#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 1.60 0.32 9.51 1.01 -1.26 -1.26 120.40 130.31 1haj s VAL 2 Ca 0.00 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.36 1haj s VAL 2 Cb 0.00 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 1haj s VAL 2 CO 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 175.10 175.47 1haj s HIS 4 N -2.75 3.48 0.07 0.00 3.76 -1.26 -1.95 115.29 116.64 1haj s HIS 4 Ca 0.31 0.60 0.04 0.00 -0.15 0.00 0.00 55.06 55.86 1haj s HIS 4 Cb 0.02 -2.07 -0.03 0.00 1.11 0.00 0.00 32.58 31.61 1haj s HIS 4 CO 0.15 0.20 -0.11 -0.08 -0.85 0.00 0.00 174.74 174.05 1haj s THR 5 N -2.05 0.89 -0.08 1.30 -1.32 0.43 -2.62 115.64 112.19 1haj s THR 5 Ca 0.43 -1.37 0.13 0.00 -1.21 0.00 0.00 61.69 59.67 1haj s THR 5 Cb -0.11 -1.05 0.25 0.00 -1.51 0.00 0.00 72.50 70.08 1haj s THR 5 CO 0.30 -0.39 1.12 0.35 -2.21 0.00 0.00 174.62 173.78 1haj n THR 6 N 1.06 0.99 0.01 5.08 -2.24 -1.26 -2.65 114.28 115.27 1haj n THR 6 Ca -0.20 -1.49 0.02 0.00 -2.27 0.00 0.00 64.05 60.11 1haj n THR 6 Cb 0.56 0.23 0.19 0.00 -2.10 0.00 0.00 70.33 69.21 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 -0.56 3.32 -4.05 6.98 0.00 -1.26 -4.88 120.51 120.06 1haj n ALA 7 Ca 0.10 -1.03 -0.18 0.00 0.00 0.00 0.00 53.44 52.33 1haj n ALA 7 Cb 0.76 -1.09 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 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 0.24 0.00 0.17 0.00 -2.24 -1.26 -5.09 114.28 106.11 1haj n THR 8 Ca 0.16 -1.60 -0.07 0.00 -2.27 0.00 0.00 64.05 60.26 1haj n THR 8 Cb 0.78 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.62 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 1.17 -0.40 -3.45 3.42 0.87 -1.99 -3.45 113.55 109.72 1haj h SER 9 Ca -0.20 0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.20 1haj h SER 9 Cb 0.81 0.10 0.05 0.00 -0.44 0.00 0.00 62.40 62.93 1haj h SER 9 CO 0.31 -0.14 0.11 -0.81 -0.53 0.00 0.00 176.83 175.76 1haj n PRO 10 N -4.07 -0.10 -3.35 2.24 -0.04 -1.26 -5.07 135.00 123.35 1haj n PRO 10 Ca -0.06 -0.96 -0.31 0.00 -0.04 0.00 0.00 63.50 62.13 1haj n PRO 10 Cb 0.19 -0.41 -0.05 0.00 -0.04 0.00 0.00 33.50 33.19 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 -1.64 4.93 0.01 0.52 1.01 -1.26 -4.83 121.20 119.94 1haj s ILE 11 Ca 0.29 0.41 -0.11 0.00 0.00 0.00 0.00 60.65 61.23 1haj s ILE 11 Cb -0.01 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.82 1haj s ILE 11 CO 0.20 -0.16 0.23 -0.94 0.00 0.00 0.00 174.94 174.27 1haj s SER 12 N -2.58 -0.06 -0.02 3.58 1.04 -1.08 -5.01 113.70 109.57 1haj s SER 12 Ca 0.47 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.74 1haj s SER 12 Cb -0.11 0.28 0.01 0.00 0.10 0.00 0.00 66.02 66.31 1haj s SER 12 CO 0.24 -0.49 -0.02 0.00 0.98 0.00 0.00 173.24 173.95 