.00 0.00 61.00 62.18 1haj s PRO 17 Cb -0.40 -1.46 1.17 0.00 0.04 0.00 0.00 34.50 33.85 1haj s PRO 17 CO 0.45 -4.38 1.52 -1.00 0.04 0.00 0.00 177.00 173.63 1haj h PRO 18 N -3.07 0.00 -0.06 0.56 0.13 -2.00 -0.89 132.00 126.66 1haj h PRO 18 Ca -0.49 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.68 1haj h PRO 18 Cb 1.33 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.42 1haj h PRO 18 CO 0.36 0.00 -0.23 0.78 -0.23 0.00 0.00 178.00 178.68 1haj h GLY 19 N 0.00 -0.28 -4.78 1.56 0.00 -2.01 -3.42 103.07 94.14 1haj h GLY 19 Ca 0.44 0.28 -0.65 0.00 0.00 0.00 0.00 47.33 47.40 1haj h GLY 19 CO -0.00 -0.20 -0.87 -0.54 0.00 0.00 0.00 176.54 174.93 1haj s GLU 20 N -6.08 1.97 0.00 4.80 8.01 -0.34 -4.39 118.70 122.66 1haj s GLU 20 Ca -0.15 -0.83 0.00 0.00 0.01 0.00 0.00 54.97 54.00 1haj s GLU 20 Cb 0.10 -1.85 0.00 0.00 -4.31 0.00 0.00 34.13 28.07 1haj s GLU 20 CO 0.67 0.47 0.00 0.09 0.01 0.00 0.00 175.26 176.50 1haj n ASN 21 N 2.60 3.24 -4.96 -0.19 4.13 -1.10 -4.29 115.26 114.69 1haj n ASN 21 Ca -0.16 -0.07 -0.20 0.00 1.68 0.00 0.00 54.58 55.83 1haj n ASN 21 Cb 0.52 0.79 0.01 0.00 -1.54 0.00 0.00 39.78 39.56 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 -2.22 3.27 0.14 3.41 1.43 0.27 -4.49 118.68 120.49 1haj s LEU 22 Ca 0.00 -0.77 0.07 0.00 -1.03 0.00 0.00 54.13 52.41 1haj s LEU 22 Cb 0.00 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 1haj s LEU 22 CO 0.00 -0.95 -0.16 0.00 0.23 0.00 0.00 176.35 175.47 1haj s TYR 24 N -2.12 1.15 -0.31 0.00 -0.85 0.16 -0.71 117.35 114.67 1haj s TYR 24 Ca 0.12 -0.32 0.01 0.00 -0.52 0.00 0.00 57.07 56.36 1haj s TYR 24 Cb -0.05 -0.69 0.09 0.00 0.38 0.00 0.00 41.96 41.69 1haj s TYR 24 CO 0.05 0.02 0.06 1.03 -1.52 0.00 0.00 175.55 175.18 1haj s ARG 25 N -0.95 1.14 0.17 -3.49 0.52 0.61 -2.59 118.95 114.35 1haj s ARG 25 Ca 0.02 -1.38 -0.15 0.00 -0.52 0.00 0.00 55.73 53.70 1haj s ARG 25 Cb -0.07 -2.56 -0.07 0.00 0.52 0.00 0.00 34.95 32.77 1haj s ARG 25 CO 0.01 -0.91 0.58 0.21 0.02 0.00 0.00 175.30 175.20 1haj s LYS 26 N 1.30 4.00 -0.11 3.54 2.20 -0.97 -0.98 119.74 128.73 1haj s LYS 26 Ca 0.08 0.53 -0.09 0.00 -0.36 0.00 0.00 55.97 56.13 1haj s LYS 26 Cb -0.18 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.29 1haj s LYS 26 CO -0.16 0.44 0.28 -1.64 -0.36 0.00 0.00 175.35 173.92 1haj s MET 27 N -2.07 0.32 -0.30 4.03 -1.94 -0.73 -1.39 119.30 117.22 1haj s MET 27 Ca 0.40 0.42 -0.15 0.00 -1.71 0.00 0.00 55.69 54.64 1haj s MET 27 Cb -0.15 0.12 0.17 0.00 2.01 0.00 0.00 34.83 36.98 1haj s MET 27 CO 0.19 -0.06 1.01 1.67 -0.01 0.00 0.00 175.02 177.82 1haj s TRP 28 N 0.31 -0.64 -0.03 -0.03 1.48 -1.10 -3.28 118.94 115.65 1haj s TRP 28 Ca -0.01 1.11 -0.34 0.00 -1.06 0.00 0.00 56.10 55.80 1haj s TRP 28 Cb -0.03 0.38 -0.12 0.00 -1.16 0.00 0.00 33.47 32.55 1haj s TRP 28 CO -0.01 -0.32 1.84 0.00 -4.06 0.00 0.00 176.95 174.40 1haj s ASP 30 N 3.51 6.77 0.00 0.00 1.47 0.32 -4.71 116.67 124.03 1haj s ASP 30 Ca 0.90 1.21 0.00 0.00 1.18 0.00 0.00 52.55 55.83 1haj s ASP 30 Cb -0.66 -2.34 0.00 0.00 -0.34 0.00 0.00 42.92 39.58 1haj s ASP 30 CO 0.48 -0.14 0.00 0.00 0.68 0.00 0.00 175.17 176.19 1haj n ALA 31 N -0.17 0.00 -1.40 2.11 0.00 -1.26 -1.83 120.51 117.96 1haj n ALA 31 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.46 1haj n ALA 31 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 1.90 0.00 -0.50 0.00 3.72 -1.26 -4.86 117.46 116.45 1haj n PHE 32 Ca 0.00 -0.01 0.38 0.00 -0.05 0.00 0.00 57.45 57.78 1haj n PHE 32 Cb 0.00 0.19 0.60 0.00 -0.94 0.00 0.00 39.48 39.33 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 -0.28 0.00 0.00 0.87 -1.94 -3.40 113.55 108.80 1haj h SER 34 Ca 0.70 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 61.11 1haj h SER 34 Cb 2.71 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 64.74 1haj h SER 34 CO -0.06 0.23 0.00 -0.24 -0.53 0.00 0.00 176.83 176.22 1haj n SER 35 N -4.99 0.00 0.00 6.23 2.88 0.31 -4.87 113.62 113.18 1haj n SER 35 Ca -0.06 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 1haj n SER 35 Cb 0.21 -0.04 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 -1.11 0.00 0.00 -1.46 5.12 0.35 -4.95 116.66 114.61 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 -0.65 0.00 0.00 -1.16 0.00 0.00 32.46 30.65 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 1.04 0.36 3.37 -0.13 0.00 0.77 -4.64 105.19 105.96 1haj n GLY 37 Ca 0.00 -0.93 -0.52 0.00 0.00 0.00 0.00 46.02 44.57 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 11.35 0.16 -2.18 1.61 5.02 -1.25 0.12 118.16 132.98 1haj n LYS 38 Ca 0.00 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.91 1haj n LYS 38 Cb 0.00 -1.68 -0.03 0.00 -0.02 0.00 0.00 35.03 33.30 1haj n LYS 38 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1haj s VAL 39 N 7.39 3.00 -0.22 -0.18 1.01 0.29 -4.60 120.40 127.10 1haj s VAL 39 Ca 1.23 0.90 -0.09 0.00 0.00 0.00 0.00 61.98 64.02 1haj s VAL 39 Cb -1.30 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 31.47 1haj s VAL 39 CO 0.57 0.17 0.11 -0.69 0.00 0.00 0.00 175.10 175.26 1haj s VAL 40 N -0.43 5.04 0.04 2.92 1.01 -1.26 -2.72 120.40 125.01 1haj s VAL 40 Ca 0.53 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.67 1haj s VAL 40 Cb -0.38 