#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lgn s THR 2 N 0.00 5.00 -0.58 0.61 2.01 0.88 -4.72 115.64 118.84 1lgn s THR 2 Ca 0.00 -0.20 -0.19 0.00 0.31 0.00 0.00 61.69 61.61 1lgn s THR 2 Cb 0.00 -3.26 0.10 0.00 0.01 0.00 0.00 72.50 69.36 1lgn s THR 2 CO 0.00 0.43 0.69 -0.62 -0.69 0.00 0.00 174.62 174.43 1lgn s ASP 3 N -1.53 6.18 -0.07 3.53 2.15 -1.25 0.83 116.67 126.50 1lgn s ASP 3 Ca 0.21 -1.42 0.05 0.00 0.43 0.00 0.00 52.55 51.82 1lgn s ASP 3 Cb -0.12 -2.30 0.27 0.00 -0.30 0.00 0.00 42.92 40.47 1lgn s ASP 3 CO 0.12 -1.09 0.93 0.18 -0.17 0.00 0.00 175.17 175.14 1lgn n LEU 4 N 6.27 2.48 -4.66 -1.34 4.32 -0.05 -4.94 117.00 119.08 1lgn n LEU 4 Ca -0.10 -1.25 -0.46 0.00 -0.02 0.00 0.00 56.01 54.19 1lgn n LEU 4 Cb 0.42 -0.53 -0.03 0.00 -1.62 0.00 0.00 43.42 41.66 1lgn n LEU 4 CO 0.58 0.37 1.05 -1.20 -1.22 0.00 0.00 177.39 176.97 1lgn n SER 5 N 0.21 2.73 -0.09 -1.43 7.64 -1.25 -1.48 113.62 119.94 1lgn n SER 5 Ca 0.09 1.12 -0.01 0.00 1.01 0.00 0.00 58.87 61.08 1lgn n SER 5 Cb 0.54 -1.41 -0.01 0.00 -1.01 0.00 0.00 64.21 62.33 1lgn n SER 5 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lgn n GLY 6 N 2.54 0.44 3.38 0.23 0.00 -1.26 -5.00 105.19 105.52 1lgn n GLY 6 Ca 0.14 -0.14 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1lgn n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lgn s LYS 7 N -0.98 1.56 0.08 1.61 1.02 -0.55 -0.89 119.74 121.58 1lgn s LYS 7 Ca 0.00 -1.87 -0.11 0.00 0.02 0.00 0.00 55.97 54.02 1lgn s LYS 7 Cb 0.00 -0.46 0.01 0.00 -0.52 0.00 0.00 37.83 36.86 1lgn s LYS 7 CO 0.00 -0.30 0.23 0.14 -0.92 0.00 0.00 175.35 174.51 1lgn s VAL 8 N -3.55 0.12 -0.13 3.17 -7.23 0.10 -4.49 120.40 108.38 1lgn s VAL 8 Ca 0.36 -0.97 -0.20 0.00 -1.81 0.00 0.00 61.98 59.36 1lgn s VAL 8 Cb 0.07 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.80 1lgn s VAL 8 CO 0.15 -0.54 0.55 -0.36 -0.31 0.00 0.00 175.10 174.58 1lgn s PHE 9 N -3.42 3.48 -0.26 2.82 0.08 0.08 -1.97 117.98 118.79 1lgn s PHE 9 Ca 0.01 0.94 -0.03 0.00 0.12 0.00 0.00 56.93 57.97 1lgn s PHE 9 Cb 0.03 -2.65 0.02 0.00 -0.57 0.00 0.00 43.02 39.84 1lgn s PHE 9 CO -0.09 0.06 -0.03 0.54 -0.10 0.00 0.00 175.22 175.60 1lgn s VAL 10 N 1.01 3.12 -0.61 -0.44 0.11 0.82 -1.36 120.40 123.05 1lgn s VAL 10 Ca 0.28 -0.94 -0.20 0.00 -2.93 0.00 0.00 