1haj s ALA 13 N -1.90 0.36 0.07 5.32 0.00 -1.26 0.16 121.76 124.51 1haj s ALA 13 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.85 1haj s ALA 13 Cb -0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 1haj s ALA 13 CO 0.00 0.01 0.01 1.55 0.00 0.00 0.00 175.76 177.33 1haj n VAL 14 N 3.58 0.00 -4.04 0.00 3.14 -0.82 -4.95 118.33 115.24 1haj n VAL 14 Ca -0.20 -0.35 -0.32 0.00 -2.96 0.00 0.00 64.34 60.51 1haj n VAL 14 Cb 0.54 0.10 -0.15 0.00 -1.06 0.00 0.00 33.84 33.27 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 -1.51 2.28 0.24 1.55 2.01 -1.26 -1.83 115.64 117.12 1haj s THR 15 Ca 0.01 -1.79 -0.31 0.00 0.31 0.00 0.00 61.69 59.91 1haj s THR 15 Cb 0.00 -2.43 -0.13 0.00 0.01 0.00 0.00 72.50 69.96 1haj s THR 15 CO 0.01 -0.18 1.50 0.00 -0.69 0.00 0.00 174.62 175.26 1haj s PRO 17 N -0.14 -2.25 -0.08 0.00 0.04 -1.26 -4.00 135.00 127.31 1haj s PRO 17 Ca 0.69 0.23 -0.21 0.00 0.04 0.00 0.00 61.00 61.75 1haj s PRO 17 Cb -0.60 -1.45 -0.25 0.00 0.04 0.00 0.00 34.50 32.23 1haj s PRO 17 CO 0.46 -4.45 1.47 -0.35 0.04 0.00 0.00 177.00 174.17 1haj n PRO 18 N -5.34 0.16 0.00 0.56 -0.04 -1.26 -2.54 135.00 126.54 1haj n PRO 18 Ca 0.11 -0.94 0.00 0.00 -0.04 0.00 0.00 63.50 62.63 1haj n PRO 18 Cb 0.59 -2.39 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 1haj n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1haj n GLY 19 N 4.67 -0.09 3.54 0.55 0.00 -1.26 -5.12 105.19 107.47 1haj n GLY 19 Ca 0.35 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.96 1haj n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1haj s GLU 20 N -1.39 3.08 0.00 1.61 8.01 -1.05 -4.55 118.70 124.40 1haj s GLU 20 Ca 0.00 -0.55 0.00 0.00 0.01 0.00 0.00 54.97 54.43 1haj s GLU 20 Cb 0.00 -2.69 0.00 0.00 -4.31 0.00 0.00 34.13 27.13 1haj s GLU 20 CO 0.00 0.50 0.00 0.09 0.01 0.00 0.00 175.26 175.86 1haj n ASN 21 N 2.71 1.75 -4.87 -0.19 4.13 -1.11 -4.19 115.26 113.49 1haj n ASN 21 Ca -0.18 -0.16 -0.21 0.00 1.68 0.00 0.00 54.58 55.71 1haj n ASN 21 Cb 0.53 0.68 -0.03 0.00 -1.54 0.00 0.00 39.78 39.41 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 -1.71 3.70 0.18 3.41 1.43 0.33 -4.48 118.68 121.53 1haj s LEU 22 Ca 0.00 -0.41 0.09 0.00 -1.03 0.00 0.00 54.13 52.78 1haj s LEU 22 Cb 0.00 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 1haj s LEU 22 CO 0.00 -0.33 -0.19 0.00 0.23 0.00 0.00 176.35 176.06 1haj s TYR 24 N -2.11 1.14 -0.14 0.00 -0.85 0.32 -0.63 117.35 115.08 1haj s TYR 24 Ca 0.18 -0.31 -0.03 0.00 -0.52 0.00 0.00 57.07 56.39 1haj s TYR 24 Cb -0.06 -0.69 0.05 0.00 0.38 0.00 0.00 41.96 41.64 1haj s TYR 24 CO 0.08 0.01 0.04 0.50 -1.52 0.00 0.00 175.55 174.66 1haj s ARG 25 N -0.89 0.46 0.05 -3.49 3.52 -0.55 -0.78 118.95 117.28 1haj s ARG 25 Ca 0.02 -0.11 -0.19 0.00 -0.13 0.00 0.00 55.73 55.32 1haj s ARG 25 Cb -0.07 -1.55 -0.06 0.00 -1.56 0.00 0.00 34.95 31.71 1haj s ARG 25 CO 0.01 -0.51 0.56 0.21 -0.81 0.00 0.00 175.30 174.75 1haj s LYS 26 N 1.98 4.20 -0.03 5.12 2.20 -0.83 -1.72 119.74 130.66 1haj s LYS 26 Ca 0.02 0.71 -0.02 0.00 -0.36 0.00 0.00 55.97 56.32 1haj s LYS 26 Cb -0.15 -3.26 0.01 0.00 -1.51 0.00 0.00 37.83 32.93 1haj s LYS 26 CO -0.07 0.60 0.06 -1.64 -0.36 0.00 0.00 175.35 173.94 1haj s MET 27 N -0.94 0.05 -0.30 4.03 -1.94 -0.38 -0.91 119.30 118.91 1haj s MET 27 Ca 0.29 0.14 -0.15 0.00 -1.71 0.00 0.00 55.69 54.25 1haj s MET 27 Cb -0.19 -0.05 0.16 0.00 2.01 0.00 0.00 34.83 36.77 1haj s MET 27 CO 0.18 -0.06 1.00 1.67 -0.01 0.00 0.00 175.02 177.80 1haj s TRP 28 N 0.36 -0.64 -0.26 -0.03 1.48 -1.12 -0.95 118.94 117.78 1haj s TRP 28 Ca -0.03 1.13 -0.33 0.00 -1.06 0.00 0.00 56.10 55.80 1haj s TRP 28 Cb -0.04 0.38 -0.10 0.00 -1.16 0.00 0.00 33.47 32.55 1haj s TRP 28 CO -0.01 -0.32 2.12 0.00 -4.06 0.00 0.00 176.95 174.68 1haj s ASP 30 N 6.78 6.53 0.00 0.00 1.47 0.33 -4.63 116.67 127.15 1haj s ASP 30 Ca 1.04 2.04 0.00 0.00 1.18 0.00 0.00 52.55 56.80 1haj s ASP 30 Cb -0.70 -2.58 0.00 0.00 -0.34 0.00 0.00 42.92 39.30 1haj s ASP 30 CO 0.47 -0.65 0.00 0.00 0.68 0.00 0.00 175.17 175.66 1haj n ALA 31 N -0.44 0.00 -1.62 2.11 0.00 -1.26 -1.64 120.51 117.66 1haj n ALA 31 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 1haj n ALA 31 Cb 0.50 0.00 -0.02 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 1.70 0.00 -0.47 0.00 3.01 -1.26 -4.90 117.46 115.54 1haj n PHE 32 Ca 0.00 -0.14 0.39 0.00 1.01 0.00 0.00 57.45 58.71 1haj n PHE 32 Cb 0.00 0.31 0.60 0.00 -0.01 0.00 0.00 39.48 40.38 1haj n PHE 32 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1haj h SER 34 N 0.00 -0.06 0.00 0.00 0.02 -1.94 -3.40 113.55 108.17 1haj h SER 34 Ca 0.69 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1haj h SER 34 Cb 3.11 0.02 0.00 0.00 0.14 0.00 0.00 62.40 65.67 1haj h SER 34 CO -0.01 0.66 0.00 -1.54 -1.14 0.00 0.00 176.83 174.80 1haj n SER 35 N -4.77 0.00 0.00 3.07 3.41 0.36 -4.88 113.62 110.81 1haj n SER 35 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1haj n SER 35 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1haj n SER 35 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1haj n ARG 36 N -1.02 0.00 0.00 4.33 5.12 0.45 -4.97 116.66 120.58 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 -0.16 3.32 -0.13 0.00 0.41 -4.70 105.19 104.83 1haj n GLY 37 Ca 0.00 -1.05 -0.52 0.00 0.00 0.00 0.00 46.02 44.44 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 3.68 0.00 -2.14 1.61 4.01 -1.24 0.12 118.16 124.20 1haj n LYS 38 Ca 0.00 0.00 -0.40 0.00 -0.51 0.00 0.00 58.31 57.40 1haj n LYS 38 Cb 0.00 -1.49 -0.01 