#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsm n VAL 2 N 0.00 0.07 0.00 2.03 0.24 -1.26 -4.70 118.33 114.71 2dsm n VAL 2 Ca 0.00 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 2dsm n VAL 2 Cb 0.00 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 2dsm n VAL 2 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2dsm n GLU 3 N 0.56 0.00 -2.51 7.34 4.71 -1.26 -5.04 120.64 124.44 2dsm n GLU 3 Ca 0.06 0.42 -0.05 0.00 -0.01 0.00 0.00 57.16 57.58 2dsm n GLU 3 Cb 0.26 -1.22 -0.04 0.00 -1.01 0.00 0.00 31.44 29.43 2dsm n GLU 3 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2dsm n ASN 4 N -1.75 -1.15 -4.56 1.62 3.02 -1.26 -4.85 115.26 106.33 2dsm n ASN 4 Ca 0.00 1.24 -0.39 0.00 -0.03 0.00 0.00 54.58 55.40 2dsm n ASN 4 Cb 0.00 -4.93 -0.03 0.00 -0.61 0.00 0.00 39.78 34.21 2dsm n ASN 4 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2dsm s PRO 5 N -0.79 2.80 -0.13 3.52 0.04 -1.26 -4.96 135.00 134.23 2dsm s PRO 5 Ca -0.24 0.54 -0.29 0.00 0.04 0.00 0.00 61.00 61.04 2dsm s PRO 5 Cb 0.02 -4.33 -0.03 0.00 0.04 0.00 0.00 34.50 30.20 2dsm s PRO 5 CO 0.73 -2.53 1.49 0.00 0.04 0.00 0.00 177.00 176.73 2dsm s MET 6 N 6.65 4.14 0.39 4.56 0.23 -1.26 -4.89 119.30 129.12 2dsm s MET 6 Ca 0.63 1.89 0.23 0.00 -1.03 0.00 0.00 55.69 57.40 2dsm s MET 6 Cb -0.12 -3.91 0.27 0.00 -1.53 0.00 0.00 34.83 29.53 2dsm s MET 6 CO 0.21 -0.87 1.49 -0.24 -2.03 0.00 0.00 175.02 173.58 2dsm h VAL 7 N 5.64 0.01 -4.39 5.16 3.04 -2.04 -3.45 116.25 120.21 2dsm h VAL 7 Ca -0.33 -1.01 -0.60 0.00 -1.01 0.00 0.00 66.70 63.75 2dsm h VAL 7 Cb 1.14 1.90 -0.30 0.00 -2.01 0.00 0.00 31.29 32.02 2dsm h VAL 7 CO 0.97 0.00 -0.85 -0.51 -1.01 0.00 0.00 177.57 176.17 2dsm s ILE 8 N -3.24 1.60 0.09 3.17 2.07 -1.26 -5.14 121.20 118.49 2dsm s ILE 8 Ca 0.05 -0.86 0.09 0.00 -1.41 0.00 0.00 60.65 58.52 2dsm s ILE 8 Cb 0.06 -1.33 -0.03 0.00 0.13 0.00 0.00 42.46 41.29 2dsm s ILE 8 CO 0.70 0.45 -0.24 0.20 -1.91 0.00 0.00 174.94 174.14 2dsm s ASN 9 N -0.45 2.91 -0.42 4.50 0.01 -1.26 -5.11 114.94 115.12 2dsm s ASN 9 Ca 0.07 -0.65 -0.13 0.00 -0.71 0.00 0.00 52.86 51.44 2dsm s ASN 9 Cb -0.08 -0.21 0.04 0.00 0.41 0.00 0.00 41.25 41.41 2dsm s ASN 9 CO -0.01 0.16 0.29 0.21 -1.51 0.00 0.00 177.10 176.24 2dsm s ASN 10 N -1.66 5.93 -0.61 -1.22 3.84 -1.26 -5.04 114.94 114.93 2dsm s ASN 10 Ca 0.10 -1.13 -0.18 0.00 0.21 0.00 0.00 52.86 51.86 2dsm s ASN 10 Cb -0.10 -2.10 0.11 0.00 -0.55 0.00 0.00 41.25 38.62 2dsm s ASN 10 CO 0.04 -0.49 0.70 0.26 -2.79 0.00 0.00 177.10 174.82 2dsm s TRP 11 N 1.59 3.08 -0.11 0.43 0.51 -1.26 -5.04 118.94 118.14 2dsm s TRP 11 Ca 0.03 -1.08 -0.04 0.00 -2.12 0.00 0.00 56.10 52.89 2dsm s TRP 11 Cb -0.21 -3.99 -0.04 0.00 -0.81 0.00 0.00 33.47 28.42 2dsm s TRP 11 CO 0.07 -1.25 0.06 -3.38 -0.51 0.00 0.00 176.95 171.93 2dsm s HIS 12 N 2.41 3.32 -1.03 -1.98 -3.43 -1.26 -5.03 115.29 108.29 2dsm s HIS 12 Ca 0.12 0.29 -0.23 0.00 -0.80 0.00 0.00 55.06 54.44 2dsm s HIS 12 Cb -0.23 -1.88 0.04 0.00 -1.43 0.00 0.00 32.58 29.08 2dsm s HIS 12 CO 0.04 0.52 1.53 0.34 -2.00 0.00 0.00 174.74 175.17 2dsm s ASP 13 N -0.76 6.37 0.00 7.38 2.15 -1.26 -4.81 116.67 125.74 2dsm s ASP 13 Ca 0.12 -1.46 0.00 0.00 0.43 0.00 0.00 52.55 51.64 2dsm s ASP 13 Cb -0.12 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 2dsm s ASP 13 CO 0.03 -1.62 0.00 0.29 -0.17 0.00 0.00 175.17 173.69 2dsm n LYS 14 N 8.84 0.00 -0.10 4.34 5.02 -1.26 -5.09 118.16 129.91 2dsm n LYS 14 Ca 0.35 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.52 2dsm n LYS 14 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.47 2dsm n LYS 14 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2dsm n LEU 15 N 0.00 1.91 -4.90 -0.35 4.32 -1.26 -4.97 117.00 111.75 2dsm n LEU 15 Ca 0.00 0.41 -0.31 0.00 -0.02 0.00 0.00 56.01 56.08 2dsm n LEU 15 Cb 0.00 -0.80 -0.05 0.00 -1.62 0.00 0.00 43.42 40.95 2dsm n LEU 15 CO 0.00 -0.13 0.02 -0.89 -1.22 0.00 0.00 177.39 175.16 2dsm s THR 16 N -2.66 5.18 -0.49 -5.08 2.01 -1.26 -5.06 115.64 108.28 2dsm s THR 16 Ca -0.28 0.01 -0.16 0.00 0.31 0.00 0.00 61.69 61.58 2dsm s THR 16 Cb 0.06 -3.62 0.09 0.00 0.01 0.00 0.00 72.50 69.03 2dsm s THR 16 CO 0.40 0.05 0.43 -1.61 -0.69 0.00 0.00 174.62 173.21 2dsm s GLU 17 N -2.64 2.99 1.12 4.92 0.41 -1.26 -4.95 118.70 119.29 2dsm s GLU 17 Ca 0.41 -1.44 0.00 0.00 -0.41 0.00 0.00 54.97 53.53 2dsm s GLU 17 Cb -0.12 -4.18 0.00 0.00 -1.78 0.00 0.00 34.13 28.05 2dsm s GLU 17 CO 0.25 -1.12 0.00 0.25 -0.49 0.00 0.00 175.26 174.14 2dsm n THR 18 N 5.23 0.00 -0.36 3.63 -2.24 -1.26 0.21 114.28 119.48 2dsm n THR 18 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2dsm n THR 18 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2dsm n THR 18 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dsm n ASP 19 N 2.72 1.21 -4.54 3.42 5.75 -1.26 -4.95 116.55 118.90 2dsm n ASP 19 Ca 0.00 -1.57 -0.43 0.00 -0.01 0.00 0.00 54.79 52.79 2dsm n ASP 19 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 2dsm n ASP 19 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2dsm s VAL 20 N -0.57 4.24 0.24 2.12 1.01 0.13 -4.67 120.40 122.90 2dsm s VAL 20 Ca 0.00 -1.60 0.07 0.00 0.00 0.00 0.00 61.98 60.44 2dsm s VAL 20 Cb 0.00 -5.07 -0.04 0.00 0.00 0.00 0.00 36.38 31.27 2dsm s VAL 20 CO 0.00 -1.89 0.21 0.00 0.00 0.00 0.00 175.10 173.42 2dsm s GLN 21 N 3.95 2.97 0.04 2.72 -2.07 -1.24 -4.42 119.66 121.61 2dsm s GLN 21 Ca 0.48 -1.01 0.07 0.00 -1.82 0.00 0.00 55.36 53.08 2dsm s GLN 21 Cb 0.01 -2.60 -0.02 0.00 -1.09 0.00 0.00 33.01 29.30 2dsm s GLN 21 CO -0.01 0.41 -0.20 0.42 -1.32 0.00 0.00 175.29 174.59 2dsm s ILE 22 N -2.08 1.64 0.58 3.63 1.01 -1.26 -0.08 121.20 124.64 2dsm s ILE 22 Ca 0.33 -1.17 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 2dsm s ILE 22 Cb -0.08 -1.43 0.12 0.00 0.01 0.00 0.00 42.46 41.09 2dsm s ILE 22 CO 0.25 0.21 0.80 -0.90 0.00 0.00 0.00 174.94 175.30 2dsm n ASP 23 N 1.89 0.65 -0.24 3.58 5.75 -1.05 -4.63 116.55 122.50 2dsm n ASP 23 Ca -0.17 -1.65 0.06 0.00 -0.01 0.00 0.00 54.79 53.03 2dsm n ASP 23 Cb 0.53 -0.55 0.32 0.00 -1.03 0.00 0.00 41.12 40.39 2dsm n ASP 23 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2dsm h PHE 24 N -0.90 0.86 -0.46 2.11 3.04 0.41 -2.72 116.94 119.29 2dsm h PHE 24 Ca -0.26 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 61.65 2dsm h PHE 24 Cb 0.86 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 39.07 2dsm h PHE 24 CO 0.00 0.44 0.05 -0.92 -2.02 0.00 0.00 178.31 175.85 2dsm h TYR 25 N 0.83 0.83 0.00 0.41 3.20 -1.94 -3.47 116.97 116.84 2dsm h TYR 25 Ca 0.36 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2dsm h TYR 25 Cb 0.31 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.36 2dsm h TYR 25 CO -0.00 0.79 0.00 0.41 -1.64 0.00 0.00 178.16 177.72 2dsm n GLY 26 N -0.46 1.73 3.80 1.82 0.00 -1.03 -5.13 105.19 105.92 2dsm n GLY 26 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2dsm n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dsm s ASP 27 N -2.00 5.43 0.11 1.61 -1.08 -1.26 -4.92 116.67 114.56 2dsm s ASP 27 Ca 0.00 -0.25 -0.30 0.00 -0.52 0.00 0.00 52.55 51.47 2dsm s ASP 27 Cb 0.00 -1.36 -0.06 0.00 -1.46 0.00 0.00 42.92 40.03 2dsm s ASP 27 CO 0.00 -0.01 1.17 -1.61 0.52 0.00 0.00 175.17 175.24 2dsm s GLU 28 N -3.63 4.48 -0.56 4.34 2.02 -1.26 -2.54 118.70 121.55 2dsm s GLU 28 Ca 0.32 1.76 -0.08 0.00 0.02 0.00 0.00 54.97 56.99 2dsm s GLU 28 Cb -0.08 -3.32 0.14 0.00 0.10 0.00 0.00 34.13 30.97 2dsm s GLU 28 CO 0.24 -0.14 0.43 0.08 0.02 0.00 0.00 175.26 175.88 2dsm s VAL 29 N 0.57 4.27 0.52 2.63 1.01 0.88 -4.92 120.40 125.36 2dsm s VAL 29 Ca 0.55 -2.18 0.06 0.00 0.00 0.00 0.00 61.98 60.41 2dsm s VAL 29 Cb -0.30 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.35 2dsm s VAL 29 CO 0.32 -0.84 0.72 0.42 0.00 0.00 0.00 175.10 175.72 2dsm s THR 30 N 0.83 2.62 -1.27 3.92 -4.23 -1.26 -3.59 115.64 112.66 2dsm s THR 30 Ca 0.10 -0.87 0.03 0.00 -1.18 0.00 0.00 61.69 59.78 2dsm s THR 30 Cb -0.22 -2.76 0.05 0.00 1.34 0.00 0.00 72.50 70.91 2dsm s THR 30 CO -0.03 0.00 0.99 -0.81 -0.54 0.00 0.00 174.62 174.24 2dsm n PRO 31 N -2.18 0.03 0.00 3.99 -0.04 -1.26 -0.54 135.00 134.99 2dsm n PRO 31 Ca 0.11 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 64.02 2dsm n PRO 31 Cb 0.60 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.78 2dsm n PRO 31 