#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 2.23 0.30 9.51 1.01 -1.26 -2.02 120.40 130.17 1haj s VAL 2 Ca 0.00 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.12 1haj s VAL 2 Cb 0.00 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.44 1haj s VAL 2 CO 0.00 0.55 -0.08 0.00 0.00 0.00 0.00 175.10 175.57 1haj s HIS 4 N -2.86 3.68 0.12 0.00 3.76 -1.26 -2.03 115.29 116.70 1haj s HIS 4 Ca 0.30 1.05 0.07 0.00 -0.15 0.00 0.00 55.06 56.33 1haj s HIS 4 Cb 0.03 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.24 1haj s HIS 4 CO 0.13 0.47 -0.16 -0.08 -0.85 0.00 0.00 174.74 174.25 1haj s THR 5 N -0.52 1.48 -0.12 1.30 -1.32 0.22 -1.64 115.64 115.04 1haj s THR 5 Ca 0.26 -1.68 0.15 0.00 -1.21 0.00 0.00 61.69 59.21 1haj s THR 5 Cb -0.17 -1.55 0.29 0.00 -1.51 0.00 0.00 72.50 69.56 1haj s THR 5 CO 0.14 -0.31 1.15 0.35 -2.21 0.00 0.00 174.62 173.74 1haj n THR 6 N 0.66 1.54 -0.86 5.08 -2.24 -0.81 -2.39 114.28 115.27 1haj n THR 6 Ca -0.16 -2.08 -0.17 0.00 -2.27 0.00 0.00 64.05 59.37 1haj n THR 6 Cb 0.56 -0.03 0.04 0.00 -2.10 0.00 0.00 70.33 68.81 1haj n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1haj n ALA 7 N -0.98 5.10 -3.04 6.98 0.00 -1.26 -4.87 120.51 122.44 1haj n ALA 7 Ca 0.14 -1.74 -0.00 0.00 0.00 0.00 0.00 53.44 51.83 1haj n ALA 7 Cb 0.70 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 1haj n ALA 7 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1haj n THR 8 N 0.23 0.00 0.17 0.00 -2.24 -1.26 -5.08 114.28 106.09 1haj n THR 8 Ca 0.32 -0.06 -0.07 0.00 -2.27 0.00 0.00 64.05 61.96 1haj n THR 8 Cb 0.62 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 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 0.09 -0.39 -3.17 3.42 0.87 -1.99 -3.44 113.55 108.93 1haj h SER 9 Ca -0.01 0.01 -0.54 0.00 -1.23 0.00 0.00 61.79 60.02 1haj h SER 9 Cb 0.06 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1haj h SER 9 CO 0.02 -0.13 -0.22 -2.16 -0.53 0.00 0.00 176.83 173.81 1haj s PRO 10 N -3.23 3.64 -0.03 2.24 0.05 -1.26 -5.07 135.00 131.34 1haj s PRO 10 Ca -0.07 -0.03 -0.26 0.00 0.05 0.00 0.00 61.00 60.69 1haj s PRO 10 Cb 0.01 -2.74 -0.04 0.00 0.05 0.00 0.00 34.50 31.78 1haj s PRO 10 CO 0.20 0.34 0.80 0.96 0.05 0.00 0.00 177.00 179.35 1haj s ILE 11 N -1.87 4.95 0.27 0.56 -4.36 -1.26 -4.88 121.20 114.60 1haj s ILE 11 Ca 0.43 1.67 0.01 0.00 -0.26 0.00 0.00 60.65 62.50 1haj s ILE 11 Cb -0.11 -4.14 -0.03 0.00 1.25 0.00 0.00 42.46 39.42 1haj s ILE 11 CO 0.27 0.23 0.24 -0.94 0.24 0.00 0.00 174.94 174.98 1haj s SER 12 N 0.77 0.79 0.02 4.36 1.04 -1.00 -4.97 113.70 114.70 1haj s SER 12 Ca 0.42 -1.51 0.02 0.00 0.48 0.00 0.00 55.95 55.36 1haj s SER 12 Cb -0.19 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 1haj s SER 12 CO 0.22 -0.99 -0.06 0.00 0.98 0.00 0.00 