0.00 -0.51 0.00 0.00 35.03 33.02 1haj n LYS 38 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1haj s VAL 39 N 7.10 2.79 -0.21 -0.18 1.01 0.28 -4.57 120.40 126.63 1haj s VAL 39 Ca 1.25 0.72 -0.05 0.00 0.00 0.00 0.00 61.98 63.91 1haj s VAL 39 Cb -1.40 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 31.53 1haj s VAL 39 CO 0.59 0.12 -0.00 -0.69 0.00 0.00 0.00 175.10 175.12 1haj s VAL 40 N -1.25 3.90 0.20 2.92 1.01 -1.26 -2.79 120.40 123.12 1haj s VAL 40 Ca 0.54 -0.33 0.09 0.00 0.00 0.00 0.00 61.98 62.28 1haj s VAL 40 Cb -0.37 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 1haj s VAL 40 CO 0.48 0.42 -0.17 -0.70 0.00 0.00 0.00 175.10 175.13 1haj s GLU 41 N 1.09 1.34 0.12 2.72 2.56 -0.08 -4.95 118.70 121.50 1haj s GLU 41 Ca 0.02 -1.53 0.02 0.00 0.00 0.00 0.00 54.97 53.48 1haj s GLU 41 Cb -0.14 -1.28 -0.04 0.00 2.00 0.00 0.00 34.13 34.66 1haj s GLU 41 CO 0.01 0.24 -0.04 -0.51 -0.56 0.00 0.00 175.26 174.40 1haj s LEU 42 N -3.05 2.37 0.00 2.70 1.02 -1.26 -1.96 118.68 118.50 1haj s LEU 42 Ca 0.20 -1.06 0.00 0.00 0.02 0.00 0.00 54.13 53.29 1haj s LEU 42 Cb -0.03 -0.07 0.00 0.00 0.02 0.00 0.00 46.19 46.11 1haj s LEU 42 CO 0.08 -0.50 0.00 0.61 0.02 0.00 0.00 176.35 176.56 1haj n GLY 43 N -0.11 1.38 3.63 -3.19 0.00 0.04 -4.39 105.19 102.55 1haj n GLY 43 Ca -0.10 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.02 -1.69 -0.61 0.00 0.00 0.25 -4.76 121.76 112.93 1haj s ALA 45 Ca 0.29 0.65 0.13 0.00 0.00 0.00 0.00 51.96 53.03 1haj s ALA 45 Cb -0.08 0.62 -0.15 0.00 0.00 0.00 0.00 23.12 23.51 1haj s ALA 45 CO 0.18 -0.78 0.56 0.00 0.00 0.00 0.00 175.76 175.72 1haj n ALA 46 N -0.33 3.70 -2.41 0.00 0.00 -1.26 0.12 120.51 120.32 1haj n ALA 46 Ca -0.11 -0.38 -0.20 0.00 0.00 0.00 0.00 53.44 52.75 1haj n ALA 46 Cb 0.62 -0.49 -0.10 0.00 0.00 0.00 0.00 19.45 19.48 1haj n ALA 46 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1haj s THR 47 N -2.31 1.12 -0.39 0.00 -1.32 -1.26 -4.76 115.64 106.71 1haj s THR 47 Ca 0.05 -2.01 0.01 0.00 -1.21 0.00 0.00 61.69 58.52 1haj s THR 47 Cb 0.10 -2.69 0.13 0.00 -1.51 0.00 0.00 72.50 68.53 1haj s THR 47 CO 0.55 -0.06 0.21 0.00 -2.21 0.00 0.00 174.62 173.11 1haj s PRO 49 N 0.77 1.53 0.34 0.00 0.04 -1.26 -5.01 135.00 131.42 1haj s PRO 49 Ca 0.17 0.68 -0.27 0.00 0.04 0.00 0.00 61.00 61.61 1haj s PRO 49 Cb -0.23 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1haj s PRO 49 CO -0.03 -2.01 1.14 -1.54 0.04 0.00 0.00 177.00 174.59 1haj s SER 50 N -3.68 6.92 0.14 6.66 1.04 -1.26 -4.98 113.70 118.55 1haj s SER 50 Ca 0.62 2.30 -0.04 0.00 0.48 0.00 0.00 55.95 59.32 1haj s SER 50 Cb -0.16 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.35 1haj s SER 50 CO 0.56 -0.39 0.25 0.29 0.98 0.00 0.00 173.24 174.92 1haj n LYS 51 N 