#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cd0 s PHE 2 N 0.00 0.09 0.22 1.20 -0.12 -1.26 -4.77 117.98 113.34 1cd0 s PHE 2 Ca 0.00 -0.45 0.11 0.00 -0.05 0.00 0.00 56.93 56.55 1cd0 s PHE 2 Cb 0.00 0.23 -0.05 0.00 -0.63 0.00 0.00 43.02 42.57 1cd0 s PHE 2 CO 0.00 -0.86 -0.21 -1.64 -0.05 0.00 0.00 175.22 172.47 1cd0 s MET 3 N -3.92 1.65 -0.33 1.99 -1.94 -1.26 -4.95 119.30 110.54 1cd0 s MET 3 Ca 0.13 -1.59 0.01 0.00 -1.71 0.00 0.00 55.69 52.53 1cd0 s MET 3 Cb 0.00 -1.86 0.08 0.00 2.01 0.00 0.00 34.83 35.07 1cd0 s MET 3 CO -0.01 0.38 0.04 -0.51 -0.01 0.00 0.00 175.02 174.90 1cd0 s LEU 4 N -3.01 4.37 -0.13 -0.03 1.43 -1.26 -0.71 118.68 119.34 1cd0 s LEU 4 Ca 0.25 -1.76 -0.15 0.00 -1.03 0.00 0.00 54.13 51.44 1cd0 s LEU 4 Cb -0.07 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 1cd0 s LEU 4 CO 0.12 -0.34 0.36 0.20 0.23 0.00 0.00 176.35 176.91 1cd0 s ASN 5 N 1.22 6.55 0.14 2.29 0.01 0.09 -2.18 114.94 123.06 1cd0 s ASN 5 Ca 0.02 0.65 0.05 0.00 -0.71 0.00 0.00 52.86 52.88 1cd0 s ASN 5 Cb -0.20 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.20 1cd0 s ASN 5 CO -0.05 0.11 -0.12 -1.10 -1.51 0.00 0.00 177.10 174.44 1cd0 s GLN 6 N 0.25 1.04 0.28 -0.60 -0.21 -1.26 -0.21 119.66 118.95 1cd0 s GLN 6 Ca 0.20 -1.36 -0.29 0.00 0.02 0.00 0.00 55.36 53.93 1cd0 s GLN 6 Cb -0.14 -0.74 -0.10 0.00 1.00 0.00 0.00 33.01 33.03 1cd0 s GLN 6 CO 0.07 0.12 1.30 -1.25 -2.12 0.00 0.00 175.29 173.41 1cd0 s PRO 7 N -3.26 4.38 0.22 2.91 0.04 -1.26 -4.79 135.00 133.23 1cd0 s PRO 7 Ca 0.13 2.15 -0.09 0.00 0.04 0.00 0.00 61.00 63.23 1cd0 s PRO 7 Cb -0.01 -3.12 0.17 0.00 0.04 0.00 0.00 34.50 31.59 1cd0 s PRO 7 CO 0.02 -0.19 1.85 1.25 0.04 0.00 0.00 177.00 179.96 1cd0 h HIS 8 N 4.10 1.10 -3.96 0.56 2.76 -1.97 -3.36 115.15 114.37 1cd0 h HIS 8 Ca -0.47 -0.02 -0.21 0.00 -2.20 0.00 0.00 60.37 57.47 1cd0 h HIS 8 Cb 1.22 -0.35 -0.22 0.00 1.55 0.00 0.00 27.41 29.61 1cd0 h HIS 8 CO 0.58 0.75 -0.71 -1.12 -1.30 0.00 0.00 177.93 176.13 1cd0 s SER 9 N -6.09 0.42 -0.11 3.26 0.01 -1.26 -1.47 113.70 108.45 1cd0 s SER 9 Ca -0.13 -0.48 -0.07 0.00 1.31 0.00 0.00 55.95 56.57 1cd0 s SER 9 Cb 0.16 0.07 0.04 0.00 0.21 0.00 0.00 66.02 66.50 1cd0 s SER 9 CO 0.81 -0.25 0.27 -0.69 0.41 0.00 0.00 173.24 173.79 1cd0 s VAL 11 N -1.34 -0.02 0.05 3.43 1.01 -0.80 -4.92 120.40 117.81 1cd0 s VAL 11 Ca -0.13 0.08 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1cd0 s VAL 11 Cb -0.09 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 1cd0 s VAL 11 CO -0.01 0.03 -0.10 -0.94 0.00 0.00 0.00 175.10 174.08 1cd0 s SER 12 N 0.79 1.19 0.04 3.32 1.04 -1.26 -1.30 113.70 117.51 1cd0 s SER 12 Ca -0.05 -0.58 -0.27 0.00 0.48 0.00 0.00 55.95 55.53 1cd0 s SER 12 Cb -0.06 0.00 0.08 0.00 0.10 0.00 0.00 66.02 66.14 1cd0 s SER 12 CO -0.05 -0.15 0.70 -0.70 0.98 0.00 0.00 173.24 174.01 1cd0 s GLU 13 N -1.66 1.08 0.55 4.02 2.56 -0.98 -4.96 118.70 119.32 1cd0 s GLU 13 Ca -0.07 -0.14 -0.16 0.00 0.00 0.00 0.00 54.97 54.60 1cd0 s GLU 13 Cb -0.10 0.50 -0.06 0.00 2.00 0.00 0.00 34.13 36.47 1cd0 s GLU 13 CO 0.01 -0.42 1.01 0.45 -0.56 0.00 0.00 175.26 175.75 1cd0 s SER 14 N -2.02 6.31 0.41 -1.70 0.15 -1.26 -1.78 113.70 113.81 1cd0 s SER 14 Ca -0.03 1.65 -0.26 0.00 0.70 0.00 0.00 55.95 58.01 1cd0 s SER 14 Cb -0.01 -2.52 -0.09 0.00 -1.71 0.00 0.00 66.02 61.70 1cd0 s SER 14 CO -0.03 -0.80 1.37 -2.16 1.20 0.00 0.00 173.24 172.82 1cd0 s PRO 15 N -4.10 3.93 0.00 5.44 0.04 -1.26 -2.60 135.00 136.44 1cd0 s PRO 15 Ca 0.60 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.96 1cd0 s PRO 15 Cb -0.12 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1cd0 s PRO 15 CO 0.34 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.21 1cd0 