61.98 58.20 1lgn s VAL 10 Cb -0.16 -2.58 0.10 0.00 -1.53 0.00 0.00 36.38 32.20 1lgn s VAL 10 CO 0.12 0.18 0.77 -0.36 -3.33 0.00 0.00 175.10 172.48 1lgn s PHE 11 N 1.37 2.92 -1.24 1.54 0.40 -0.19 -2.00 117.98 120.76 1lgn s PHE 11 Ca 0.01 -0.86 0.18 0.00 -0.60 0.00 0.00 56.93 55.66 1lgn s PHE 11 Cb -0.17 -4.09 0.87 0.00 0.51 0.00 0.00 43.02 40.14 1lgn s PHE 11 CO -0.03 -1.39 1.57 -2.30 0.70 0.00 0.00 175.22 173.78 1lgn n PRO 12 N 6.68 0.15 -3.48 0.24 -0.02 -1.26 -2.10 135.00 135.21 1lgn n PRO 12 Ca -0.08 0.14 -0.12 0.00 -2.02 0.00 0.00 63.50 61.43 1lgn n PRO 12 Cb 0.43 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.38 1lgn n PRO 12 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1lgn s ARG 13 N -2.76 1.22 0.02 -0.52 1.70 -1.26 -4.99 118.95 112.36 1lgn s ARG 13 Ca 0.14 -0.52 -0.30 0.00 -0.47 0.00 0.00 55.73 54.58 1lgn s ARG 13 Cb 0.12 0.56 -0.05 0.00 -0.57 0.00 0.00 34.95 35.01 1lgn s ARG 13 CO 0.30 -0.52 1.16 -2.00 -1.08 0.00 0.00 175.30 173.16 1lgn s GLU 14 N -3.71 4.44 0.35 3.89 2.12 -1.26 -4.83 118.70 119.69 1lgn s GLU 14 Ca 0.01 1.69 -0.17 0.00 0.36 0.00 0.00 54.97 56.85 1lgn s GLU 14 Cb -0.00 -3.42 0.05 0.00 0.26 0.00 0.00 34.13 31.02 1lgn s GLU 14 CO -0.12 -0.27 0.79 -1.54 -0.54 0.00 0.00 175.26 173.58 1lgn s SER 15 N 1.15 -0.05 -0.19 -1.70 1.04 -1.26 -5.01 113.70 107.67 1lgn s SER 15 Ca 0.57 -1.00 0.14 0.00 0.48 0.00 0.00 55.95 56.14 1lgn s SER 15 Cb -0.27 0.80 0.43 0.00 0.10 0.00 0.00 66.02 67.09 1lgn s SER 15 CO 0.27 -1.57 1.20 0.55 0.98 0.00 0.00 173.24 174.67 1lgn n VAL 16 N -0.52 1.78 0.06 5.02 3.14 -1.26 -4.63 118.33 121.92 1lgn n VAL 16 Ca -0.07 -2.95 0.00 0.00 -2.96 0.00 0.00 64.34 58.35 1lgn n VAL 16 Cb 0.60 -0.06 0.00 0.00 -1.06 0.00 0.00 33.84 33.31 1lgn n VAL 16 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1lgn n THR 17 N -0.71 0.23 -2.07 1.55 -1.04 -1.26 -4.87 114.28 106.11 1lgn n THR 17 Ca 0.20 0.07 -0.40 0.00 -2.04 0.00 0.00 64.05 61.88 1lgn n THR 17 Cb 0.83 -0.89 -0.02 0.00 -1.82 0.00 0.00 70.33 68.44 1lgn n THR 17 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1lgn s ASP 18 N -5.18 6.66 -0.09 8.00 1.01 -1.26 -4.54 116.67 121.27 1lgn s ASP 18 Ca 0.00 2.72 -0.33 0.00 0.71 0.00 0.00 52.55 55.65 1lgn s ASP 18 Cb 0.00 -2.65 0.14 0.00 1.01 0.00 0.00 42.92 41.42 1lgn s