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2dsm n VAL 32 N -1.37 0.00 -4.22 0.52 0.31 -1.26 -4.89 118.33 107.41 2dsm n VAL 32 Ca 0.01 -0.43 -0.34 0.00 -0.01 0.00 0.00 64.34 63.58 2dsm n VAL 32 Cb 0.03 1.21 -0.11 0.00 -0.91 0.00 0.00 33.84 34.06 2dsm n VAL 32 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2dsm s ASP 33 N -2.01 5.23 -0.50 4.52 1.01 0.29 -5.06 116.67 120.15 2dsm s ASP 33 Ca 0.31 0.00 -0.28 0.00 0.71 0.00 0.00 52.55 53.29 2dsm s ASP 33 Cb 0.20 -1.82 0.03 0.00 1.01 0.00 0.00 42.92 42.34 2dsm s ASP 33 CO 0.31 0.20 1.08 -1.81 0.21 0.00 0.00 175.17 175.17 2dsm s ASP 34 N 0.19 6.53 0.18 0.27 1.01 -1.26 -4.77 116.67 118.82 2dsm s ASP 34 Ca 0.01 0.23 0.02 0.00 0.71 0.00 0.00 52.55 53.53 2dsm s ASP 34 Cb -0.13 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.24 2dsm s ASP 34 CO 0.02 -1.26 -0.01 -0.72 0.21 0.00 0.00 175.17 173.41 2dsm s TYR 35 N 4.37 1.30 0.02 4.23 1.13 -1.26 -1.73 117.35 125.41 2dsm s TYR 35 Ca 0.43 -0.97 0.02 0.00 -1.41 0.00 0.00 57.07 55.14 2dsm s TYR 35 Cb -0.08 -0.74 -0.01 0.00 -1.10 0.00 0.00 41.96 40.03 2dsm s TYR 35 CO 0.28 -0.14 -0.06 0.08 -2.51 0.00 0.00 175.55 173.20 2dsm s VAL 36 N -3.56 0.48 -0.30 -3.49 1.01 -0.52 -4.89 120.40 109.12 2dsm s VAL 36 Ca 0.24 -0.60 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 2dsm s VAL 36 Cb 0.06 -0.47 -0.00 0.00 0.00 0.00 0.00 36.38 35.96 2dsm s VAL 36 CO 0.05 -0.10 0.11 -0.63 0.00 0.00 0.00 175.10 174.53 2dsm s ILE 37 N -0.67 4.27 -0.69 2.22 1.01 -1.26 -1.28 121.20 124.79 2dsm s ILE 37 Ca -0.03 -0.52 -0.05 0.00 0.00 0.00 0.00 60.65 60.05 2dsm s ILE 37 Cb -0.06 -3.17 0.18 0.00 0.01 0.00 0.00 42.46 39.43 2dsm s ILE 37 CO 0.00 0.10 0.54 -0.62 0.00 0.00 0.00 174.94 174.96 2dsm s ASP 38 N 1.56 5.59 -0.09 3.58 -1.08 0.53 -4.65 116.67 122.11 2dsm s ASP 38 Ca 0.04 -2.92 -0.01 0.00 -0.52 0.00 0.00 52.55 49.14 2dsm s ASP 38 Cb -0.17 -1.93 0.00 0.00 -1.46 0.00 0.00 42.92 39.37 2dsm s ASP 38 CO 0.04 -0.39 0.07 0.61 0.52 0.00 0.00 175.17 176.03 2dsm n GLY 39 N 3.45 0.80 3.42 2.66 0.00 -1.26 -3.02 105.19 111.24 2dsm n GLY 39 Ca 0.10 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2dsm n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dsm n GLY 40 N -0.65 2.96 3.79 -0.02 0.00 -1.26 -4.95 105.19 105.07 2dsm n GLY 40 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2dsm n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dsm s GLU 41 N -0.08 4.20 -0.02 1.61 2.56 -1.17 -5.07 118.70 120.74 2dsm s GLU 41 Ca 0.00 0.67 -0.14 0.00 0.00 0.00 0.00 54.97 55.50 2dsm s GLU 41 Cb 0.00 -3.28 -0.05 0.00 2.00 0.00 0.00 34.13 32.80 2dsm s GLU 41 CO 0.00 0.54 0.37 0.42 -0.56 0.00 0.00 175.26 176.03 2dsm s ILE 42 N -0.72 5.10 -0.03 -3.70 1.01 -1.26 -0.35 121.20 121.26 2dsm s ILE 42 