n GLY 16 N 0.62 2.90 3.84 0.56 0.00 0.10 -4.89 105.19 108.32 1cd0 n GLY 16 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1cd0 n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cd0 s LYS 17 N -0.01 0.54 -0.17 1.61 -2.85 -1.07 -3.68 119.74 114.11 1cd0 s LYS 17 Ca 0.00 -0.17 -0.04 0.00 -1.00 0.00 0.00 55.97 54.76 1cd0 s LYS 17 Cb 0.00 -1.81 -0.02 0.00 -2.06 0.00 0.00 37.83 33.93 1cd0 s LYS 17 CO 0.00 -2.52 -0.03 0.99 0.10 0.00 0.00 175.35 173.89 1cd0 s THR 18 N -3.60 3.84 -0.02 3.79 2.01 -1.26 -2.35 115.64 118.05 1cd0 s THR 18 Ca 0.70 -0.37 0.04 0.00 0.31 0.00 0.00 61.69 62.38 1cd0 s THR 18 Cb -0.07 -2.69 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 1cd0 s THR 18 CO 0.53 0.48 -0.13 0.54 -0.69 0.00 0.00 174.62 175.34 1cd0 s VAL 19 N 0.57 3.13 -0.08 3.82 0.11 0.45 -4.95 120.40 123.45 1cd0 s VAL 19 Ca -0.03 -0.83 0.05 0.00 -2.93 0.00 0.00 61.98 58.24 1cd0 s VAL 19 Cb -0.14 -2.28 -0.00 0.00 -1.53 0.00 0.00 36.38 32.43 1cd0 s VAL 19 CO 0.03 0.49 -0.24 -0.89 -3.33 0.00 0.00 175.10 171.16 1cd0 s THR 20 N -0.83 2.02 -0.17 5.04 2.01 -1.26 -0.37 115.64 122.08 1cd0 s THR 20 Ca 0.13 -1.02 -0.00 0.00 0.31 0.00 0.00 61.69 61.11 1cd0 s THR 20 Cb -0.11 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.67 1cd0 s THR 20 CO 0.03 0.56 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.74 1cd0 s ILE 21 N 0.16 2.66 0.29 1.82 1.01 0.32 -4.97 121.20 122.49 1cd0 s ILE 21 Ca -0.13 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.72 1cd0 s ILE 21 Cb -0.16 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 1cd0 s ILE 21 CO 0.07 0.50 0.53 -0.94 0.00 0.00 0.00 174.94 175.11 1cd0 s SER 22 N 1.02 6.41 -0.25 3.58 1.04 -1.26 -0.97 113.70 123.27 1cd0 s SER 22 Ca -0.01 0.63 -0.04 0.00 0.48 0.00 0.00 55.95 57.01 1cd0 s SER 22 Cb -0.15 -2.11 0.09 0.00 0.10 0.00 0.00 66.02 63.95 1cd0 s SER 22 CO -0.03 -0.19 0.12 0.00 0.98 0.00 0.00 173.24 174.11 1cd0 s THR 24 N 2.12 4.59 -0.21 0.00 2.01 0.70 -0.04 115.64 124.81 1cd0 s THR 24 Ca 0.07 -0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.70 1cd0 s THR 24 Cb -0.16 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.21 1cd0 s THR 24 CO -0.27 0.34 1.07 -0.60 -0.69 0.00 0.00 174.62 174.47 1cd0 s ARG 25 N 1.43 4.27 0.32 4.92 3.52 -0.91 -0.73 118.95 131.77 1cd0 s ARG 25 Ca 0.06 1.40 0.02 0.00 -0.13 0.00 0.00 55.73 57.08 1cd0 s ARG 25 Cb -0.15 -3.64 0.59 0.00 -1.56 0.00 0.00 34.95 30.19 1cd0 s ARG 25 CO 0.05 -0.61 1.93 0.66 -0.81 0.00 0.00 175.30 176.52 1cd0 h SER 26 N 7.51 0.83 -4.30 -2.12 4.64 -1.25 -3.44 113.55 115.41 1cd0 h SER 26 Ca -0.21 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.00 1cd0 h SER 26 Cb 1.07 -0.18 -0.22 0.00 -0.31 0.00 0.00 62.40 62.77 1cd0 h SER 26 CO 0.97 0.54 -0.18 -0.94 -0.87 0.00 0.00 176.83 176.34 1cd0 s SER 27 N -6.11 -0.40 0.00 4.97 1.04 -1.26 -4.96 113.70 106.97 1cd0 s SER 27 Ca -0.11 0.65 0.00 0.00 0.48 0.00 0.00 55.95 56.97 1cd0 s SER 27 Cb 0.19 0.70 0.00 0.00 0.10 0.00 0.00 66.02 67.02 1cd0 s SER 27 CO 0.79 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 175.34 1cd0 n GLY 27 N 2.22 0.17 3.72 7.32 0.00 -1.26 -4.77 105.19 112.59 1cd0 n GLY 27 Ca -0.16 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 1cd0 n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cd0 s ASN 27 N -1.05 6.46 0.38 1.61 0.02 -1.26 -4.89 114.94 116.21 1cd0 s ASN 27 Ca 0.00 2.78 0.07 0.00 -1.02 0.00 0.00 52.86 54.69 1cd0 s ASN 27 Cb 0.00 -2.60 0.80 0.00 0.02 0.00 0.00 41.25 39.47 1cd0 s ASN 27 CO 0.00 -0.91 1.99 -0.29 0.02 0.00 0.00 177.10 177.90 1cd0 h ILE 28 N 3.86 1.03 -0.02 0.60 6.09 -1.92 -1.70 117.51 125.45 1cd0 h ILE 28 Ca -0.43 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 