ASP 18 CO 0.00 -0.62 1.39 -1.38 0.21 0.00 0.00 175.17 174.77 1lgn s HIS 19 N -1.16 -0.02 -0.01 4.23 -3.43 0.59 -4.56 115.29 110.93 1lgn s HIS 19 Ca 0.51 -0.02 0.05 0.00 -0.80 0.00 0.00 55.06 54.80 1lgn s HIS 19 Cb -0.40 0.51 -0.01 0.00 -1.43 0.00 0.00 32.58 31.25 1lgn s HIS 19 CO 0.53 -0.09 -0.17 0.08 -2.00 0.00 0.00 174.74 173.09 1lgn s VAL 20 N -2.15 1.34 -0.27 -5.38 1.01 -0.56 -1.08 120.40 113.31 1lgn s VAL 20 Ca 0.14 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 1lgn s VAL 20 Cb 0.06 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1lgn s VAL 20 CO -0.06 0.37 0.11 0.20 0.00 0.00 0.00 175.10 175.72 1lgn s ASN 21 N -0.43 5.37 -0.09 3.32 0.01 -0.12 -1.14 114.94 121.86 1lgn s ASN 21 Ca 0.06 -0.24 -0.18 0.00 -0.71 0.00 0.00 52.86 51.79 1lgn s ASN 21 Cb -0.07 -1.97 -0.05 0.00 0.41 0.00 0.00 41.25 39.58 1lgn s ASN 21 CO -0.01 -0.07 0.49 -0.76 -1.51 0.00 0.00 177.10 175.24 1lgn s LEU 22 N 1.64 4.32 -0.19 0.60 1.02 -0.49 -0.15 118.68 125.42 1lgn s LEU 22 Ca 0.06 0.88 -0.03 0.00 0.02 0.00 0.00 54.13 55.06 1lgn s LEU 22 Cb -0.16 -2.71 -0.01 0.00 0.02 0.00 0.00 46.19 43.33 1lgn s LEU 22 CO 0.05 0.05 -0.06 -0.63 0.02 0.00 0.00 176.35 175.79 1lgn s ILE 23 N 0.32 3.38 0.00 -0.59 1.01 0.12 -4.20 121.20 121.25 1lgn s ILE 23 Ca 0.26 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.41 1lgn s ILE 23 Cb -0.16 -2.51 -0.00 0.00 0.01 0.00 0.00 42.46 39.80 1lgn s ILE 23 CO 0.12 0.45 -0.00 0.28 0.00 0.00 0.00 174.94 175.78 1lgn s THR 24 N 1.10 0.02 -1.57 2.92 -1.32 -1.26 -4.53 115.64 111.00 1lgn s THR 24 Ca 0.01 -0.17 -0.09 0.00 -1.21 0.00 0.00 61.69 60.23 1lgn s THR 24 Cb -0.15 -0.06 -0.06 0.00 -1.51 0.00 0.00 72.50 70.72 1lgn s THR 24 CO -0.01 -0.09 2.90 -0.81 -2.21 0.00 0.00 174.62 174.40 1lgn n PRO 25 N 2.81 3.80 -2.92 7.08 -0.04 -1.26 -4.86 135.00 139.61 1lgn n PRO 25 Ca -0.14 -2.35 -0.44 0.00 -0.04 0.00 0.00 63.50 60.53 1lgn n PRO 25 Cb 0.59 -2.77 -0.03 0.00 -0.04 0.00 0.00 33.50 31.25 1lgn n PRO 25 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1lgn s LEU 26 N -0.13 4.89 -0.02 1.53 2.96 -1.26 -4.79 118.68 121.86 1lgn s LEU 26 Ca 0.68 -1.68 0.21 0.00 -0.22 0.00 0.00 54.13 53.12 1lgn s LEU 26 Cb 0.18 -2.40 -0.28 0.00 0.50 0.00 0.00 46.19 44.20 1lgn s LEU 26 CO -0.06 -1.18 0.51 -0.62 -1.32 0.00 0.00 