0.63 0.36 -3.52 4.02 4.01 -1.26 -5.07 118.16 117.32 1haj n LYS 51 Ca 0.01 -0.93 -0.37 0.00 -0.51 0.00 0.00 58.31 56.52 1haj n LYS 51 Cb 0.46 1.04 -0.07 0.00 -0.51 0.00 0.00 35.03 35.95 1haj n LYS 51 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1haj s LYS 52 N -2.14 4.20 -0.98 1.97 1.02 -1.26 -4.99 119.74 117.56 1haj s LYS 52 Ca 0.08 0.15 -0.08 0.00 0.02 0.00 0.00 55.97 56.14 1haj s LYS 52 Cb -0.01 -3.40 -0.15 0.00 -0.52 0.00 0.00 37.83 33.74 1haj s LYS 52 CO 0.06 0.29 3.13 -0.35 -0.92 0.00 0.00 175.35 177.56 1haj n PRO 53 N 3.38 2.96 0.00 -1.68 -0.04 -1.26 -3.29 135.00 135.06 1haj n PRO 53 Ca -0.12 -1.70 0.00 0.00 -0.04 0.00 0.00 63.50 61.65 1haj n PRO 53 Cb 0.52 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1haj n PRO 53 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1haj n TYR 54 N 3.21 -0.57 -2.58 0.54 4.01 -1.26 -5.00 117.16 115.51 1haj n TYR 54 Ca 0.63 0.02 -0.27 0.00 -0.16 0.00 0.00 57.90 58.12 1haj n TYR 54 Cb 0.47 0.15 -0.01 0.00 -0.31 0.00 0.00 39.34 39.65 1haj n TYR 54 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 1haj n GLU 55 N -2.18 3.39 -0.89 -0.72 2.13 -1.25 -4.26 120.64 116.85 1haj n GLU 55 Ca 0.00 -4.57 0.00 0.00 0.66 0.00 0.00 57.16 53.25 1haj n GLU 55 Cb 0.00 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.46 1haj n GLU 55 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1haj n GLU 56 N -0.42 0.00 -3.88 5.31 -0.58 -0.13 -4.78 120.64 116.17 1haj n GLU 56 Ca 0.37 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.77 1haj n GLU 56 Cb 0.58 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.40 1haj n GLU 56 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1haj s VAL 57 N -2.99 5.45 -0.00 2.62 1.01 -1.26 -1.25 120.40 123.97 1haj s VAL 57 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.04 1haj s VAL 57 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1haj s VAL 57 CO 0.00 0.43 -0.17 0.28 0.00 0.00 0.00 175.10 175.64 1haj s THR 58 N -1.22 2.83 -0.08 3.92 -1.32 -0.70 -4.80 115.64 114.27 1haj s THR 58 Ca 0.23 -0.98 0.01 0.00 -1.21 0.00 0.00 61.69 59.73 1haj s THR 58 Cb -0.12 -2.14 -0.03 0.00 -1.51 0.00 0.00 72.50 68.70 1haj s THR 58 CO 0.13 0.47 -0.08 0.00 -2.21 0.00 0.00 174.62 172.93 1haj n SER 61 N 0.44 5.83 -3.91 0.00 3.41 -1.26 -1.15 113.62 116.98 1haj n SER 61 Ca -0.14 -3.72 -0.09 0.00 -0.26 0.00 0.00 58.87 54.65 1haj n SER 61 Cb 0.56 -0.78 -0.04 0.00 -0.26 0.00 0.00 64.21 63.68 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 -4.81 0.01 0.41 6.66 2.01 -1.26 -5.02 115.64 113.64 1haj s THR 62 Ca 0.47 -1.19 -0.22 0.00 0.31 0.00 0.00 61.69 61.05 1haj s THR 62 Cb 0.32 -2.00 -0.10 0.00 0.01 0.00 0.00 72.50 70.72 1haj s THR 62 CO -0.20 -0.05 0.96 -0.62 -0.69 0.00 0.00 174.62 