#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 3.46 0.32 9.51 1.01 -1.26 -2.00 120.40 131.44 1haj s VAL 2 Ca 0.00 -0.46 0.10 0.00 0.00 0.00 0.00 61.98 61.61 1haj s VAL 2 Cb 0.00 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 1haj s VAL 2 CO 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 175.10 175.46 1haj s HIS 4 N -2.52 3.69 0.11 0.00 3.76 -1.26 -1.91 115.29 117.16 1haj s HIS 4 Ca 0.33 1.17 0.06 0.00 -0.15 0.00 0.00 55.06 56.47 1haj s HIS 4 Cb -0.01 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.20 1haj s HIS 4 CO 0.18 0.49 -0.14 -0.08 -0.85 0.00 0.00 174.74 174.33 1haj s THR 5 N -1.33 1.30 0.00 1.30 -1.32 0.31 -1.65 115.64 114.25 1haj s THR 5 Ca 0.35 -1.64 0.00 0.00 -1.21 0.00 0.00 61.69 59.19 1haj s THR 5 Cb -0.17 -1.45 0.00 0.00 -1.51 0.00 0.00 72.50 69.37 1haj s THR 5 CO 0.19 -0.37 0.32 0.35 -2.21 0.00 0.00 174.62 172.90 1haj n THR 6 N 0.68 0.00 0.02 5.08 -2.24 -1.08 -2.54 114.28 114.19 1haj n THR 6 Ca -0.17 -0.43 0.22 0.00 -2.27 0.00 0.00 64.05 61.40 1haj n THR 6 Cb 0.56 1.11 0.73 0.00 -2.10 0.00 0.00 70.33 70.63 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 2.37 -4.05 6.98 0.00 -1.88 -3.41 119.26 119.27 1haj h ALA 7 Ca 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.56 1haj h ALA 7 Cb 0.06 0.04 0.11 0.00 0.00 0.00 0.00 17.79 18.00 1haj h ALA 7 CO 0.00 -0.72 0.25 0.25 0.00 0.00 0.00 179.25 179.04 1haj n THR 8 N -4.06 0.00 0.10 0.00 -2.24 -1.26 -5.03 114.28 101.79 1haj n THR 8 Ca 0.10 -0.86 -0.04 0.00 -2.27 0.00 0.00 64.05 60.97 1haj n THR 8 Cb 0.66 -1.46 -0.02 0.00 -2.10 0.00 0.00 70.33 67.41 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 -1.08 -0.24 -3.07 3.42 0.87 -1.98 -3.46 113.55 108.02 1haj h SER 9 Ca -0.30 0.01 -0.16 0.00 -1.23 0.00 0.00 61.79 60.11 1haj h SER 9 Cb 0.90 0.06 0.05 0.00 -0.44 0.00 0.00 62.40 62.97 1haj h SER 9 CO 0.24 -0.08 0.12 -0.81 -0.53 0.00 0.00 176.83 175.76 1haj n PRO 10 N -3.24 -0.22 -3.39 2.24 -0.04 -1.26 -5.06 135.00 124.03 1haj n PRO 10 Ca -0.04 -0.80 -0.32 0.00 -0.04 0.00 0.00 63.50 62.30 1haj n PRO 10 Cb 0.11 -0.41 -0.05 0.00 -0.04 0.00 0.00 33.50 33.10 1haj n PRO 10 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1haj s ILE 11 N -1.71 4.91 -0.08 0.52 1.01 -1.26 -4.78 121.20 119.81 1haj s ILE 11 Ca 0.26 0.52 -0.24 0.00 0.00 0.00 0.00 60.65 61.19 1haj s ILE 11 Cb -0.01 -3.62 0.05 0.00 0.01 0.00 0.00 42.46 38.90 1haj s ILE 11 CO 0.18 -0.07 0.56 -0.94 0.00 0.00 0.00 174.94 174.67 1haj s SER 12 N -2.33 -0.52 -0.02 3.58 1.04 -1.05 -5.01 113.70 109.39 1haj s SER 12 Ca 0.48 0.64 0.02 0.00 0.48 0.00 0.00 55.95 57.57 1haj s SER 12 Cb -0.11 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1haj s SER 12 CO 0.21 -0.48 -0.06 0.00 0.98 0.00 0.00 173.24 173.88 1haj s ALA 13 N -0.91 0.61 0.36 