Ca 0.29 0.75 -0.00 0.00 0.00 0.00 0.00 60.65 61.68 2dsm s ILE 42 Cb -0.18 -3.67 0.03 0.00 0.01 0.00 0.00 42.46 38.65 2dsm s ILE 42 CO 0.17 0.58 0.02 -0.63 0.00 0.00 0.00 174.94 175.08 2dsm s ILE 43 N -1.00 0.03 0.50 2.92 1.09 -0.40 0.11 121.20 124.45 2dsm s ILE 43 Ca 0.22 0.21 -0.23 0.00 -1.10 0.00 0.00 60.65 59.76 2dsm s ILE 43 Cb -0.16 -0.18 -0.07 0.00 -1.06 0.00 0.00 42.46 40.99 2dsm s ILE 43 CO 0.12 0.13 1.21 0.18 -0.10 0.00 0.00 174.94 176.48 2dsm n LEU 44 N 4.41 4.34 0.32 2.97 4.77 -1.26 -1.44 117.00 131.11 2dsm n LEU 44 Ca -0.22 0.99 0.20 0.00 -0.03 0.00 0.00 56.01 56.95 2dsm n LEU 44 Cb 0.50 -1.49 1.07 0.00 -2.33 0.00 0.00 43.42 41.18 2dsm n LEU 44 CO 0.19 -0.97 1.14 0.03 -1.33 0.00 0.00 177.39 176.45 2dsm h ARG 45 N 1.46 0.00 -0.43 3.23 2.47 -1.68 -1.26 114.38 118.16 2dsm h ARG 45 Ca -0.49 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.19 2dsm h ARG 45 Cb 1.32 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.62 2dsm h ARG 45 CO 0.57 0.00 0.11 1.49 0.56 0.00 0.00 179.97 182.70 2dsm h GLU 46 N 0.00 0.69 -0.29 0.04 4.81 -1.89 -2.97 114.58 114.98 2dsm h GLU 46 Ca 0.00 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2dsm h GLU 46 Cb 0.17 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2dsm h GLU 46 CO 0.00 0.69 0.00 -1.71 -0.73 0.00 0.00 179.01 177.26 2dsm n ASN 47 N -4.54 2.75 -0.02 1.04 2.85 -1.02 -4.57 115.26 111.76 2dsm n ASN 47 Ca 0.00 -1.89 -0.03 0.00 -0.11 0.00 0.00 54.58 52.56 2dsm n ASN 47 Cb 0.20 -0.19 0.22 0.00 1.24 0.00 0.00 39.78 41.26 2dsm n ASN 47 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2dsm h LEU 48 N 2.14 0.55 -1.66 1.20 5.85 -1.06 -2.27 115.31 120.06 2dsm h LEU 48 Ca 0.00 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.65 2dsm h LEU 48 Cb 0.69 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 2dsm h LEU 48 CO 0.00 0.70 0.36 -0.08 -0.34 0.00 0.00 178.44 179.08 2dsm h GLU 49 N 0.52 0.39 0.22 1.25 4.81 -1.81 0.87 114.58 120.84 2dsm h GLU 49 Ca 0.10 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2dsm h GLU 49 Cb 0.51 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.80 2dsm h GLU 49 CO 0.03 0.26 -0.11 -0.09 -0.73 0.00 0.00 179.01 178.37 2dsm h ARG 50 N 0.40 -0.29 -0.51 1.92 9.65 -1.74 -1.94 114.38 121.87 2dsm h ARG 50 Ca 0.24 0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.10 2dsm h ARG 50 Cb 0.42 0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.05 2dsm h ARG 50 CO -0.06 0.04 0.17 -0.92 2.80 0.00 0.00 179.97 182.00 2dsm h TYR 51 N -0.65 0.82 0.00 2.20 5.03 -1.17 -1.68 116.97 121.52 2dsm h TYR 51 Ca -0.03 -0.08 -0.07 0.00 2.58 0.00 0.00 58.73 61.13 2dsm h TYR 51 Cb 0.46 -0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.49 2dsm h TYR 51 CO 0.03 0.70 -0.34 -0.07 -1.32 