173.24 173.39 1haj s ALA 13 N -3.77 0.48 0.34 5.32 0.00 -1.26 0.69 121.76 123.56 1haj s ALA 13 Ca 0.38 -0.47 -0.05 0.00 0.00 0.00 0.00 51.96 51.81 1haj s ALA 13 Cb 0.04 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.14 1haj s ALA 13 CO 0.19 0.04 0.52 0.54 0.00 0.00 0.00 175.76 177.05 1haj s VAL 14 N -0.71 0.00 -0.60 0.00 0.11 -0.86 -4.89 120.40 113.44 1haj s VAL 14 Ca -0.04 -1.49 -0.28 0.00 -2.93 0.00 0.00 61.98 57.25 1haj s VAL 14 Cb -0.06 -2.64 0.03 0.00 -1.53 0.00 0.00 36.38 32.19 1haj s VAL 14 CO 0.00 0.00 1.18 -0.89 -3.33 0.00 0.00 175.10 172.06 1haj s THR 15 N -3.03 4.01 0.23 5.04 2.01 -1.26 -1.97 115.64 120.68 1haj s THR 15 Ca 0.27 0.74 -0.30 0.00 0.31 0.00 0.00 61.69 62.72 1haj s THR 15 Cb -0.01 -4.74 -0.09 0.00 0.01 0.00 0.00 72.50 67.67 1haj s THR 15 CO 0.18 -1.41 1.22 0.00 -0.69 0.00 0.00 174.62 173.92 1haj s PRO 17 N -0.72 -1.83 0.59 0.00 0.04 -1.26 -4.52 135.00 127.30 1haj s PRO 17 Ca 0.51 0.20 0.32 0.00 0.04 0.00 0.00 61.00 62.07 1haj s PRO 17 Cb -0.34 -1.50 1.23 0.00 0.04 0.00 0.00 34.50 33.92 1haj s PRO 17 CO 0.40 -4.17 1.52 -1.00 0.04 0.00 0.00 177.00 173.80 1haj h PRO 18 N -2.92 0.00 0.06 0.56 0.13 -2.02 -0.45 132.00 127.37 1haj h PRO 18 Ca -0.48 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1haj h PRO 18 Cb 1.32 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 1haj h PRO 18 CO 0.36 0.00 -0.20 0.78 -0.23 0.00 0.00 178.00 178.71 1haj h GLY 19 N 0.00 -0.33 -5.13 1.56 0.00 -2.01 -3.42 103.07 93.74 1haj h GLY 19 Ca 0.50 0.24 -0.68 0.00 0.00 0.00 0.00 47.33 47.39 1haj h GLY 19 CO -0.01 -0.19 -0.79 -0.54 0.00 0.00 0.00 176.54 175.01 1haj s GLU 20 N -6.10 2.78 0.00 4.80 8.01 -0.18 -4.17 118.70 123.85 1haj s GLU 20 Ca -0.15 -0.74 0.00 0.00 0.01 0.00 0.00 54.97 54.09 1haj s GLU 20 Cb 0.08 -2.40 0.00 0.00 -4.31 0.00 0.00 34.13 27.50 1haj s GLU 20 CO 0.66 0.44 0.00 0.09 0.01 0.00 0.00 175.26 176.46 1haj n ASN 21 N 2.82 3.45 -4.77 -0.19 3.02 -1.17 -4.28 115.26 114.13 1haj n ASN 21 Ca -0.17 -0.04 -0.23 0.00 -0.03 0.00 0.00 54.58 54.11 1haj n ASN 21 Cb 0.52 0.77 -0.06 0.00 -0.61 0.00 0.00 39.78 40.40 1haj n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1haj s LEU 22 N -2.22 3.25 0.21 3.41 1.43 0.98 -4.65 118.68 121.08 1haj s LEU 22 Ca 0.00 -0.87 0.09 0.00 -1.03 0.00 0.00 54.13 52.32 1haj s LEU 22 Cb 0.00 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1haj s LEU 22 CO 0.00 -0.48 -0.10 0.00 0.23 0.00 0.00 176.35 176.00 1haj s TYR 24 N -1.89 0.03 -0.21 0.00 -0.85 -0.15 -2.12 117.35 112.16 1haj s TYR 24 Ca 0.26 -0.07 -0.04 0.00 -0.52 0.00 0.00 57.07 56.70 1haj s TYR 24 Cb -0.08 -0.05 0.07 0.00 0.38 0.00 0.00 41.96 42.29 1haj s TYR 24 CO 0.16 -0.21 0.09 0.50 -1.52 0.00 0.00 175.55 174.57 1haj s ARG 25 N -0.98 0.22 0.19 -3.49 3.52 -0.75 -2.38 