176.35 173.67 1lgn n GLU 27 N 6.87 0.66 -4.74 1.98 1.02 -1.26 -0.06 120.64 125.10 1lgn n GLU 27 Ca 0.13 -0.12 -0.33 0.00 -0.02 0.00 0.00 57.16 56.82 1lgn n GLU 27 Cb 0.47 -1.57 -0.12 0.00 -0.02 0.00 0.00 31.44 30.20 1lgn n GLU 27 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1lgn s LYS 28 N -3.34 2.80 0.34 3.49 2.20 -1.26 -4.68 119.74 119.29 1lgn s LYS 28 Ca -0.07 -0.63 -0.27 0.00 -0.36 0.00 0.00 55.97 54.65 1lgn s LYS 28 Cb 0.12 -2.53 -0.13 0.00 -1.51 0.00 0.00 37.83 33.79 1lgn s LYS 28 CO 0.88 0.56 1.06 -2.30 -0.36 0.00 0.00 175.35 175.19 1lgn n PRO 29 N 2.53 1.51 -2.76 4.03 -0.02 -1.26 -4.64 135.00 134.38 1lgn n PRO 29 Ca -0.18 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 1lgn n PRO 29 Cb 0.53 -2.01 -0.04 0.00 -0.02 0.00 0.00 33.50 31.96 1lgn n PRO 29 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1lgn s LEU 30 N -0.15 4.50 -0.00 2.45 2.96 0.23 -4.87 118.68 123.80 1lgn s LEU 30 Ca 0.59 1.76 0.00 0.00 -0.22 0.00 0.00 54.13 56.26 1lgn s LEU 30 Cb -0.62 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 42.52 1lgn s LEU 30 CO 0.59 -0.05 -0.00 1.67 -1.32 0.00 0.00 176.35 177.24 1lgn n GLN 31 N 2.75 2.38 -4.04 1.98 7.27 -1.26 -0.56 117.38 125.90 1lgn n GLN 31 Ca 0.02 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.99 1lgn n GLN 31 Cb 0.49 -1.00 -0.11 0.00 2.41 0.00 0.00 30.24 32.03 1lgn n GLN 31 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 1lgn s ASN 32 N -3.42 0.53 -0.06 1.69 0.01 -1.26 -0.91 114.94 111.51 1lgn s ASN 32 Ca -0.00 -0.67 -0.31 0.00 -0.71 0.00 0.00 52.86 51.17 1lgn s ASN 32 Cb 0.00 0.10 0.12 0.00 0.41 0.00 0.00 41.25 41.88 1lgn s ASN 32 CO 0.00 -0.36 1.14 0.72 -1.51 0.00 0.00 177.10 177.10 1lgn s PHE 33 N -2.16 -0.14 -0.07 2.20 -0.12 -0.76 -4.25 117.98 112.67 1lgn s PHE 33 Ca -0.07 0.03 -0.04 0.00 -0.05 0.00 0.00 56.93 56.80 1lgn s PHE 33 Cb -0.05 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 42.92 1lgn s PHE 33 CO -0.03 -0.36 0.17 0.99 -0.05 0.00 0.00 175.22 175.93 1lgn s THR 34 N -2.65 -0.04 -0.08 -4.49 2.01 -0.75 -2.09 115.64 107.56 1lgn s THR 34 Ca 0.10 0.13 0.03 0.00 0.31 0.00 0.00 61.69 62.26 1lgn s THR 34 Cb 0.01 -0.26 0.01 0.00 0.01 0.00 0.00 72.50 72.26 1lgn s THR 34 CO -0.04 0.05 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.56 1lgn