5.32 0.00 -1.26 0.11 121.76 125.99 1haj s ALA 13 Ca -0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 51.96 51.61 1haj s ALA 13 Cb -0.02 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.88 1haj s ALA 13 CO 0.06 0.10 0.51 0.54 0.00 0.00 0.00 175.76 176.98 1haj s VAL 14 N 0.15 0.00 -0.61 0.00 0.11 -0.80 -4.88 120.40 114.36 1haj s VAL 14 Ca -0.02 -1.55 -0.28 0.00 -2.93 0.00 0.00 61.98 57.21 1haj s VAL 14 Cb -0.06 -2.69 0.03 0.00 -1.53 0.00 0.00 36.38 32.13 1haj s VAL 14 CO -0.00 0.00 1.23 -0.89 -3.33 0.00 0.00 175.10 172.11 1haj s THR 15 N -2.91 3.94 0.29 5.04 2.01 -1.25 -1.53 115.64 121.23 1haj s THR 15 Ca 0.29 0.79 -0.30 0.00 0.31 0.00 0.00 61.69 62.78 1haj s THR 15 Cb -0.01 -4.75 -0.11 0.00 0.01 0.00 0.00 72.50 67.64 1haj s THR 15 CO 0.20 -1.44 1.58 0.00 -0.69 0.00 0.00 174.62 174.27 1haj s PRO 17 N -0.58 -2.55 0.61 0.00 0.04 -1.26 -4.66 135.00 126.60 1haj s PRO 17 Ca 0.62 0.21 0.26 0.00 0.04 0.00 0.00 61.00 62.13 1haj s PRO 17 Cb -0.47 -1.41 1.15 0.00 0.04 0.00 0.00 34.50 33.80 1haj s PRO 17 CO 0.48 -4.65 1.58 -1.35 0.04 0.00 0.00 177.00 173.11 1haj h PRO 18 N -3.26 0.00 -0.03 0.56 0.11 -2.03 -1.15 132.00 126.21 1haj h PRO 18 Ca -0.46 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.67 1haj h PRO 18 Cb 1.34 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 1haj h PRO 18 CO 0.32 0.00 -0.14 0.78 -0.21 0.00 0.00 178.00 178.75 1haj h GLY 19 N 0.00 -0.15 -4.63 -0.55 0.00 -2.01 -3.42 103.07 92.30 1haj h GLY 19 Ca 0.29 0.17 -0.70 0.00 0.00 0.00 0.00 47.33 47.08 1haj h GLY 19 CO -0.00 -0.14 -0.89 -0.54 0.00 0.00 0.00 176.54 174.97 1haj s GLU 20 N -6.14 2.14 -0.00 4.80 8.01 -0.43 -4.38 118.70 122.68 1haj s GLU 20 Ca -0.14 -0.93 0.02 0.00 0.01 0.00 0.00 54.97 53.93 1haj s GLU 20 Cb 0.09 -2.05 -0.03 0.00 -4.31 0.00 0.00 34.13 27.83 1haj s GLU 20 CO 0.67 0.55 0.07 0.09 0.01 0.00 0.00 175.26 176.64 1haj n ASN 21 N 2.48 3.37 -4.23 -0.19 4.13 -1.13 -4.33 115.26 115.36 1haj n ASN 21 Ca -0.16 -0.14 -0.21 0.00 1.68 0.00 0.00 54.58 55.75 1haj n ASN 21 Cb 0.51 1.08 -0.01 0.00 -1.54 0.00 0.00 39.78 39.83 1haj n ASN 21 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1haj n LEU 22 N -1.45 0.00 -4.44 3.41 4.77 0.13 -4.71 117.00 114.70 1haj n LEU 22 Ca -0.00 -2.31 -0.21 0.00 -0.03 0.00 0.00 56.01 53.46 1haj n LEU 22 Cb 0.06 0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.06 1haj n LEU 22 CO 0.05 -0.50 -0.34 0.00 -1.33 0.00 0.00 177.39 175.27 1haj s TYR 24 N -3.07 -0.15 -0.15 0.00 -0.85 0.12 -2.28 117.35 110.97 1haj s TYR 24 Ca 0.31 0.09 -0.04 0.00 -0.52 0.00 0.00 57.07 56.91 1haj s TYR 24 Cb 0.05 0.11 0.06 0.00 0.38 0.00 0.00 41.96 42.56 1haj s TYR 24 CO 0.13 -0.48 0.10 0.50 -1.52 0.00 0.00 175.55 174.28 1haj s ARG 25 N -2.16 0.05 0.22 -3.49 3.52 -0.32 -2.48 118.95 114.29 