0.00 0.00 178.16 177.17 2dsm h LEU 52 N 0.70 0.00 -1.01 2.82 3.38 -0.96 -1.61 115.31 118.63 2dsm h LEU 52 Ca 0.17 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 2dsm h LEU 52 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2dsm h LEU 52 CO -0.01 0.34 -0.37 -0.09 0.09 0.00 0.00 178.44 178.40 2dsm h ARG 53 N 0.00 0.00 0.00 1.13 2.43 -0.51 -2.28 114.38 115.15 2dsm h ARG 53 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2dsm h ARG 53 Cb 0.63 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 2dsm h ARG 53 CO 0.04 0.37 -0.03 0.93 -1.51 0.00 0.00 179.97 179.77 2dsm h GLU 54 N 0.00 0.00 0.00 0.20 4.39 -0.53 -3.44 114.58 115.20 2dsm h GLU 54 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 2dsm h GLU 54 Cb 0.85 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.49 2dsm h GLU 54 CO 0.05 0.00 -1.86 0.00 -1.16 0.00 0.00 179.01 176.04 2dsm n GLN 55 N -2.41 0.67 -3.19 2.33 10.64 -0.68 -5.02 117.38 119.72 2dsm n GLN 55 Ca -0.00 -0.13 -0.15 0.00 -1.83 0.00 0.00 57.00 54.88 2dsm n GLN 55 Cb 0.02 -1.42 0.06 0.00 -0.86 0.00 0.00 30.24 28.04 2dsm n GLN 55 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 2dsm n LEU 56 N -2.20 -3.22 0.00 2.61 7.94 -0.86 -3.19 117.00 118.09 2dsm n LEU 56 Ca -0.07 -0.42 0.00 0.00 -1.11 0.00 0.00 56.01 54.41 2dsm n LEU 56 Cb 0.56 -2.38 0.00 0.00 0.53 0.00 0.00 43.42 42.14 2dsm n LEU 56 CO 0.37 0.39 0.00 0.61 -1.11 0.00 0.00 177.39 177.65 2dsm n GLY 57 N -1.39 1.93 3.42 -3.96 0.00 -1.26 -4.98 105.19 98.94 2dsm n GLY 57 Ca -0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 2dsm n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dsm s PHE 58 N -2.47 3.09 -0.56 1.61 0.08 -1.19 -4.17 117.98 114.37 2dsm s PHE 58 Ca 0.00 -0.72 -0.20 0.00 0.12 0.00 0.00 56.93 56.13 2dsm s PHE 58 Cb 0.00 -3.53 0.07 0.00 -0.57 0.00 0.00 43.02 38.99 2dsm s PHE 58 CO 0.00 -1.02 0.72 -2.00 -0.10 0.00 0.00 175.22 172.82 2dsm s GLU 59 N 2.36 3.11 -0.49 0.44 2.12 -1.26 -4.90 118.70 120.08 2dsm s GLU 59 Ca 0.11 -0.99 -0.29 0.00 0.36 0.00 0.00 54.97 54.17 2dsm s GLU 59 Cb -0.22 -4.17 0.03 0.00 0.26 0.00 0.00 34.13 30.03 2dsm s GLU 59 CO 0.09 -1.43 1.20 -0.06 -0.54 0.00 0.00 175.26 174.52 2dsm s PHE 60 N 2.93 2.69 -0.38 5.30 0.08 -1.26 -4.99 117.98 122.35 2dsm s PHE 60 Ca 0.16 0.64 -0.06 0.00 0.12 0.00 0.00 56.93 57.78 2dsm s PHE 60 Cb -0.20 -4.44 0.07 0.00 -0.57 0.00 0.00 43.02 37.88 2dsm s PHE 60 CO 0.10 -1.47 0.18 0.15 -0.10 0.00 0.00 175.22 174.08 2dsm s LYS 61 N 4.68 2.47 0.87 0.44 -0.14 -1.26 -5.09 119.74 121.70 2dsm s LYS 61 Ca 0.49 -1.44 -0.12 0.00 -1.36 0.00 0.00 55.97 53.54 2dsm s LYS 61 Cb -0.08 -3.59 0.11 0.00 -1.68 0.00 0.00 37.83 32.59 2dsm s LYS 61 CO 0.31 -0.86 1.13 -0.80 -0.76 0.00 0.00 175.35 174.36 2dsm s ASN 62 N 1.78 