s LEU 35 N 0.91 1.78 0.02 4.42 2.96 0.49 -1.44 118.68 127.81 1lgn s LEU 35 Ca -0.07 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.48 1lgn s LEU 35 Cb -0.09 -1.01 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 1lgn s LEU 35 CO -0.05 0.07 -0.07 0.00 -1.32 0.00 0.00 176.35 174.98 1lgn s PHE 37 N -0.65 -0.17 0.03 0.00 -0.12 -0.07 -1.19 117.98 115.81 1lgn s PHE 37 Ca -0.02 0.07 0.03 0.00 -0.05 0.00 0.00 56.93 56.96 1lgn s PHE 37 Cb -0.05 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 1lgn s PHE 37 CO 0.00 -0.35 -0.04 1.03 -0.05 0.00 0.00 175.22 175.81 1lgn s ARG 38 N -2.66 2.57 0.00 1.99 0.52 -0.15 -1.10 118.95 120.12 1lgn s ARG 38 Ca 0.09 -0.74 -0.03 0.00 -0.52 0.00 0.00 55.73 54.53 1lgn s ARG 38 Cb -0.00 -2.53 -0.01 0.00 0.52 0.00 0.00 34.95 32.93 1lgn s ARG 38 CO -0.05 0.59 0.05 0.00 0.02 0.00 0.00 175.30 175.91 1lgn s ALA 39 N -1.10 -0.10 -0.15 2.13 0.00 -0.64 -1.64 121.76 120.27 1lgn s ALA 39 Ca 0.20 -0.22 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 1lgn s ALA 39 Cb -0.11 0.06 0.06 0.00 0.00 0.00 0.00 23.12 23.13 1lgn s ALA 39 CO 0.11 -0.14 0.11 -0.47 0.00 0.00 0.00 175.76 175.38 1lgn s TYR 40 N -0.99 0.06 -0.06 0.00 5.04 -0.48 -0.88 117.35 120.03 1lgn s TYR 40 Ca -0.11 -0.04 -0.22 0.00 -2.44 0.00 0.00 57.07 54.26 1lgn s TYR 40 Cb -0.06 -0.56 0.05 0.00 0.35 0.00 0.00 41.96 41.73 1lgn s TYR 40 CO 0.00 -0.45 0.50 0.45 -1.34 0.00 0.00 175.55 174.71 1lgn s SER 41 N 2.19 -0.44 -0.30 4.32 0.15 -1.26 -0.67 113.70 117.68 1lgn s SER 41 Ca 0.03 0.52 0.09 0.00 0.70 0.00 0.00 55.95 57.29 1lgn s SER 41 Cb -0.15 0.54 0.52 0.00 -1.71 0.00 0.00 66.02 65.22 1lgn s SER 41 CO -0.08 -0.46 1.49 -0.90 1.20 0.00 0.00 173.24 174.49 1lgn n ASP 42 N 1.41 2.59 -4.73 5.45 5.68 -1.26 -4.55 116.55 121.13 1lgn n ASP 42 Ca -0.19 -3.75 -0.41 0.00 -0.50 0.00 0.00 54.79 49.94 1lgn n ASP 42 Cb 0.56 -0.65 -0.04 0.00 -1.14 0.00 0.00 41.12 39.86 1lgn n ASP 42 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1lgn s LEU 43 N -3.24 4.48 -0.04 -2.12 2.96 -1.26 -4.95 118.68 114.50 1lgn s LEU 43 Ca 0.45 1.92 0.07 0.00 -0.22 0.00 0.00 54.13 56.36 1lgn s LEU 43 Cb 0.41 -3.59 -0.24 0.00 0.50 0.00 0.00 46.19 43.27 1lgn s LEU 43 CO 0.01 -0.17 0.66 0.28 -1.32 0.00 0.00 176.35 175.80 1lgn h SER 44 N 5.57 0.11 -3.66 3.68 0.02 -2.00 -3.48 113.55 113.78 1lgn h SER 44 Ca -0.43 -0.22 -0.42 0.00 -0.84 0.00 0.00 61.79 59.87 1lgn h SER 44 Cb 1.21 -0.03 0.18 0.00 0.14 0.00 0.00 62.40 63.90 1lgn h SER 44 CO 0.73 1.19 0.20 0.00 -1.14 0.00 0.00 176.83 177.81 1lgn s ARG 45 N -2.60 -0.66 0.44 3.45 1.70 -1.26 -4.72 118.95 115.31 1lgn s ARG 45 Ca -0.08 -0.08 -0.21 0.00 -0.47 0.00 0.00 55.73 54.90 1lgn s ARG 45 Cb 0.08 -1.66 -0.11 0.00 -0.57 0.00 0.00 34.95 32.69 1lgn s ARG 45 CO 0.82 -3.33 0.96 0.00 -1.08 0.00 0.00 175.30 172.66 1lgn s ALA 46 N -3.18 3.03 0.03 7.88 0.00 -1.26 -4.81 121.76 123.44 1lgn s ALA 46 Ca 0.71 0.39 -0.26 0.00 0.00 0.00 0.00 51.96 52.80 1lgn s ALA 46 Cb -0.09 -3.15 0.06 0.00 0.00 0.00 0.00 23.12 19.93 1lgn s ALA 46 CO 0.55 0.07 0.59 1.52 0.00 0.00 0.00 175.76 178.49 1lgn s TYR 47 N -2.21 -0.53 -0.00 0.00 -0.85 -1.05 -4.51 117.35 108.20 1lgn s TYR 47 Ca 0.62 0.70 -0.28 0.00 -0.52 0.00 0.00 57.07 57.60 1lgn s TYR 47 Cb -0.10 0.40 -0.04 0.00 0.38 0.00 0.00 41.96 42.61 1lgn s TYR 47 CO 0.15 -0.66 0.88 0.45 -1.52 0.00 0.00 175.55 174.85 1lgn s SER 48 N -1.77 7.26 -0.13 -0.18 0.15 -0.61 -1.66 113.70 116.75 1lgn s SER 48 Ca -0.07 1.52 -0.08 0.00 0.70 0.00 0.00 55.95 58.02 1lgn s SER 48 Cb -0.01 -2.52 -0.26 0.00 -1.71 0.00 0.00 66.02 61.53 1lgn s SER 48 CO 0.01 -0.17 0.34 0.18 1.20 0.00 0.00 173.24 174.80 1lgn n LEU 49 N 3.66 2.59 -3.44 3.45 7.99 0.08 -4.50 117.00 126.84 1lgn n LEU 49 Ca 0.03 0.22 -0.08 0.00 -0.01 0.00 0.00 56.01 56.16 1lgn n LEU 49 Cb 0.51 -1.11 -0.08 0.00 -0.11 0.00 0.00 43.42 42.63 1lgn n LEU 49 CO 0.50 0.82 -0.02 0.12 -1.51 0.00 0.00 177.39 177.30 1lgn s PHE 50 N -2.54 -0.85 -0.14 -1.77 2.19 -1.00 -4.67 117.98 109.19 1lgn s PHE 50 Ca -0.23 1.08 -0.06 0.00 0.33 0.00 0.00 56.93 58.05 1lgn s PHE 50 Cb 0.07 0.13 -0.04 0.00 -1.31 0.00 0.00 43.02 41.87 1lgn s PHE 50 CO 0.75 -0.65 0.06 0.45 1.83 0.00 0.00 175.22 177.66 1lgn s SER 51 N 2.58 5.68 -0.25 6.13 0.15 -1.11 -1.19 113.70 125.69 1lgn s SER 51 Ca 0.09 0.18 -0.03 0.00 0.70 0.00 0.00 55.95 56.89 1lgn s SER 51 Cb -0.14 -1.85 0.10 0.00 -1.71 0.00 0.00 66.02 62.42 1lgn s SER 51 CO -0.15 0.28 0.20 -0.47 1.20 0.00 0.00 173.24 174.30 1lgn s TYR 52 N -0.29 -0.10 0.13 3.44 6.14 -0.34 -1.65 117.35 124.68 1lgn s TYR 52 Ca 0.08 -0.29 0.10 0.00 0.64 0.00 0.00 57.07 57.60 