1haj s ARG 25 Ca -0.08 0.02 -0.12 0.00 -0.13 0.00 0.00 55.73 55.43 1haj s ARG 25 Cb -0.02 -1.56 -0.07 0.00 -1.56 0.00 0.00 34.95 31.73 1haj s ARG 25 CO -0.01 -0.61 0.58 0.21 -0.81 0.00 0.00 175.30 174.66 1haj s LYS 26 N 2.16 3.89 -0.14 5.12 2.20 -0.95 -0.36 119.74 131.66 1haj s LYS 26 Ca 0.03 0.40 -0.12 0.00 -0.36 0.00 0.00 55.97 55.92 1haj s LYS 26 Cb -0.15 -2.70 0.04 0.00 -1.51 0.00 0.00 37.83 33.51 1haj s LYS 26 CO -0.08 0.34 0.36 -1.64 -0.36 0.00 0.00 175.35 173.97 1haj s MET 27 N -2.59 0.41 -0.29 4.03 -1.94 -0.88 -1.27 119.30 116.77 1haj s MET 27 Ca 0.46 0.53 -0.17 0.00 -1.71 0.00 0.00 55.69 54.79 1haj s MET 27 Cb -0.12 0.17 0.15 0.00 2.01 0.00 0.00 34.83 37.04 1haj s MET 27 CO 0.20 -0.06 1.04 1.67 -0.01 0.00 0.00 175.02 177.85 1haj s TRP 28 N 0.34 -0.47 -0.33 -0.03 -2.14 -1.12 -3.34 118.94 111.85 1haj s TRP 28 Ca -0.01 0.98 -0.27 0.00 2.66 0.00 0.00 56.10 59.45 1haj s TRP 28 Cb -0.03 0.31 -0.05 0.00 -3.10 0.00 0.00 33.47 30.60 1haj s TRP 28 CO -0.01 -0.23 2.18 0.00 -2.66 0.00 0.00 176.95 176.23 1haj s ASP 30 N 8.99 6.49 0.00 0.00 1.47 0.28 -4.58 116.67 129.31 1haj s ASP 30 Ca 0.95 2.21 0.00 0.00 1.18 0.00 0.00 52.55 56.89 1haj s ASP 30 Cb -0.26 -2.60 0.00 0.00 -0.34 0.00 0.00 42.92 39.72 1haj s ASP 30 CO 0.32 -0.69 0.00 0.00 0.68 0.00 0.00 175.17 175.48 1haj n ALA 31 N -0.18 0.00 -1.42 2.11 0.00 -1.26 -1.83 120.51 117.93 1haj n ALA 31 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.49 1haj n ALA 31 Cb 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 1.96 0.00 -0.38 0.00 3.72 -1.26 -4.87 117.46 116.62 1haj n PHE 32 Ca 0.00 -0.01 0.36 0.00 -0.05 0.00 0.00 57.45 57.75 1haj n PHE 32 Cb 0.00 0.20 0.56 0.00 -0.94 0.00 0.00 39.48 39.30 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 -0.04 0.00 0.00 0.02 -1.94 -3.40 113.55 108.18 1haj h SER 34 Ca 0.64 -0.64 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1haj h SER 34 Cb 3.15 0.01 0.00 0.00 0.14 0.00 0.00 62.40 65.71 1haj h SER 34 CO -0.01 0.70 0.00 -0.24 -1.14 0.00 0.00 176.83 176.15 1haj n SER 35 N -4.75 0.00 0.00 3.07 2.88 0.40 -4.90 113.62 110.32 1haj n SER 35 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1haj n SER 35 Cb 0.33 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 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 -1.30 0.00 0.00 -1.46 5.12 0.80 -4.98 116.66 114.84 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 -0.