3.92 0.00 2.83 0.02 -1.26 -4.88 114.94 117.35 2dsm s ASN 62 Ca 0.02 1.02 0.00 0.00 -1.02 0.00 0.00 52.86 52.88 2dsm s ASN 62 Cb -0.22 -1.63 0.00 0.00 0.02 0.00 0.00 41.25 39.42 2dsm s ASN 62 CO 0.01 -2.30 0.64 0.00 0.02 0.00 0.00 177.10 175.47 2dsm n ALA 63 N -3.61 2.20 -1.37 0.60 0.00 -1.26 -4.63 120.51 112.45 2dsm n ALA 63 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.38 2dsm n ALA 63 Cb 0.59 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 2dsm n ALA 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2dsm n GLN 64 N 1.00 -1.67 -2.95 0.00 6.02 -1.26 -4.90 117.38 113.62 2dsm n GLN 64 Ca 0.00 0.94 -0.44 0.00 -0.01 0.00 0.00 57.00 57.49 2dsm n GLN 64 Cb 0.26 -5.37 -0.03 0.00 1.02 0.00 0.00 30.24 26.11 2dsm n GLN 64 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2dsm s LEU 65 N -2.87 5.01 -0.02 1.08 2.34 -1.26 -4.77 118.68 118.18 2dsm s LEU 65 Ca 0.00 -1.75 -0.00 0.00 0.06 0.00 0.00 54.13 52.44 2dsm s LEU 65 Cb 0.00 -2.38 -0.00 0.00 -0.56 0.00 0.00 46.19 43.25 2dsm s LEU 65 CO 0.00 -1.14 -0.01 -0.08 -1.06 0.00 0.00 176.35 174.06 2dsm h GLU 66 N 9.01 0.00 -2.13 1.48 4.22 -2.00 -3.48 114.58 121.68 2dsm h GLU 66 Ca -0.01 0.00 -0.40 0.00 0.08 0.00 0.00 59.36 59.03 2dsm h GLU 66 Cb 1.04 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.21 2dsm h GLU 66 CO 1.11 0.00 -0.44 1.58 -2.18 0.00 0.00 179.01 179.08 2dsm n HIS 67 N -2.56 -0.58 -3.67 0.92 -0.00 -1.26 -4.95 115.22 103.12 2dsm n HIS 67 Ca -0.00 0.00 -0.37 0.00 0.46 0.00 0.00 57.72 57.81 2dsm n HIS 67 Cb 0.01 -3.61 -0.07 0.00 -0.12 0.00 0.00 29.99 26.21 2dsm n HIS 67 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2dsm s HIS 68 N -2.84 3.55 -0.32 1.57 3.76 -1.26 -5.03 115.29 114.72 2dsm s HIS 68 Ca 0.00 0.61 -0.29 0.00 -0.15 0.00 0.00 55.06 55.24 2dsm s HIS 68 Cb 0.00 -2.17 -0.01 0.00 1.11 0.00 0.00 32.58 31.51 2dsm s HIS 68 CO 0.00 0.50 1.66 -1.01 -0.85 0.00 0.00 174.74 175.04 2dsm s HIS 69 N -0.37 2.03 -1.18 1.40 3.76 -1.26 -4.88 115.29 114.79 2dsm s HIS 69 Ca 0.16 0.62 -0.21 0.00 -0.15 0.00 0.00 55.06 55.48 2dsm s HIS 69 Cb -0.13 -4.14 -0.00 0.00 1.11 0.00 0.00 32.58 29.42 2dsm s HIS 69 CO 0.05 -2.71 1.79 -1.01 -0.85 0.00 0.00 174.74 172.01 2dsm s HIS 70 N 6.11 2.35 0.00 1.40 0.09 -1.26 -2.07 115.29 121.90 2dsm s HIS 70 Ca 0.73 -0.55 0.00 0.00 -0.00 0.00 0.00 55.06 55.24 2dsm s HIS 70 Cb -0.21 -4.41 0.00 0.00 -0.00 0.00 0.00 32.58 27.96 2dsm s HIS 70 CO 0.32 -1.60 0.00 1.58 -0.00 0.00 0.00 174.74 175.04 2dsm n HIS 71 N 11.17 0.00 -0.62 1.40 -0.00 -1.26 -5.32 115.22 120.59 2dsm n HIS 71 Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.17 2dsm n HIS 71 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.46 2dsm n HIS 71 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92