118.95 115.29 1haj s ARG 25 Ca -0.11 -0.30 -0.08 0.00 -0.13 0.00 0.00 55.73 55.11 1haj s ARG 25 Cb -0.06 -1.70 -0.07 0.00 -1.56 0.00 0.00 34.95 31.56 1haj s ARG 25 CO 0.01 -0.77 0.48 0.21 -0.81 0.00 0.00 175.30 174.41 1haj s LYS 26 N 2.06 3.74 -0.07 5.12 2.20 -0.84 -0.93 119.74 131.02 1haj s LYS 26 Ca 0.04 0.14 -0.07 0.00 -0.36 0.00 0.00 55.97 55.72 1haj s LYS 26 Cb -0.16 -2.74 0.02 0.00 -1.51 0.00 0.00 37.83 33.44 1haj s LYS 26 CO -0.17 0.39 0.20 -1.64 -0.36 0.00 0.00 175.35 173.76 1haj s MET 27 N -2.70 0.24 -0.30 4.03 -1.94 -0.21 -0.81 119.30 117.61 1haj s MET 27 Ca 0.44 0.25 -0.15 0.00 -1.71 0.00 0.00 55.69 54.52 1haj s MET 27 Cb -0.12 0.12 0.16 0.00 2.01 0.00 0.00 34.83 37.00 1haj s MET 27 CO 0.22 -0.03 1.01 1.67 -0.01 0.00 0.00 175.02 177.88 1haj s TRP 28 N 0.06 -0.61 -0.23 -0.03 1.48 -1.10 -2.91 118.94 115.59 1haj s TRP 28 Ca -0.00 1.09 -0.32 0.00 -1.06 0.00 0.00 56.10 55.81 1haj s TRP 28 Cb -0.02 0.37 -0.09 0.00 -1.16 0.00 0.00 33.47 32.57 1haj s TRP 28 CO 0.00 -0.30 2.12 0.00 -4.06 0.00 0.00 176.95 174.71 1haj s ASP 30 N 6.81 6.91 0.00 0.00 1.47 0.36 -4.65 116.67 127.57 1haj s ASP 30 Ca 1.02 1.95 0.00 0.00 1.18 0.00 0.00 52.55 56.69 1haj s ASP 30 Cb -0.61 -2.58 0.00 0.00 -0.34 0.00 0.00 42.92 39.39 1haj s ASP 30 CO 0.44 -0.38 0.00 0.00 0.68 0.00 0.00 175.17 175.91 1haj n ALA 31 N -0.01 0.00 -1.45 2.11 0.00 -1.26 -1.89 120.51 118.01 1haj n ALA 31 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1haj n ALA 31 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.95 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 1.95 0.00 -0.33 0.00 3.72 -1.26 -4.88 117.46 116.66 1haj n PHE 32 Ca 0.00 -0.04 0.33 0.00 -0.05 0.00 0.00 57.45 57.70 1haj n PHE 32 Cb 0.00 0.22 0.51 0.00 -0.94 0.00 0.00 39.48 39.27 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 -0.07 0.00 0.00 0.02 -1.94 -3.40 113.55 108.15 1haj h SER 34 Ca 0.59 -0.51 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1haj h SER 34 Cb 3.07 0.02 0.00 0.00 0.14 0.00 0.00 62.40 65.63 1haj h SER 34 CO -0.01 0.62 0.00 -0.24 -1.14 0.00 0.00 176.83 176.06 1haj n SER 35 N -4.78 0.00 0.00 3.07 2.88 0.33 -4.89 113.62 110.23 1haj n SER 35 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1haj n SER 35 Cb 0.28 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.74 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 -1.12 0.00 0.00 -1.46 5.12 0.54 -4.96 116.66 114.77 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 -0.74 0.00 0.00 -1.16 0.00 0.00 32.46 30.56 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 0.89 0.19 3.41 -0.13 0.00 0.11 -4.66 105.19 105.01 1haj n GLY 37 Ca 0.00 -1.03 -0.48 0.00 0.00 0.00 0.00 46.02 44.51 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 8.57 0.12 -2.08 1.61 5.02 -1.25 0.14 118.16 130.29 1haj n LYS 38 Ca 0.00 0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 55.90 1haj n LYS 38 Cb 0.00 -1.66 -0.02 0.00 -0.02 0.00 0.00 35.03 33.33 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 7.93 2.72 -0.26 -0.18 1.01 0.35 -4.58 120.40 127.39 1haj s VAL 39 Ca 1.27 0.67 -0.10 0.00 0.00 0.00 0.00 61.98 63.82 1haj s VAL 39 Cb -1.27 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.64 1haj s VAL 39 CO 0.54 0.14 0.15 -0.69 0.00 0.00 0.00 175.10 175.24 1haj s VAL 40 N -0.66 5.12 0.09 2.92 1.01 -1.26 -2.73 120.40 124.90 1haj s VAL 40 Ca 0.53 0.10 0.09 0.00 0.00 0.00 0.00 61.98 62.70 1haj s VAL 40 Cb -0.40 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1haj s VAL 40 CO 0.49 0.30 -0.19 -0.70 0.00 0.00 0.00 175.10 175.01 1haj s GLU 41 N 1.45 1.84 -0.05 2.72 2.56 0.01 -4.96 118.70 122.27 1haj s GLU 41 Ca 0.07 -1.13 -0.06 0.00 0.00 0.00 0.00 54.97 53.84 1haj s GLU 41 Cb -0.15 -2.12 0.01 0.00 2.00 0.00 0.00 34.13 33.87 1haj s GLU 41 CO 0.07 0.50 0.16 -0.51 -0.56 0.00 0.00 175.26 174.92 1haj s LEU 42 N -1.92 1.41 0.00 2.70 1.02 -1.26 -1.99 118.68 118.63 1haj s LEU 42 Ca 0.17 0.22 0.00 0.00 0.02 0.00 0.00 54.13 54.53 1haj s LEU 42 Cb -0.10 0.59 0.00 0.00 0.02 0.00 0.00 46.19 46.69 1haj s LEU 42 CO 0.08 -0.12 0.00 0.61 0.02 0.00 0.00 176.35 176.94 1haj n GLY 43 N 2.66 0.98 3.78 -3.19 0.00 -0.65 -1.92 105.19 106.85 1haj n GLY 43 Ca -0.15 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.26 0.52 0.05 0.00 0.00 0.24 -4.87 121.76 117.43 1haj s ALA 45 Ca 0.21 -0.93 0.10 0.00 0.00 0.00 0.00 51.96 51.33 1haj s ALA 45 Cb -0.15 0.14 -0.22 0.00 0.00 0.00 0.00 23.12 22.90 1haj s ALA 45 CO 0.09 -0.17 1.01 0.00 0.00 0.00 0.00 175.76 176.68 1haj h ALA 46 N 3.95 0.54 -4.03 0.00 0.00 -1.82 0.28 119.26 118.18 1haj h ALA 46 Ca -0.34 -1.15 -0.18 0.00 0.00 0.00 0.00 54.91 53.24 1haj h ALA 46 Cb 1.18 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1haj h ALA 46 CO 0.51 1.39 -0.14 0.25 0.00 0.00 0.00 179.25 181.26 1haj n THR 47 N -3.21 0.00 -3.58 0.00 -2.24 -1.26 -4.63 114.28 99.35 1haj n THR 47 Ca -0.07 -0.72 -0.27 0.00 -2.27 0.00 0.00 64.05 60.72 1haj n THR 47 Cb 0.99 0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 69.34 1haj n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1haj s PRO 49 N -1.34 2.42 -0.18 0.00 0.04 -1.26 -5.06 135.00 129.62 1haj s PRO 49 Ca 0.32 0.20 -0.30 0.00 0.04 0.00 0.00 61.00 61.26 1haj s PRO 49 Cb 0.05 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.70 1haj s PRO 49 CO -0.13 -1.27 1.05 -1.54 0.04 0.00 0.00 177.00 175.15 1haj s SER 50 N -4.46 -0.33 -0.27 6.66 1.04 -1.26 -4.90 113.70 110.18 1haj s SER 50 Ca 0.60 0.38 0.05 0.00 0.48 0.00 0.00 55.95 57.46 1haj s SER 50 Cb -0.11 0.29 0.20 0.00 0.10 0.00 0.00 66.02 66.50 