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1haj s VAL 40 CO 0.44 0.39 -0.26 -0.70 0.00 0.00 0.00 175.10 174.97 1haj s GLU 41 N 0.86 1.78 -0.07 2.72 2.56 -0.49 -4.97 118.70 121.09 1haj s GLU 41 Ca 0.06 -1.10 0.02 0.00 0.00 0.00 0.00 54.97 53.95 1haj s GLU 41 Cb -0.13 -1.95 0.01 0.00 2.00 0.00 0.00 34.13 34.06 1haj s GLU 41 CO 0.03 0.50 -0.12 -0.51 -0.56 0.00 0.00 175.26 174.60 1haj s LEU 42 N -1.23 1.63 0.03 2.70 1.02 -1.26 -2.28 118.68 119.28 1haj s LEU 42 Ca 0.11 -0.30 -0.28 0.00 0.02 0.00 0.00 54.13 53.68 1haj s LEU 42 Cb -0.10 -0.84 0.10 0.00 0.02 0.00 0.00 46.19 45.37 1haj s LEU 42 CO 0.02 0.03 0.95 -0.83 0.02 0.00 0.00 176.35 176.54 1haj s GLY 43 N 0.71 -0.38 0.04 -3.19 0.00 -1.07 -3.19 107.32 100.24 1haj s GLY 43 Ca -0.14 0.79 -0.04 0.00 0.00 0.00 0.00 44.72 45.33 1haj s GLY 43 CO 0.03 0.24 0.25 0.00 0.00 0.00 0.00 173.10 173.63 1haj s ALA 45 N -1.42 -0.52 -0.79 0.00 0.00 0.49 -4.84 121.76 114.68 1haj s ALA 45 Ca 0.32 -0.31 0.16 0.00 0.00 0.00 0.00 51.96 52.12 1haj s ALA 45 Cb -0.13 0.49 0.55 0.00 0.00 0.00 0.00 23.12 24.04 1haj s ALA 45 CO 0.21 -0.52 1.47 0.00 0.00 0.00 0.00 175.76 176.92 1haj n ALA 46 N 0.07 2.81 -3.00 0.00 0.00 -1.26 0.95 120.51 120.08 1haj n ALA 46 Ca -0.16 -1.68 0.00 0.00 0.00 0.00 0.00 53.44 51.60 1haj n ALA 46 Cb 0.62 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 19.31 1haj n ALA 46 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1haj n THR 47 N 0.48 0.00 -4.82 0.00 5.66 -1.26 -4.86 114.28 109.48 1haj n THR 47 Ca 0.20 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.88 1haj n THR 47 Cb 0.76 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.39 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 3.62 0.02 -4.09 0.00 -0.02 -1.26 -5.09 135.00 128.18 1haj n PRO 49 Ca -0.18 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.04 1haj n PRO 49 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.96 1haj n PRO 49 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1haj s SER 50 N -1.47 4.50 -0.44 2.55 0.01 -1.26 -5.06 113.70 112.52 1haj s SER 50 Ca 0.00 -1.18 -0.27 0.00 1.31 0.00 0.00 55.95 55.81 1haj s SER 50 Cb 0.00 -0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.18 1haj s SER 50 CO 0.00 -0.77 1.02 -0.75 0.41 0.00 0.00 173.24 173.15 1haj s LYS 51 N -4.04 3.70 -0.02 12.44 2.36 -1.26 -4.71 119.74 128.22 1haj s LYS 51 Ca 0.35 0.45 0.01 0.00 -2.55 0.00 0.00 55.97 54.23 1haj s LYS 51 Cb 0.01 -3.89 -0.04 0.00 -1.05 0.00 0.00 37.83 32.87 1haj s LYS 51 CO 0.20 -1.22 0.02 0.15 1.55 0.00 0.00 175.35 176.04 1haj s LYS 52 N 3.99 2.88 -0.13 4.03 1.02 -1.11 -5.05 119.74 125.36 1haj s LYS 52 Ca 0.42 -0.55 -0.35 0.00 0.02 0.00 0.00 55.97 55.51 1haj s LYS 52 Cb -0.09 -2.73 -0.12 0.00 -0.52 0.00 0.00 37.83 34.37 1haj s LYS 52 CO 0.27 0.64 1.88 -2.30 -0.92 0.00 0.00 175.35 174.92 1haj n PRO 53 N 1.47 2.01 -2.25 -1.68 -0.02 -1.26 -1.06 135.00 132.21 1haj n PRO 53 Ca -0.15 0.73 -0.15 0.00 -2.02 0.00 0.00 63.50 61.91 1haj n PRO 53 Cb 0.53 -2.58 -0.02 0.00 -0.02 0.00 0.00 33.50 31.41 1haj n PRO 53 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1haj n TYR 54 N 6.66 -1.11 -3.22 6.00 4.02 -1.26 -4.89 117.16 123.36 1haj n TYR 54 Ca 0.24 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 58.07 1haj n TYR 54 Cb 0.27 -3.06 -0.03 0.00 -0.02 0.00 0.00 39.34 36.50 1haj n TYR 54 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1haj s GLU 55 N -4.72 0.79 0.26 -0.72 2.12 -0.22 -4.64 118.70 111.57 1haj s GLU 55 Ca 0.00 -0.60 0.09 0.00 0.36 0.00 0.00 54.97 54.81 1haj s GLU 55 Cb 0.00 -0.23 -0.04 0.00 0.26 0.00 0.00 34.13 34.11 1haj s GLU 55 CO 0.00 -1.21 0.06 -1.21 -0.54 0.00 0.00 175.26 172.35 1haj s GLU 56 N 1.55 2.49 -0.04 4.30 0.41 -1.21 -2.76 118.70 123.44 1haj s GLU 56 Ca 0.18 -1.29 -0.02 0.00 -0.41 0.00 0.00 54.97 53.44 1haj s GLU 56 Cb -0.07 -2.29 0.03 0.00 -1.78 0.00 0.00 34.13 30.02 1haj s GLU 56 CO -0.06 0.38 0.07 0.14 -0.49 0.00 0.00 175.26 175.31 1haj s VAL 57 N -2.23 -0.10 -0.26 2.63 -7.23 -1.26 -1.77 120.40 110.18 1haj s VAL 57 Ca 0.32 0.31 -0.17 0.00 -1.81 0.00 0.00 61.98 60.63 1haj s VAL 57 Cb -0.07 -0.16 -0.03 0.00 0.56 0.00 0.00 36.38 36.68 1haj s VAL 57 CO 0.21 0.13 0.46 0.42 -0.31 0.00 0.00 175.10 176.01 1haj s THR 58 N 1.65 5.12 -0.11 5.32 -4.23 -0.15 -4.79 115.64 118.45 1haj s THR 58 Ca -0.02 0.76 -0.05 0.00 -1.18 0.00 0.00 61.69 61.20 1haj s THR 58 Cb -0.12 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 69.90 1haj s THR 58 CO -0.04 0.13 0.08 0.00 -0.54 0.00 0.00 174.62 174.25 1haj n SER 61 N 0.84 6.41 -3.99 0.00 3.41 -1.26 -1.22 113.62 117.80 1haj n SER 61 Ca -0.18 -3.77 -0.19 0.00 -0.26 0.00 0.00 58.87 54.47 1haj n SER 61 Cb 0.56 -0.69 -0.09 0.00 -0.26 0.00 0.00 64.21 63.73 1haj n SER 61 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1haj s THR 62 N -4.76 0.36 0.45 6.66 2.01 -1.26 -5.01 115.64 114.09 1haj s THR 62 Ca 0.58 -2.00 -0.13 0.00 0.31 0.00 0.00 61.69 60.45 1haj s THR 62 Cb 0.46 -2.51 -0.07 0.00 0.01 0.00 0.00 72.50 70.39 1haj s THR 62 CO -0.01 0.00 0.86 -0.62 -0.69 0.00 0.00 174.62 174.17 1haj s ASP 63 N -3.39 6.57 -1.22 3.53 -1.08 -1.26 -3.99 116.67 115.82 1haj s ASP 63 Ca 0.35 1.33 -0.15 0.00 -0.52 0.00 0.00 52.55 53.56 1haj