62.83 1cd0 h ILE 28 Cb 1.20 0.30 0.00 0.00 0.47 0.00 0.00 36.82 38.79 1cd0 h ILE 28 CO 0.93 0.12 0.00 -0.90 -3.07 0.00 0.00 178.15 175.23 1cd0 n ASP 29 N -4.47 0.18 0.01 2.19 5.75 -1.26 -3.76 116.55 115.18 1cd0 n ASP 29 Ca 0.09 -1.43 0.13 0.00 -0.01 0.00 0.00 54.79 53.57 1cd0 n ASP 29 Cb 0.20 -0.01 0.45 0.00 -1.03 0.00 0.00 41.12 40.73 1cd0 n ASP 29 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1cd0 n SER 30 N -0.68 0.29 -3.80 -1.12 3.41 -0.64 -4.83 113.62 106.24 1cd0 n SER 30 Ca 0.15 0.24 -0.12 0.00 -0.26 0.00 0.00 58.87 58.87 1cd0 n SER 30 Cb 0.09 -0.24 -0.11 0.00 -0.26 0.00 0.00 64.21 63.70 1cd0 n SER 30 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1cd0 s ASN 31 N -3.24 -0.19 0.43 4.04 -0.87 -1.25 -5.10 114.94 108.76 1cd0 s ASN 31 Ca 0.12 0.28 -0.26 0.00 -1.57 0.00 0.00 52.86 51.44 1cd0 s ASN 31 Cb 0.17 0.41 -0.09 0.00 -0.02 0.00 0.00 41.25 41.72 1cd0 s ASN 31 CO 0.60 -0.20 1.37 -1.22 -2.57 0.00 0.00 177.10 175.08 1cd0 n TYR 32 N 2.37 2.50 -4.80 2.20 4.01 -1.26 -4.86 117.16 117.32 1cd0 n TYR 32 Ca -0.16 0.47 -0.33 0.00 -0.16 0.00 0.00 57.90 57.72 1cd0 n TYR 32 Cb 0.57 -2.43 -0.14 0.00 -0.31 0.00 0.00 39.34 37.03 1cd0 n TYR 32 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1cd0 s VAL 33 N -1.18 3.02 0.21 -0.72 1.01 -1.26 -4.29 120.40 117.19 1cd0 s VAL 33 Ca 0.60 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.98 1cd0 s VAL 33 Cb -0.48 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1cd0 s VAL 33 CO 0.59 0.53 0.01 -1.10 0.00 0.00 0.00 175.10 175.12 1cd0 s GLN 34 N 0.30 2.39 -0.09 2.72 1.11 0.56 -0.73 119.66 125.91 1cd0 s GLN 34 Ca -0.10 -1.21 0.01 0.00 0.01 0.00 0.00 55.36 54.06 1cd0 s GLN 34 Cb -0.16 -2.30 0.02 0.00 -1.01 0.00 0.00 33.01 29.57 1cd0 s GLN 34 CO 0.06 0.42 -0.10 -1.58 0.01 0.00 0.00 175.29 174.10 1cd0 s TRP 35 N -1.95 1.50 -0.02 0.91 0.52 0.76 -0.79 118.94 119.87 1cd0 s TRP 35 Ca 0.29 -0.66 0.04 0.00 0.02 0.00 0.00 56.10 55.78 1cd0 s TRP 35 Cb -0.08 -1.17 -0.03 0.00 -1.15 0.00 0.00 33.47 31.04 1cd0 s TRP 35 CO 0.19 -0.41 -0.11 0.71 0.02 0.00 0.00 176.95 177.36 1cd0 s TYR 36 N 1.19 2.78 -0.19 -1.98 2.02 0.45 -1.09 117.35 120.53 1cd0 s TYR 36 Ca -0.05 -0.11 -0.04 0.00 -0.37 0.00 0.00 57.07 56.51 1cd0 s TYR 36 Cb -0.14 -1.61 -0.02 0.00 -0.40 0.00 0.00 41.96 39.79 1cd0 s TYR 36 CO -0.03 0.28 -0.03 -1.14 -1.57 0.00 0.00 175.55 173.06 1cd0 s GLN 37 N -1.09 3.54 -0.22 -0.62 0.74 0.60 -1.24 119.66 121.37 1cd0 s GLN 37 Ca 0.14 -0.57 0.01 0.00 0.05 0.00 0.00 55.36 54.99 1cd0 s GLN 37 Cb -0.11 -2.97 0.05 0.00 1.10 0.00 0.00 33.01 31.08 1cd0 s GLN 37 CO 0.04 0.03 -0.07 -1.14 -0.55 0.00 0.00 175.29 173.60 1cd0 s GLN 38 N 0.90 1.72 0.50 1.67 0.74 0.15 -1.36 119.66 123.99 1cd0 s GLN 38 Ca -0.00 -0.89 -0.05 0.00 0.05 0.00 0.00 55.36 54.46 1cd0 s GLN 38 Cb -0.15 -2.47 -0.03 0.00 1.10 0.00 0.00 33.01 31.46 1cd0 s GLN 38 CO 0.01 -0.53 0.81 -0.98 -0.55 0.00 0.00 175.29 174.05 1cd0 s ARG 39 N 1.42 3.40 0.08 1.67 1.04 -1.26 -1.00 118.95 124.31 1cd0 s ARG 39 Ca -0.04 0.14 -0.36 0.00 -1.04 0.00 0.00 55.73 54.43 1cd0 s ARG 39 Cb -0.18 -2.36 -0.16 0.00 -2.04 0.00 0.00 34.95 30.22 1cd0 s ARG 39 CO -0.07 -0.31 1.44 -0.35 -0.04 0.00 0.00 175.30 175.97 1cd0 n PRO 40 N -2.32 1.46 -1.83 3.89 -0.04 -1.26 -2.24 135.00 132.66 1cd0 n PRO 40 Ca 0.01 0.53 -0.18 0.00 -0.04 0.00 0.00 63.50 63.82 1cd0 n PRO 40 Cb 0.56 -2.21 -0.05 0.00 -0.04 0.00 0.00 33.50 31.75 1cd0 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cd0 n GLY 41 N 2.90 0.98 3.36 0.55 0.00 -1.26 -4.96 105.19 106.76 1cd0 n GLY 41 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1cd0 n GLY 41 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cd0 s SER 42 N -2.38 1.59 0.52 1.61 1.04 -0.95 -5.15 113.70 109.99 1cd0 s SER 42 Ca 0.00 -1.43 -0.17 0.00 0.48 0.00 0.00 55.95 54.83 1cd0 s SER 42 Cb 0.00 0.18 -0.07 0.00 0.10 0.00 0.00 66.02 66.23 1cd0 s SER 42 CO 0.00 -0.75 1.00 0.00 0.98 0.00 0.00 173.24 174.47 1cd0 s ALA 43 N -3.60 3.01 0.64 5.32 0.00 -1.26 -4.61 121.76 121.26 1cd0 s ALA 43 Ca 0.36 0.22 -0.16 0.00 0.00 0.00 0.00 51.96 52.39 1cd0 s ALA 43 Cb 0.07 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1cd0 s ALA 43 CO 0.15 -0.32 1.11 -2.14 0.00 0.00 0.00 175.76 174.56 1cd0 s PRO 44 N -4.04 2.91 0.05 0.00 0.02 -1.26 -4.60 135.00 128.08 1cd0 s PRO 44 Ca 0.60 1.43 0.04 0.00 0.02 0.00 0.00 61.00 63.08 1cd0 s PRO 44 Cb -0.11 -1.96 -0.02 0.00 0.02 0.00 0.00 34.50 32.43 1cd0 s PRO 44 CO 0.32 -1.17 -0.11 0.96 -0.33 0.00 0.00 177.00 176.67 1cd0 s ILE 45 N -2.23 0.83 -0.14 2.83 -4.36 -0.46 -4.94 121.20 112.73 1cd0 s ILE 45 Ca 0.68 -1.06 -0.25 0.00 -0.26 0.00 0.00 60.65 59.76 1cd0 s ILE 45 Cb -0.21 -0.82 -0.02 0.00 1.25 0.00 0.00 42.46 42.66 1cd0 s ILE 45 CO 0.39 -0.20 0.80 -0.89 0.24 0.00 0.00 174.94 175.27 1cd0 s THR 46 N -1.12 4.92 -0.06 8.37 2.01 -1.26 -0.29 115.64 128.21 1cd0 s THR 46 Ca -0.04 1.60 0.14 0.00 0.31 0.00 0.00 61.69 63.70 1cd0 s THR 46 Cb -0.09 -4.12 -0.21 0.00 0.01 0.00 0.00 72.50 68.09 1cd0 s THR 46 CO 0.01 0.09 0.23 1.33 -0.69 0.00 0.00 174.62 175.59 1cd0 n VAL 47 N 4.46 0.33 -3.75 3.82 0.24 -0.25 -4.72 118.33 118.47 1cd0 n VAL 47 Ca 0.03 -0.43 -0.13 0.00 -2.04 0.00 0.00 64.34 61.78 1cd0 n VAL 47 Cb 0.50 -0.11 -0.11 0.00 -1.47 0.00 0.00 33.84 32.65 1cd0 n VAL 47 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1cd0 s ILE 48 N -2.80 -0.00 0.04 1.34 -1.09 -1.10 -4.45 121.20 113.14 1cd0 s ILE 48 Ca -0.06 0.01 -0.02 0.00 -2.23 0.00 0.00 60.65 58.35 1cd0 s ILE 48 Cb 0.08 -0.50 -0.03 0.00 -1.58 0.00 0.00 42.46 40.42 1cd0 s ILE 48 CO 0.60 0.00 0.00 -0.72 -1.23 0.00 0.00 174.94 173.60 1cd0 s TYR 49 N 0.31 0.39 -1.34 3.97 -0.85 0.12 -0.17 117.35 119.77 1cd0 s TYR 49 Ca -0.01 -0.82 -0.01 0.00 -0.52 0.00 0.00 57.07 55.71 1cd0 s TYR 49 Cb -0.03 -0.28 -0.00 0.00 0.38 0.00 0.00 41.96 42.02 1cd0 s TYR 49 CO -0.01 -0.34 0.58 0.39 -1.52 0.00 0.00 175.55 174.66 1cd0 n GLU 50 N 0.58 -4.13 0.00 -3.49 1.02 -1.20 -0.66 120.64 112.77 1cd0 n GLU 50 Ca -0.17 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1cd0 n GLU 50 Cb 0.59 -4.88 0.00 0.00 -0.02 0.00 0.00 31.44 27.13 1cd0 n GLU 50 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1cd0 n ASP 51 N -3.02 0.00 -0.45 1.62 8.00 0.09 -3.95 116.55 118.85 1cd0 n ASP 51 Ca -0.30 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.20 1cd0 n ASP 51 Cb 0.68 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 1cd0 n ASP 51 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1cd0 n ASN 52 N 1.48 0.00 -4.72 -2.24 0.23 -1.20 -3.49 115.26 105.32 1cd0 n ASN 52 Ca 0.00 -1.55 -0.38 0.00 -0.53 0.00 0.00 54.58 52.12 1cd0 n ASN 52 Cb 0.00 -0.11 -0.06 0.00 -2.08 0.00 0.00 39.78 37.53 1cd0 n ASN 52 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 1cd0 s GLN 53 N 0.00 4.35 -0.24 -3.83 -1.52 0.17 -4.65 119.66 113.94 1cd0 s GLN 53 Ca 0.00 0.53 -0.07 0.00 -1.95 0.00 0.00 55.36 53.86 1cd0 s GLN 53 Cb 0.00 -3.