174.02 1haj s ASP 63 N -2.96 6.96 -1.65 3.53 2.15 -1.26 -3.66 116.67 119.78 1haj s ASP 63 Ca 0.17 1.77 -0.20 0.00 0.43 0.00 0.00 52.55 54.72 1haj s ASP 63 Cb -0.01 -2.55 0.19 0.00 -0.30 0.00 0.00 42.92 40.24 1haj s ASP 63 CO 0.05 -0.34 0.59 0.29 -0.17 0.00 0.00 175.17 175.59 1haj n LYS 64 N -0.36 -1.65 0.02 4.34 4.76 -0.48 -4.79 118.16 120.00 1haj n LYS 64 Ca 0.06 0.20 0.12 0.00 -2.87 0.00 0.00 58.31 55.82 1haj n LYS 64 Cb 0.53 -4.82 0.15 0.00 -1.84 0.00 0.00 35.03 29.05 1haj n LYS 64 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1haj n ASN 66 N -1.80 5.30 -4.96 0.00 6.94 -1.26 -4.94 115.26 114.55 1haj n ASN 66 Ca 0.04 -3.75 -0.23 0.00 -0.02 0.00 0.00 54.58 50.63 1haj n ASN 66 Cb 0.39 -0.58 0.04 0.00 -2.36 0.00 0.00 39.78 37.26 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 -3.65 2.65 -0.12 -0.53 0.04 -1.26 -4.53 135.00 127.60 1haj s PRO 67 Ca 0.49 -0.57 -0.29 0.00 0.04 0.00 0.00 61.00 60.67 1haj s PRO 67 Cb 0.41 -2.44 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1haj s PRO 67 CO -0.23 -0.69 1.42 -1.58 0.04 0.00 0.00 177.00 175.96 1haj s HIS 68 N -2.81 2.51 0.54 0.56 2.46 -1.26 -4.90 115.29 112.39 1haj s HIS 68 Ca 0.55 0.68 0.32 0.00 0.47 0.00 0.00 55.06 57.09 1haj s HIS 68 Cb -0.10 -3.67 1.81 0.00 -0.13 0.00 0.00 32.58 30.49 1haj s HIS 68 CO 0.40 -2.56 2.21 -1.00 -2.47 0.00 0.00 174.74 171.32 1haj h PRO 69 N 8.70 0.00 -0.66 2.88 0.13 -2.01 -1.82 132.00 139.21 1haj h PRO 69 Ca -0.32 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.56 1haj h PRO 69 Cb 1.14 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.11 1haj h PRO 69 CO 0.96 0.04 0.26 1.63 -0.23 0.00 0.00 178.00 180.66 1haj n LYS 70 N -3.62 2.88 -2.34 0.86 4.76 -1.26 -4.98 118.16 114.45 1haj n LYS 70 Ca -0.03 -3.07 -0.42 0.00 -2.87 0.00 0.00 58.31 51.93 1haj n LYS 70 Cb 0.13 -2.08 -0.03 0.00 -1.84 0.00 0.00 35.03 31.22 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 -3.11 4.30 -0.06 1.97 0.74 -0.69 -5.01 119.66 117.81 1haj s GLN 71 Ca 0.52 1.81 -0.19 0.00 0.05 0.00 0.00 55.36 57.54 1haj s GLN 71 Cb 0.43 -3.60 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 1haj s GLN 71 CO 0.09 -0.54 0.54 0.50 -0.55 0.00 0.00 175.29 175.34 1haj s ARG 72 N 2.49 4.31 0.75 1.67 6.06 -1.26 -5.08 118.95 127.88 1haj s ARG 72 Ca 0.60 0.61 -0.13 0.00 -2.50 0.00 0.00 55.73 54.31 1haj s ARG 72 Cb -0.27 -3.38 0.18 0.00 0.06 0.00 0.00 34.95 31.54 1haj s ARG 72 CO 0.23 0.27 0.70 -0.35 -2.50 0.00 0.00 175.30 173.65 1haj n PRO 73 N 3.18 -2.15 -0.91 5.12 -0.04 -1.26 -5.25 135.00 133.69 1haj n PRO 73 Ca -0.07 -1.12 0.00 0.00 -0.04 0.00 0.00 63.50 62.28 1haj n PRO 73 Cb 0.51 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1haj n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87