s ASP 63 Cb 0.05 -2.41 0.15 0.00 -1.46 0.00 0.00 42.92 39.26 1haj s ASP 63 CO 0.18 -0.48 0.38 2.29 0.52 0.00 0.00 175.17 178.06 1haj n LYS 64 N -1.41 -0.81 0.03 4.34 0.00 -0.64 -4.73 118.16 114.93 1haj n LYS 64 Ca 0.04 0.09 0.12 0.00 -0.00 0.00 0.00 58.31 58.56 1haj n LYS 64 Cb 0.54 -3.05 0.14 0.00 -0.00 0.00 0.00 35.03 32.66 1haj n LYS 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1haj n ASN 66 N -1.83 5.51 -4.93 0.00 6.94 -1.26 -4.96 115.26 114.73 1haj n ASN 66 Ca 0.04 -3.74 -0.25 0.00 -0.02 0.00 0.00 54.58 50.61 1haj n ASN 66 Cb 0.40 -0.67 0.02 0.00 -2.36 0.00 0.00 39.78 37.17 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 -3.71 2.99 0.18 -0.53 0.04 -1.26 -4.54 135.00 128.17 1haj s PRO 67 Ca 0.48 -0.20 -0.32 0.00 0.04 0.00 0.00 61.00 61.01 1haj s PRO 67 Cb 0.37 -2.39 -0.11 0.00 0.04 0.00 0.00 34.50 32.41 1haj s PRO 67 CO -0.23 -0.52 1.73 -1.58 0.04 0.00 0.00 177.00 176.44 1haj s HIS 68 N -2.81 2.75 0.62 0.56 2.46 -1.26 -4.84 115.29 112.76 1haj s HIS 68 Ca 0.52 0.29 0.28 0.00 0.47 0.00 0.00 55.06 56.61 1haj s HIS 68 Cb -0.10 -4.13 1.46 0.00 -0.13 0.00 0.00 32.58 29.68 1haj s HIS 68 CO 0.42 -4.35 1.85 -1.35 -2.47 0.00 0.00 174.74 168.84 1haj h PRO 69 N 7.22 0.00 -0.63 2.88 0.11 -2.01 0.38 132.00 139.94 1haj h PRO 69 Ca -0.44 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.38 1haj h PRO 69 Cb 1.20 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.14 1haj h PRO 69 CO 0.95 0.00 0.24 1.63 -0.21 0.00 0.00 178.00 180.61 1haj n LYS 70 N -3.36 2.34 -1.39 1.05 4.76 -1.26 -5.02 118.16 115.29 1haj n LYS 70 Ca 0.05 -3.09 -0.30 0.00 -2.87 0.00 0.00 58.31 52.10 1haj n LYS 70 Cb 0.60 -2.01 0.10 0.00 -1.84 0.00 0.00 35.03 31.88 1haj n LYS 70 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1haj s GLN 71 N -3.20 2.01 0.11 1.97 -1.52 0.13 -4.94 119.66 114.22 1haj s GLN 71 Ca 0.50 0.86 -0.32 0.00 -1.95 0.00 0.00 55.36 54.45 1haj s GLN 71 Cb 0.43 -1.89 -0.12 0.00 -0.22 0.00 0.00 33.01 31.22 1haj s GLN 71 CO 0.06 -1.73 1.79 0.54 -0.25 0.00 0.00 175.29 175.70 1haj n ARG 72 N -3.54 2.60 0.00 2.91 3.00 -1.26 -4.99 116.66 115.38 1haj n ARG 72 Ca 0.08 0.94 0.00 0.00 -0.01 0.00 0.00 57.85 58.86 1haj n ARG 72 Cb 0.55 -2.81 0.00 0.00 0.00 0.00 0.00 32.46 30.20 1haj n ARG 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1haj n PRO 73 N 5.21 -0.22 0.00 5.56 -0.04 -1.26 -5.18 135.00 139.07 1haj n PRO 73 Ca 0.18 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.73 1haj n PRO 73 Cb 0.35 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 33.87 1haj n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87