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.58 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 0.98 0.06 3.31 -0.13 0.00 0.84 -4.66 105.19 105.59 1haj n GLY 37 Ca 0.00 -1.14 -0.56 0.00 0.00 0.00 0.00 46.02 44.32 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 5.15 0.10 -1.56 1.61 4.76 -1.22 0.99 118.16 127.99 1haj n LYS 38 Ca 0.00 0.03 -0.33 0.00 -2.87 0.00 0.00 58.31 55.13 1haj n LYS 38 Cb 0.00 -1.60 0.07 0.00 -1.84 0.00 0.00 35.03 31.66 1haj n LYS 38 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1haj s VAL 39 N 6.64 2.88 -0.18 -0.18 1.01 0.68 -4.58 120.40 126.68 1haj s VAL 39 Ca 1.21 0.40 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1haj s VAL 39 Cb -1.39 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 32.12 1haj s VAL 39 CO 0.61 -0.26 -0.07 -0.69 0.00 0.00 0.00 175.10 174.69 1haj s VAL 40 N -2.28 1.32 0.23 2.92 1.01 -1.25 -2.77 120.40 119.58 1haj s VAL 40 Ca 0.69 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.98 1haj s VAL 40 Cb -0.23 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1haj s VAL 40 CO 0.45 0.16 0.04 -0.70 0.00 0.00 0.00 175.10 175.04 1haj s GLU 41 N 1.54 2.46 -0.04 2.72 2.12 -0.40 -4.93 118.70 122.17 1haj s GLU 41 Ca 0.00 -1.24 -0.04 0.00 0.36 0.00 0.00 54.97 54.05 1haj s GLU 41 Cb -0.15 -2.31 0.01 0.00 0.26 0.00 0.00 34.13 31.94 1haj s GLU 41 CO -0.08 0.40 0.11 -0.51 -0.54 0.00 0.00 175.26 174.64 1haj s LEU 42 N -3.47 1.59 0.00 2.70 1.02 -1.26 -2.23 118.68 117.03 1haj s LEU 42 Ca 0.30 0.21 0.00 0.00 0.02 0.00 0.00 54.13 54.66 1haj s LEU 42 Cb -0.08 0.37 0.00 0.00 0.02 0.00 0.00 46.19 46.51 1haj s LEU 42 CO 0.20 -0.04 0.00 0.61 0.02 0.00 0.00 176.35 177.14 1haj n GLY 43 N 3.00 1.09 3.91 -3.19 0.00 -0.66 -2.64 105.19 106.70 1haj n GLY 43 Ca -0.12 -0.84 -0.28 0.00 0.00 0.00 0.00 46.02 44.78 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 -3.39 -1.85 -0.02 0.00 0.00 -0.23 -4.69 121.76 111.58 1haj s ALA 45 Ca 0.60 1.53 0.01 0.00 0.00 0.00 0.00 51.96 54.11 1haj s ALA 45 Cb -0.11 -0.49 -0.26 0.00 0.00 0.00 0.00 23.12 22.26 1haj s ALA 45 CO 0.47 -0.33 0.77 0.00 0.00 0.00 0.00 175.76 176.67 1haj h ALA 46 N 3.13 0.43 -3.61 0.00 0.00 -1.85 0.37 119.26 117.73 1haj h ALA 46 Ca -0.24 -1.23 -0.08 0.00 0.00 0.00 0.00 54.91 53.37 1haj h ALA 46 Cb 1.15 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1haj h ALA 46 CO 0.31 1.29 -0.06 0.25 0.00 0.00 0.00 179.25 181.03 1haj n THR 47 N -3.34 0.00 -3.78 0.00 -2.24 -1.26 -4.69 114.28 98.97 1haj n THR 47 Ca -0.17 -0.33 -0.28 0.00 -2.27 0.00 0.00 64.05 61.00 1haj n THR 47 Cb 1.04 0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 69.28 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 -1.55 2.97 -0.22 0.00 0.04 -1.26 -5.06 135.00 129.92 1haj s PRO 49 Ca 0.28 0.57 -0.28 0.00 0.04 0.00 0.00 61.00 61.61 1haj s PRO 49 Cb 0.00 -2.02 0.14 0.00 0.04 0.00 0.00 34.50 32.65 1haj s PRO 49 CO -0.14 -0.98 1.08 -1.12 0.04 0.00 0.00 177.00 175.87 1haj s SER 50 N -4.24 -0.33 -0.20 6.66 0.01 -1.26 -4.69 113.70 109.64 1haj s SER 50 Ca 0.58 0.48 0.06 0.00 1.31 0.00 0.00 55.95 58.38 1haj s SER 50 Cb -0.11 0.43 0.20 0.00 0.21 0.00 0.00 