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.33 1cd0 s GLN 53 CO 0.00 0.15 0.07 1.03 -0.25 0.00 0.00 175.29 176.29 1cd0 s ARG 54 N 0.62 3.70 0.74 2.91 0.52 -1.26 -0.71 118.95 125.47 1cd0 s ARG 54 Ca 0.28 -0.46 -0.13 0.00 -0.52 0.00 0.00 55.73 54.90 1cd0 s ARG 54 Cb -0.16 -3.32 0.04 0.00 0.52 0.00 0.00 34.95 32.04 1cd0 s ARG 54 CO 0.12 -0.14 1.12 -1.25 0.02 0.00 0.00 175.30 175.17 1cd0 s PRO 55 N 1.48 2.33 0.50 3.54 0.04 -1.26 -4.93 135.00 136.69 1cd0 s PRO 55 Ca 0.06 1.39 -0.23 0.00 0.04 0.00 0.00 61.00 62.26 1cd0 s PRO 55 Cb -0.15 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 1cd0 s PRO 55 CO 0.04 -1.62 1.32 -1.54 0.04 0.00 0.00 177.00 175.23 1cd0 s SER 56 N -2.78 5.65 0.00 6.66 1.04 -1.26 -2.58 113.70 120.43 1cd0 s SER 56 Ca 0.66 2.66 0.00 0.00 0.48 0.00 0.00 55.95 59.75 1cd0 s SER 56 Cb -0.21 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.28 1cd0 s SER 56 CO 0.49 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 174.01 1cd0 n GLY 57 N 0.64 2.68 3.68 7.32 0.00 -1.26 -5.04 105.19 113.21 1cd0 n GLY 57 Ca 0.08 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 1cd0 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cd0 s VAL 58 N -1.34 4.68 0.51 1.61 1.01 -1.06 -5.01 120.40 120.79 1cd0 s VAL 58 Ca 0.00 1.96 -0.23 0.00 0.00 0.00 0.00 61.98 63.71 1cd0 s VAL 58 Cb 0.00 -4.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.06 1cd0 s VAL 58 CO 0.00 -0.02 1.37 -2.84 0.00 0.00 0.00 175.10 173.61 1cd0 s PRO 59 N 2.19 3.37 0.00 2.72 0.02 -1.26 -4.84 135.00 137.20 1cd0 s PRO 59 Ca 0.49 2.27 0.08 0.00 0.02 0.00 0.00 61.00 63.86 1cd0 s PRO 59 Cb -0.19 -2.41 0.47 0.00 0.02 0.00 0.00 34.50 32.39 1cd0 s PRO 59 CO 0.17 -1.02 0.88 -0.40 -0.33 0.00 0.00 177.00 176.31 1cd0 n ASP 60 N -0.70 0.00 0.29 2.53 5.75 -1.26 -1.78 116.55 121.38 1cd0 n ASP 60 Ca 0.08 -0.40 0.18 0.00 -0.01 0.00 0.00 54.79 54.65 1cd0 n ASP 60 Cb 0.44 0.00 0.81 0.00 -1.03 0.00 0.00 41.12 41.34 1cd0 n ASP 60 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1cd0 h ARG 61 N 0.00 0.00 -5.55 0.11 3.08 -1.89 -3.41 114.38 106.71 1cd0 h ARG 61 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 1cd0 h ARG 61 Cb 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 29.96 1cd0 h ARG 61 CO 0.00 0.01 -0.42 -0.06 -1.07 0.00 0.00 179.97 178.43 1cd0 s PHE 62 N -3.80 3.54 -0.07 3.04 0.40 -0.74 -1.76 117.98 118.59 1cd0 s PHE 62 Ca -0.00 0.54 -0.05 0.00 -0.60 0.00 0.00 56.93 56.81 1cd0 s PHE 62 Cb 0.10 -2.11 0.02 0.00 0.51 0.00 0.00 43.02 41.54 1cd0 s PHE 62 CO 0.52 0.52 0.17 0.00 0.70 0.00 0.00 175.22 177.13 1cd0 s ALA 63 N -0.39 -0.40 0.00 5.36 0.00 -0.36 -4.99 121.76 120.98 1cd0 s ALA 63 Ca 0.14 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1cd0 s ALA 63 Cb -0.12 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1cd0 s ALA 63 CO 0.03 -0.11 0.07 0.20 0.00 0.00 0.00 175.76 175.95 1cd0 s GLY 64 N 0.45 2.00 0.25 0.00 0.00 -1.26 -0.73 107.32 108.03 1cd0 s GLY 64 Ca -0.03 -0.89 -0.09 0.00 0.00 0.00 0.00 44.72 43.71 1cd0 s GLY 64 CO -0.02 -0.77 0.42 -1.35 0.00 0.00 0.00 173.10 171.37 1cd0 s SER 65 N -1.75 0.09 -0.05 1.64 1.04 -0.51 -4.48 113.70 109.69 1cd0 s SER 65 Ca 0.23 -1.10 0.01 0.00 0.48 0.00 0.00 55.95 55.57 1cd0 s SER 65 Cb -0.12 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1cd0 s SER 65 CO 0.14 -1.11 -0.04 -0.63 0.98 0.00 0.00 173.24 172.58 1cd0 s ILE 66 N -3.89 0.50 -0.36 -1.02 -1.09 -1.26 -1.18 121.20 112.90 1cd0 s ILE 66 Ca 0.27 -0.09 0.01 0.00 -2.23 0.00 0.00 60.65 58.61 1cd0 s ILE 66 Cb 0.01 -0.54 0.10 0.00 -1.58 0.00 0.00 42.46 40.44 1cd0 s ILE 66 CO 0.11 0.22 0.10 -0.62 -1.23 0.00 0.00 174.94 173.52 1cd0 s ASP 66 N 1.01 4.95 0.34 3.58 -1.08 0.62 -4.97 116.67 121.12 1cd0 s ASP 66 Ca -0.10 -2.04 0.27 0.00 -0.52 0.00 0.00 52.55 50.16 1cd0 s ASP 66 Cb -0.14 -1.71 1.06 0.00 -1.46 0.00 0.00 42.92 40.68 1cd0 s ASP 66 CO -0.00 -0.43 1.79 0.03 0.52 0.00 0.00 175.17 177.08 1cd0 h ARG 66 N 7.80 0.00 0.00 4.34 3.08 -1.95 -1.07 114.38 126.57 1cd0 h ARG 66 Ca -0.09 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.85 1cd0 h ARG 66 Cb 1.03 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 1cd0 h ARG 66 