1haj s SER 50 CO 0.49 -0.29 1.11 2.29 0.98 0.00 0.00 173.24 177.83 1haj n LYS 51 N 0.79 0.63 -3.23 4.02 2.85 -1.26 -5.11 118.16 116.86 1haj n LYS 51 Ca -0.09 -0.93 -0.02 0.00 -1.05 0.00 0.00 58.31 56.23 1haj n LYS 51 Cb 0.58 0.08 -0.03 0.00 -0.65 0.00 0.00 35.03 35.00 1haj n LYS 51 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1haj s LYS 52 N 0.08 0.49 0.62 -1.58 -0.14 -1.26 -5.02 119.74 112.93 1haj s LYS 52 Ca 0.08 0.56 0.31 0.00 -1.36 0.00 0.00 55.97 55.56 1haj s LYS 52 Cb 0.21 0.05 1.70 0.00 -1.68 0.00 0.00 37.83 38.11 1haj s LYS 52 CO -0.05 -0.86 2.04 -1.35 -0.76 0.00 0.00 175.35 174.37 1haj h PRO 53 N 8.08 0.00 0.02 -1.68 0.11 -2.04 -2.40 132.00 134.09 1haj h PRO 53 Ca -0.12 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.60 1haj h PRO 53 Cb 1.16 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 1haj h PRO 53 CO 0.23 0.00 -2.38 0.66 -0.21 0.00 0.00 178.00 176.30 1haj n TYR 54 N -3.48 0.23 -3.17 0.65 4.01 -1.26 -4.84 117.16 109.30 1haj n TYR 54 Ca 0.02 0.05 -0.43 0.00 -0.16 0.00 0.00 57.90 57.38 1haj n TYR 54 Cb 0.38 -1.03 -0.07 0.00 -0.31 0.00 0.00 39.34 38.31 1haj n TYR 54 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1haj s GLU 55 N -2.52 3.21 0.22 -0.72 2.02 -0.90 -4.76 118.70 115.25 1haj s GLU 55 Ca -0.33 -0.53 0.10 0.00 0.02 0.00 0.00 54.97 54.22 1haj s GLU 55 Cb 0.09 -3.97 -0.04 0.00 0.10 0.00 0.00 34.13 30.31 1haj s GLU 55 CO 0.61 -0.99 -0.10 -1.21 0.02 0.00 0.00 175.26 173.59 1haj s GLU 56 N 2.61 2.00 0.03 1.61 0.41 -1.15 -4.14 118.70 120.08 1haj s GLU 56 Ca 0.19 -1.43 0.03 0.00 -0.41 0.00 0.00 54.97 53.35 1haj s GLU 56 Cb -0.15 -2.06 -0.02 0.00 -1.78 0.00 0.00 34.13 30.12 1haj s GLU 56 CO 0.17 0.39 -0.08 0.08 -0.49 0.00 0.00 175.26 175.33 1haj s VAL 57 N -2.02 0.62 -0.37 2.63 1.01 -1.26 -1.05 120.40 119.96 1haj s VAL 57 Ca 0.27 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 1haj s VAL 57 Cb -0.07 -0.62 0.03 0.00 0.00 0.00 0.00 36.38 35.71 1haj s VAL 57 CO 0.16 -0.19 0.20 0.42 0.00 0.00 0.00 175.10 175.69 1haj s THR 58 N -0.98 4.57 -0.24 3.92 -4.23 -0.10 -4.88 115.64 113.69 1haj s THR 58 Ca -0.05 -0.84 -0.05 0.00 -1.18 0.00 0.00 61.69 59.58 1haj s THR 58 Cb -0.08 -3.54 -0.01 0.00 1.34 0.00 0.00 72.50 70.22 1haj s THR 58 CO 0.00 -0.22 -0.01 0.00 -0.54 0.00 0.00 174.62 173.86 1haj n SER 61 N -1.39 4.31 -4.02 0.00 3.41 -1.26 -2.01 113.62 112.67 1haj n SER 61 Ca -0.08 -3.64 -0.08 0.00 -0.26 0.00 0.00 58.87 54.81 1haj n SER 61 Cb 0.65 -0.52 -0.10 0.00 -0.26 0.00 0.00 64.21 63.98 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 -4.75 0.17 0.51 6.66 2.01 -1.26 -5.05 115.64 113.93 1haj s THR 62 Ca 0.48 -1.44 -0.20 0.00 0.31 0.00 0.00 61.69 60.83 1haj s THR 62 Cb 0.33 -1.11 -0.07 0.00 0.01 0.00 0.00 72.50 71.67 1haj s THR 62 CO -0.15 -0.79 1.12 -0.62 -0.69 0.00 0.00 174.62 173.49 1haj s ASP 63 N -2.44 5.95 -1.39 3.53 -1.08 -1.26 -3.25 116.67 116.73 1haj s ASP 63 Ca -0.01 2.17 -0.18 0.00 -0.52 0.00 0.00 52.55 54.01 1haj s ASP 63 Cb 0.02 -2.58 0.18 0.00 -1.46 0.00 0.00 42.92 39.07 1haj s ASP 63 CO -0.07 -1.06 0.44 0.29 0.52 0.00 0.00 175.17 175.29 1haj n LYS 64 N -1.03 -0.91 0.00 4.34 5.02 0.17 -4.75 118.16 121.01 1haj n LYS 64 Ca 0.10 0.10 0.12 0.00 -2.02 0.00 0.00 58.31 56.61 1haj n LYS 64 Cb 0.50 -3.74 0.22 0.00 -0.02 0.00 0.00 35.03 31.99 1haj n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1haj n ASN 66 N -1.46 4.98 -4.91 0.00 6.94 -1.26 -4.98 115.26 114.56 1haj n ASN 66 Ca 0.06 -3.72 -0.27 0.00 -0.02 0.00 0.00 54.58 50.63 1haj n ASN 66 Cb 0.34 -0.57 0.03 0.00 -2.36 0.00 0.00 39.78 37.22 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 -3.60 3.01 0.43 -0.53 0.04 -1.26 -4.58 135.00 128.51 1haj s PRO 67 Ca 0.48 0.04 -0.25 0.00 0.04 0.00 0.00 61.00 61.31 1haj s PRO 67 Cb 0.36 -2.28 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 1haj s PRO 67 CO -0.19 -0.64 1.30 1.58 0.04 0.00 0.00 177.00 179.09 1haj n HIS 68 N -2.55 2.22 0.79 0.56 -0.00 -1.26 -4.87 115.22 110.11 1haj n HIS 68 Ca 0.04 0.49 0.08 0.00 0.46 0.00 0.00 57.72 58.79 1haj n HIS 68 Cb 0.57 -2.39 0.41 0.00 -0.12 0.00 0.00 29.99 28.46 1haj n HIS 68 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1haj n PRO 69 N -0.02 0.27 -0.41 1.57 -0.04 -1.26 -2.47 135.00 132.64 1haj n PRO 69 Ca 0.06 0.12 0.06 0.00 -0.04 0.00 0.00 63.50 63.70 1haj n PRO 69 Cb 0.40 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.55 1haj n PRO 69 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1haj n LYS 70 N -1.24 1.71 -3.70 0.54 4.01 -1.26 -4.97 118.16 113.25 1haj n LYS 70 Ca 0.08 -2.94 -0.16 0.00 -0.51 0.00 0.00 58.31 54.79 1haj n LYS 70 Cb 0.11 -1.64 -0.16 0.00 -0.51 0.00 0.00 35.03 32.84 1haj n LYS 70 CO 0.00 0.00 0.00 1.14 -1.11 0.00 0.00 177.40 177.43 1haj s GLN 71 N -3.04 0.03 -0.37 1.97 1.03 -1.03 -5.11 119.66 113.14 1haj s GLN 71 Ca 0.37 0.46 -0.29 0.00 0.04 0.00 0.00 55.36 55.95 1haj s GLN 71 Cb 0.34 -0.27 0.00 0.00 0.03 0.00 0.00 33.01 33.11 1haj s GLN 71 CO 0.00 -0.26 1.44 1.03 -2.54 0.00 0.00 175.29 174.96 1haj s ARG 72 N 1.86 3.64 0.34 9.60 1.81 -1.26 -4.66 118.95 130.27 1haj s ARG 72 Ca -0.01 1.09 -0.28 0.00 -1.72 0.00 0.00 55.73 54.81 1haj s ARG 72 Cb -0.12 -4.01 -0.09 0.00 -0.45 0.00 0.00 34.95 30.28 1haj s ARG 72 CO -0.05 -1.48 1.17 -1.25 -0.68 0.00 0.00 175.30 173.00 1haj s PRO 73 N 4.83 4.36 0.00 3.54 0.04 -1.26 -5.16 135.00 141.35 1haj s PRO 73 Ca 0.63 1.90 0.28 0.00 0.04 0.00 0.00 61.00 63.84 1haj s PRO 73 Cb -0.16 -2.96 1.02 0.00 0.04 0.00 0.00 34.50 32.44 1haj s PRO 73 CO 0.31 -0.07 1.73 0.41 0.04 0.00 0.00 177.00 179.41