66.02 66.75 1haj s SER 50 CO 0.53 -0.23 1.05 1.17 0.41 0.00 0.00 173.24 176.17 1haj n LYS 51 N 1.21 0.67 -3.56 12.44 3.00 -1.26 -5.12 118.16 125.53 1haj n LYS 51 Ca -0.10 -0.70 -0.00 0.00 -0.00 0.00 0.00 58.31 57.51 1haj n LYS 51 Cb 0.57 0.18 -0.04 0.00 0.00 0.00 0.00 35.03 35.74 1haj n LYS 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1haj s LYS 52 N 0.07 0.48 0.09 1.64 -0.14 -1.25 -5.03 119.74 115.61 1haj s LYS 52 Ca 0.06 1.18 -0.26 0.00 -1.36 0.00 0.00 55.97 55.59 1haj s LYS 52 Cb 0.22 0.69 -0.13 0.00 -1.68 0.00 0.00 37.83 36.93 1haj s LYS 52 CO -0.06 -0.16 1.69 -1.35 -0.76 0.00 0.00 175.35 174.71 1haj h PRO 53 N 7.75 -0.31 0.00 -1.68 0.11 -2.02 -3.05 132.00 132.81 1haj h PRO 53 Ca -0.18 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.82 1haj h PRO 53 Cb 1.11 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1haj h PRO 53 CO 0.10 -0.20 -0.68 1.88 -0.21 0.00 0.00 178.00 178.89 1haj h TYR 54 N -0.32 0.00 -3.49 0.65 0.05 -1.97 -3.40 116.97 108.48 1haj h TYR 54 Ca -0.01 0.00 -0.70 0.00 0.05 0.00 0.00 58.73 58.07 1haj h TYR 54 Cb 0.29 0.00 -0.34 0.00 1.01 0.00 0.00 36.73 37.69 1haj h TYR 54 CO -0.11 0.62 -0.42 -1.21 -1.05 0.00 0.00 178.16 176.00 1haj s GLU 55 N -2.90 2.39 0.18 4.88 2.02 -1.15 -4.39 118.70 119.73 1haj s GLU 55 Ca 0.03 -2.14 0.07 0.00 0.02 0.00 0.00 54.97 52.95 1haj s GLU 55 Cb 0.08 -3.74 -0.04 0.00 0.10 0.00 0.00 34.13 30.53 1haj s GLU 55 CO 0.77 -1.15 -0.15 -1.21 0.02 0.00 0.00 175.26 173.55 1haj s GLU 56 N 0.62 1.25 -0.08 1.61 2.02 -1.21 -3.78 118.70 119.13 1haj s GLU 56 Ca 0.12 -1.50 0.04 0.00 0.02 0.00 0.00 54.97 53.65 1haj s GLU 56 Cb -0.22 -1.07 0.00 0.00 0.10 0.00 0.00 34.13 32.94 1haj s GLU 56 CO -0.04 0.19 -0.21 0.14 0.02 0.00 0.00 175.26 175.36 1haj s VAL 57 N -2.76 1.78 -0.35 2.63 -7.23 -1.26 -2.07 120.40 111.15 1haj s VAL 57 Ca 0.19 -0.87 -0.21 0.00 -1.81 0.00 0.00 61.98 59.28 1haj s VAL 57 Cb -0.02 -1.54 0.00 0.00 0.56 0.00 0.00 36.38 35.38 1haj s VAL 57 CO 0.06 0.50 0.67 0.42 -0.31 0.00 0.00 175.10 176.44 1haj s THR 58 N 0.32 4.86 -0.10 5.32 -4.23 0.51 -4.82 115.64 117.51 1haj s THR 58 Ca -0.15 0.72 -0.02 0.00 -1.18 0.00 0.00 61.69 61.07 1haj s THR 58 Cb -0.16 -4.09 -0.03 0.00 1.34 0.00 0.00 72.50 69.55 1haj s THR 58 CO 0.06 -0.30 0.00 0.00 -0.54 0.00 0.00 174.62 173.84 1haj n SER 61 N -1.40 3.20 -3.94 0.00 3.41 -1.26 -2.42 113.62 111.21 1haj n SER 61 Ca 0.00 -3.09 -0.10 0.00 -0.26 0.00 0.00 58.87 55.43 1haj n SER 61 Cb 0.64 -0.46 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 1haj n SER 61 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1haj s THR 62 N -4.30 0.12 0.36 6.66 -1.32 -1.26 -5.06 115.64 110.85 1haj s THR 62 Ca 0.38 -1.00 -0.28 0.00 -1.21 0.00 0.00 61.69 59.58 1haj s THR 62 Cb 0.40 -0.68 -0.11 0.00 -1.51 0.00 0.00 