CO 0.59 0.00 -0.53 0.66 -1.07 0.00 0.00 179.97 179.61 1cd0 h SER 67 N 0.00 0.00 -0.26 7.04 4.64 -1.94 -2.99 113.55 120.03 1cd0 h SER 67 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cd0 h SER 67 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1cd0 h SER 67 CO 0.00 0.53 0.00 -1.54 -0.87 0.00 0.00 176.83 174.95 1cd0 n SER 68 N -3.45 3.08 -4.23 4.97 3.41 -1.08 -4.99 113.62 111.33 1cd0 n SER 68 Ca 0.00 -2.36 -0.34 0.00 -0.26 0.00 0.00 58.87 55.91 1cd0 n SER 68 Cb 0.65 -0.31 -0.07 0.00 -0.26 0.00 0.00 64.21 64.22 1cd0 n SER 68 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1cd0 n ASN 69 N -0.01 -0.26 -4.04 4.04 5.15 -0.66 -4.82 115.26 114.66 1cd0 n ASN 69 Ca 0.13 -1.25 -0.09 0.00 -0.60 0.00 0.00 54.58 52.77 1cd0 n ASN 69 Cb 0.56 -1.78 -0.08 0.00 -0.53 0.00 0.00 39.78 37.95 1cd0 n ASN 69 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1cd0 s SER 70 N -4.21 0.18 0.16 1.20 1.04 -0.50 -2.13 113.70 109.45 1cd0 s SER 70 Ca 0.10 -1.02 0.08 0.00 0.48 0.00 0.00 55.95 55.60 1cd0 s SER 70 Cb -0.06 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 1cd0 s SER 70 CO 0.98 -0.80 -0.08 0.00 0.98 0.00 0.00 173.24 174.32 1cd0 s ALA 71 N -4.00 2.99 0.01 5.32 0.00 0.94 -0.27 121.76 126.74 1cd0 s ALA 71 Ca 0.19 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.77 1cd0 s ALA 71 Cb 0.05 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 1cd0 s ALA 71 CO -0.00 0.51 -0.06 -1.12 0.00 0.00 0.00 175.76 175.09 1cd0 s SER 72 N -2.69 0.70 -0.23 0.00 0.01 -0.33 -0.28 113.70 110.88 1cd0 s SER 72 Ca 0.24 -0.21 -0.05 0.00 1.31 0.00 0.00 55.95 57.25 1cd0 s SER 72 Cb -0.09 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 1cd0 s SER 72 CO 0.15 0.01 -0.00 -0.22 0.41 0.00 0.00 173.24 173.59 1cd0 s LEU 73 N -0.47 3.11 -0.15 2.44 2.96 -0.15 -1.42 118.68 125.00 1cd0 s LEU 73 Ca -0.01 -0.31 -0.02 0.00 -0.22 0.00 0.00 54.13 53.57 1cd0 s LEU 73 Cb -0.04 -1.81 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1cd0 s LEU 73 CO -0.00 -0.02 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.05 1cd0 s THR 74 N 1.47 3.57 -0.20 3.68 2.01 0.09 -0.52 115.64 125.74 1cd0 s THR 74 Ca 0.05 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.60 1cd0 s THR 74 Cb -0.15 -2.55 0.04 0.00 0.01 0.00 0.00 72.50 69.85 1cd0 s THR 74 CO -0.00 0.50 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.65 1cd0 s ILE 75 N 0.44 1.89 0.48 1.82 1.01 0.50 -1.23 121.20 126.11 1cd0 s ILE 75 Ca -0.06 -1.08 0.08 0.00 0.00 0.00 0.00 60.65 59.59 1cd0 s ILE 75 Cb -0.15 -1.86 0.03 0.00 0.01 0.00 0.00 42.46 40.49 1cd0 s ILE 75 CO 0.04 0.28 0.57 -0.94 0.00 0.00 0.00 174.94 174.89 1cd0 s SER 76 N 1.30 5.24 -1.65 3.58 1.04 -0.72 -0.41 113.70 122.08 1cd0 s SER 76 Ca -0.00 -0.71 -0.17 0.00 0.48 0.00 0.00 55.95 55.55 1cd0 s SER 76 Cb -0.16 -0.26 0.14 0.00 0.10 0.00 0.00 66.02 65.84 1cd0 s SER 76 CO -0.09 -0.93 0.86 0.61 0.98 0.00 0.00 173.24 174.67 1cd0 n GLY 77 N -1.88 -0.47 3.63 7.32 0.00 -1.21 -4.77 105.19 107.82 1cd0 n GLY 77 Ca 0.08 0.16 -0.54 0.00 0.00 0.00 0.00 46.02 45.72 1cd0 n GLY 77 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1cd0 n LEU 78 N -4.49 1.89 -4.33 0.99 7.94 -0.99 -4.56 117.00 113.45 1cd0 n LEU 78 Ca 0.07 1.10 -0.25 0.00 -1.11 0.00 0.00 56.01 55.82 1cd0 n LEU 78 Cb 0.50 -1.18 -0.12 0.00 0.53 0.00 0.00 43.42 43.15 1cd0 n LEU 78 CO 0.83 -0.85 -0.52 -0.54 -1.11 0.00 0.00 177.39 175.19 1cd0 s LYS 79 N 1.42 1.24 0.63 1.96 1.02 -1.26 0.00 119.74 124.76 1cd0 s LYS 79 Ca 0.89 -1.28 0.29 0.00 0.02 0.00 0.00 55.97 55.89 1cd0 s LYS 79 Cb -0.98 -1.53 1.58 0.00 -0.52 0.00 0.00 37.83 36.38 1cd0 s LYS 79 CO 0.52 0.35 1.93 1.79 -0.92 0.00 0.00 175.35 179.02 1cd0 h THR 80 N 3.81 0.16 0.00 2.17 1.35 -1.94 0.47 112.91 118.93 1cd0 h THR 80 Ca -0.46 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.38 1cd0 h THR 80 Cb 1.19 0.66 -0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1cd0 h THR 80 CO 0.42 0.00 -0.07 -0.08 -0.25 0.00 0.00 175.52 175.54 1cd0 h GLU 81 N 0.00 0.00 0.00 4.72 4.81 -1.99 -2.77 114.58 119.35 1cd0 h GLU 81 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1cd0 h GLU 81 Cb 0.82 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1cd0 h GLU 81 CO -0.00 0.07 0.00 -0.25 -0.73 0.00 0.00 179.01 178.10 1cd0 n ASP 82 N -3.19 0.74 -4.67 1.04 8.00 0.17 -4.80 116.55 113.84 1cd0 n ASP 82 Ca 0.01 0.62 -0.47 0.00 0.71 0.00 0.00 54.79 55.66 1cd0 n ASP 82 Cb 0.36 -0.80 -0.04 0.00 -0.02 0.00 0.00 41.12 40.61 1cd0 n ASP 82 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1cd0 n GLU 83 N -2.25 2.11 -3.36 -1.24 1.02 -1.05 -4.85 120.64 111.02 1cd0 n GLU 83 Ca 0.04 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 1cd0 n GLU 83 Cb 0.33 -2.55 0.00 0.00 -0.02 0.00 0.00 31.44 29.21 1cd0 n GLU 83 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cd0 n ALA 84 N 4.25 0.00 -2.76 0.62 0.00 -1.11 -4.85 120.51 116.67 1cd0 n ALA 84 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.26 1cd0 n ALA 84 Cb 0.28 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.67 1cd0 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cd0 s ASP 85 N -1.10 6.46 -0.08 0.00 1.01 -0.17 -0.83 116.67 121.97 1cd0 s ASP 85 Ca 0.00 0.55 0.05 0.00 0.71 0.00 0.00 52.55 53.86 1cd0 s ASP 85 Cb 0.00 -2.13 -0.01 0.00 1.01 0.00 0.00 42.92 41.80 1cd0 s ASP 85 CO 0.00 0.32 -0.24 -0.31 0.21 0.00 0.00 175.17 175.15 1cd0 s TYR 86 N -0.65 2.50 -0.07 4.23 1.51 -0.33 0.33 117.35 124.87 1cd0 s TYR 86 Ca 0.16 -0.86 0.04 0.00 -1.01 0.00 0.00 57.07 55.41 1cd0 s TYR 86 Cb -0.13 -1.65 -0.00 0.00 -0.11 0.00 0.00 41.96 40.07 1cd0 s TYR 86 CO 0.05 -0.30 -0.20 0.71 -1.11 0.00 0.00 175.55 174.70 1cd0 s TYR 87 N 0.05 2.08 0.35 2.71 2.02 -0.37 -1.35 117.35 122.84 1cd0 s TYR 87 Ca -0.10 -0.72 0.01 0.00 -0.37 0.00 0.00 57.07 55.88 1cd0 s TYR 87 Cb -0.16 -1.41 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 1cd0 s TYR 87 CO 0.06 -0.28 0.55 0.00 -1.57 0.00 0.00 175.55 174.31 1cd0 s GLN 89 N -4.31 0.60 0.00 0.00 -0.44 0.03 -0.66 119.66 114.88 1cd0 s GLN 89 Ca 0.40 0.60 0.00 0.00 -2.50 0.00 0.00 55.36 53.86 1cd0 s GLN 89 Cb -0.10 0.29 0.00 0.00 -1.64 0.00 0.00 33.01 31.56 1cd0 s GLN 89 CO 0.36 -0.09 0.00 0.45 0.50 0.00 0.00 175.29 176.51 1cd0 n SER 90 N 2.62 0.00 -4.21 6.67 2.88 -0.40 -0.32 113.62 120.86 1cd0 n SER 90 Ca -0.14 -0.82 -0.31 0.00 -1.33 0.00 0.00 58.87 56.27 1cd0 n SER 90 Cb 0.57 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.86 1cd0 n SER 90 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1cd0 s TYR 91 N -3.58 2.35 -0.31 0.66 2.02 -1.26 -0.88 117.35 116.35 1cd0 s TYR 91 Ca 0.00 -0.85 0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1cd0 s TYR 91 Cb 0.00 -1.57 0.07 0.00 -0.40 0.00 0.00 41.96 40.06 1cd0 s TYR 91 CO 0.00 -0.32 0.01 0.34 -1.57 0.00 0.00 175.55 174.01 1cd0 s ASP 92 N 0.18 4.79 1.30 2.29 -1.08 -0.57 -4.89 116.67 118.68 1cd0 s ASP 92 Ca -0.12 -1.62 0.00 0.00 -0.52 0.00 0.00 52.55 50.29 1cd0 s ASP 92 Cb -0.16 -1.66 0.00 0.00 -1.46 0.00 0.00 42.92 39.64 1cd0 s ASP 92 CO 0.06 -0.31 0.00 0.00 0.52 0.00 0.00 175.17 175.44 1cd0 n ALA 93 N 4.48 0.00 -0.04 3.66 0.00 -1.26 -1.35 120.51 126.00 1cd0 n ALA 93 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1cd0 n ALA 93 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1cd0 n ALA 93 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1cd0 n ARG 94 N 0.00 3.28 -2.01 0.00 0.00 -1.26 -5.05 116.66 111.62 1cd0 n ARG 94 Ca 0.00 -0.19 -0.33 0.00 -0.00 0.00 0.00 57.85 57.34 1cd0 n ARG 94 Cb 0.00 -0.66 0.01 0.00 -0.00 0.00 0.00 32.46 31.82 1cd0 n ARG 94 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1cd0 s ASN 95 N -0.52 5.76 -0.30 2.89 3.04 -0.45 -5.02 114.94 120.33 1cd0 s ASN 95 Ca 0.00 1.80 -0.14 0.00 0.04 0.00 0.00 52.86 54.56 1cd0 s ASN 95 Cb 0.00 -2.53 -0.03 0.00 -1.54 0.00 0.00 41.25 37.15 1cd0 s ASN 95 CO 0.00 -1.18 0.32 -0.69 -3.04 0.00 0.00 177.10 172.51 1cd0 s VAL 96 N -2.50 5.21 -0.16 -5.21 1.01 -1.26 -1.51 120.40 115.98 1cd0 s VAL 96 Ca 0.63 0.24 -0.05 0.00 0.00 0.00 0.00 61.98 62.80 1cd0 s VAL 96 Cb -0.16 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1cd0 s VAL 96 CO 0.38 0.08 0.01 -0.69 0.00 0.00 0.00 175.10 174.88 1cd0 s VAL 97 N 1.96 4.36 0.09 2.92 1.01 -0.06 -4.97 120.40 125.71 1cd0 s VAL 97 Ca 0.11 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1cd0 s VAL 97 Cb -0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1cd0 s VAL 97 CO 0.11 0.50 0.05 -0.36 0.00 0.00 0.00 175.10 175.39 1cd0 s PHE 98 N 0.17 3.10 0.76 5.22 0.40 -1.26 -1.27 117.98 125.09 1cd0 s PHE 98 Ca 0.01 0.02 -0.11 0.00 -0.60 0.00 0.00 56.93 56.25 1cd0 s PHE 98 Cb -0.13 -1.57 0.05 0.00 0.51 0.00 0.00 43.02 41.88 1cd0 s PHE 98 CO 0.02 0.50 1.10 0.20 0.70 0.00 0.00 175.22 177.74 1cd0 s GLY 99 N -2.43 1.62 0.63 4.36 0.00 0.16 -4.45 107.32 107.22 1cd0 s GLY 99 Ca 0.28 -0.29 0.41 0.00 0.00 0.00 0.00 44.72 45.12 1cd0 s GLY 99 CO 0.21 0.12 2.26 -1.33 0.00 0.00 0.00 173.10 174.36 1cd0 h GLY 100 N -0.92 0.00 0.00 0.20 0.00 -1.77 -3.44 103.07 97.15 1cd0 h GLY 100 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1cd0 h GLY 100 CO 0.61 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.76 1cd0 n GLY 101 N -0.77 1.09 2.89 4.60 0.00 -1.26 -5.01 105.19 106.73 1cd0 n GLY 101 Ca -0.02 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.14 1cd0 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cd0 s THR 102 N -2.30 0.73 -0.40 2.61 2.01 -0.46 -4.38 115.64 113.44 1cd0 s THR 102 Ca 0.00 -0.17 -0.27 0.00 0.31 0.00 0.00 61.69 61.56 1cd0 s THR 102 Cb 0.00 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.77 1cd0 s THR 102 CO 0.00 0.29 0.97 -0.60 -0.69 0.00 0.00 174.62 174.59 1cd0 s ARG 103 N 1.30 3.77 -0.39 4.92 6.06 -0.54 -1.18 118.95 132.88 1cd0 s ARG 103 Ca -0.04 0.52 -0.16 0.00 -2.50 0.00 0.00 55.73 53.54 1cd0 s ARG 103 Cb -0.14 -3.84 0.01 0.00 0.06 0.00 0.00 34.95 31.04 1cd0 s ARG 103 CO -0.02 -1.08 0.40 -1.17 -2.50 0.00 0.00 175.30 170.92 1cd0 s LEU 104 N 3.72 4.69 -0.21 -0.88 2.96 -0.01 -1.90 118.68 127.05 1cd0 s LEU 104 Ca 0.40 -0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 1cd0 s LEU 104 Cb -0.11 -2.36 -0.03 0.00 0.50 0.00 0.00 46.19 44.20 1cd0 s LEU 104 CO 0.22 -0.47 0.01 -0.89 -1.32 0.00 0.00 176.35 173.91 1cd0 s THR 105 N 2.07 4.04 -0.83 3.68 2.01 -0.42 -2.75 115.64 123.43 1cd0 s THR 105 Ca 0.12 -0.28 -0.18 0.00 0.31 0.00 0.00 61.69 61.65 1cd0 s THR 105 Cb -0.17 -2.84 0.14 0.00 0.01 0.00 0.00 72.50 69.64 1cd0 s THR 105 CO 0.13 0.41 0.98 0.54 -0.69 0.00 0.00 174.62 175.99 1cd0 s VAL 106 N 1.10 4.86 0.64 3.82 0.11 -1.26 -2.31 120.40 127.35 1cd0 s VAL 106 Ca 0.03 -1.52 0.16 0.00 -2.93 0.00 0.00 61.98 57.71 1cd0 s VAL 106 Cb -0.14 -4.67 0.21 0.00 -1.53 0.00 0.00 36.38 30.24 1cd0 s VAL 106 CO 0.02 -1.36 1.30 -0.07 -3.33 0.00 0.00 175.10 171.66 1cd0 h LEU 107 N 9.97 0.00 0.00 2.54 3.38 -1.71 -3.47 115.31 126.03 1cd0 h LEU 107 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1cd0 h LEU 107 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1cd0 h LEU 107 CO 1.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.19