72.50 70.60 1haj s THR 62 CO -0.04 -0.55 1.43 -1.81 -2.21 0.00 0.00 174.62 171.44 1haj s ASP 63 N -1.85 6.46 -1.61 8.08 1.11 -1.26 -2.53 116.67 125.07 1haj s ASP 63 Ca -0.09 2.94 -0.17 0.00 0.18 0.00 0.00 52.55 55.42 1haj s ASP 63 Cb -0.04 -2.66 0.14 0.00 1.07 0.00 0.00 42.92 41.42 1haj s ASP 63 CO -0.03 -0.78 0.77 0.29 1.18 0.00 0.00 175.17 176.60 1haj n LYS 64 N 0.54 -3.53 0.05 8.23 5.02 0.21 -4.84 118.16 123.85 1haj n LYS 64 Ca 0.01 0.41 0.12 0.00 -2.02 0.00 0.00 58.31 56.83 1haj n LYS 64 Cb 0.40 -5.17 0.09 0.00 -0.02 0.00 0.00 35.03 30.33 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 -2.07 5.51 -4.93 0.00 6.94 -1.26 -4.93 115.26 114.52 1haj n ASN 66 Ca 0.02 -3.73 -0.25 0.00 -0.02 0.00 0.00 54.58 50.60 1haj n ASN 66 Cb 0.44 -0.70 0.04 0.00 -2.36 0.00 0.00 39.78 37.21 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 -3.73 2.71 0.28 -0.53 0.04 -1.26 -4.55 135.00 127.96 1haj s PRO 67 Ca 0.48 -0.23 -0.30 0.00 0.04 0.00 0.00 61.00 60.98 1haj s PRO 67 Cb 0.34 -2.31 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 1haj s PRO 67 CO -0.20 -0.78 1.54 1.58 0.04 0.00 0.00 177.00 179.17 1haj n HIS 68 N -2.57 2.67 -0.23 0.56 -0.00 -1.26 -4.90 115.22 109.48 1haj n HIS 68 Ca 0.05 0.31 -0.01 0.00 -0.00 0.00 0.00 57.72 58.08 1haj n HIS 68 Cb 0.59 -2.55 0.11 0.00 -0.00 0.00 0.00 29.99 28.13 1haj n HIS 68 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1haj h PRO 69 N 4.51 0.63 -0.67 1.57 0.11 -2.00 -2.26 132.00 133.89 1haj h PRO 69 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1haj h PRO 69 Cb 1.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1haj h PRO 69 CO 0.77 0.41 0.05 1.63 -0.21 0.00 0.00 178.00 180.66 1haj n LYS 70 N -4.82 4.23 -3.15 1.05 4.76 -1.26 -4.93 118.16 114.04 1haj n LYS 70 Ca 0.09 -2.76 -0.39 0.00 -2.87 0.00 0.00 58.31 52.38 1haj n LYS 70 Cb 0.20 -2.17 -0.05 0.00 -1.84 0.00 0.00 35.03 31.17 1haj n LYS 70 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1haj s GLN 71 N -2.58 4.39 -0.33 1.97 0.74 -0.85 -4.98 119.66 118.01 1haj s GLN 71 Ca 0.48 0.74 -0.31 0.00 0.05 0.00 0.00 55.36 56.32 1haj s GLN 71 Cb 0.37 -3.42 -0.08 0.00 1.10 0.00 0.00 33.01 30.98 1haj s GLN 71 CO 0.14 0.16 2.25 -2.13 -0.55 0.00 0.00 175.29 175.15 1haj n ARG 72 N 3.50 1.43 -1.84 1.67 0.63 -1.26 -4.93 116.66 115.86 1haj n ARG 72 Ca -0.04 0.36 -0.33 0.00 -0.92 0.00 0.00 57.85 56.91 1haj n ARG 72 Cb 0.51 -2.89 0.04 0.00 0.45 0.00 0.00 32.46 30.57 1haj n ARG 72 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1haj s PRO 73 N 6.60 2.89 0.00 -0.14 0.04 -1.26 -5.15 135.00 137.98 1haj s PRO 73 Ca 1.05 1.44 0.21 0.00 0.04 0.00 0.00 61.00 63.74 1haj s PRO 73 Cb -0.56 -1.96 0.17 0.00 0.04 0.00 0.00 34.50 32.19 1haj s PRO 73 CO 0.40 -1.19 1.16 0.41 0.04 0.00 0.00 177.00 177.83