1lgn s TYR 52 Cb -0.12 -0.59 -0.04 0.00 0.42 0.00 0.00 41.96 41.63 1lgn s TYR 52 CO 0.02 -0.75 -0.20 -0.80 0.64 0.00 0.00 175.55 174.45 1lgn s ASN 53 N 2.25 3.74 0.31 4.32 -0.87 -0.69 -1.82 114.94 122.18 1lgn s ASN 53 Ca 0.08 -0.63 0.08 0.00 -1.57 0.00 0.00 52.86 50.81 1lgn s ASN 53 Cb -0.15 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.25 40.56 1lgn s ASN 53 CO -0.25 0.17 -0.07 0.42 -2.57 0.00 0.00 177.10 174.80 1lgn s THR 54 N -1.19 1.88 0.20 1.60 -4.23 -1.16 0.39 115.64 113.14 1lgn s THR 54 Ca 0.18 -2.15 -0.32 0.00 -1.18 0.00 0.00 61.69 58.21 1lgn s THR 54 Cb -0.10 -2.57 -0.13 0.00 1.34 0.00 0.00 72.50 71.04 1lgn s THR 54 CO 0.09 -0.23 1.62 1.67 -0.54 0.00 0.00 174.62 177.23 1lgn n GLN 55 N -0.69 2.45 -0.73 3.99 7.27 -1.26 -1.51 117.38 126.90 1lgn n GLN 55 Ca -0.05 0.88 0.00 0.00 0.07 0.00 0.00 57.00 57.90 1lgn n GLN 55 Cb 0.64 -2.67 0.00 0.00 2.41 0.00 0.00 30.24 30.62 1lgn n GLN 55 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1lgn n GLY 56 N 3.34 0.79 3.09 1.69 0.00 -1.26 -4.96 105.19 107.87 1lgn n GLY 56 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1lgn n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lgn s ARG 57 N -0.32 2.67 -0.04 1.61 1.81 -0.57 -5.12 118.95 118.99 1lgn s ARG 57 Ca 0.00 -0.71 -0.03 0.00 -1.72 0.00 0.00 55.73 53.27 1lgn s ARG 57 Cb 0.00 -2.31 -0.04 0.00 -0.45 0.00 0.00 34.95 32.15 1lgn s ARG 57 CO 0.00 -0.17 0.10 0.34 -0.68 0.00 0.00 175.30 174.89 1lgn s ASP 58 N 1.24 5.92 -1.22 0.23 2.15 -1.26 -2.97 116.67 120.76 1lgn s ASP 58 Ca 0.02 0.26 -0.08 0.00 0.43 0.00 0.00 52.55 53.18 1lgn s ASP 58 Cb -0.14 -1.79 -0.01 0.00 -0.30 0.00 0.00 42.92 40.68 1lgn s ASP 58 CO -0.09 0.32 0.75 0.59 -0.17 0.00 0.00 175.17 176.56 1lgn n ASN 59 N 1.45 -3.28 -0.03 -0.34 3.02 -1.26 -4.16 115.26 110.66 1lgn n ASN 59 Ca -0.15 -0.88 -0.17 0.00 -0.03 0.00 0.00 54.58 53.35 1lgn n ASN 59 Cb 0.53 -3.96 -0.07 0.00 -0.61 0.00 0.00 39.78 35.67 1lgn n ASN 59 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1lgn h GLU 60 N -1.75 0.77 -1.93 3.52 4.57 -1.70 0.39 114.58 118.44 1lgn h GLU 60 Ca -0.63 -0.62 -0.17 0.00 -1.18 0.00 0.00 59.36 56.76 1lgn h GLU 60 Cb 1.35 0.13 -0.30 0.00 -0.16 0.00 0.00 28.75 29.77 1lgn h GLU 60 CO 0.52 1.23 -0.50 -1.17 -1.18 0.00 0.00 179.01 177.92 1lgn s LEU 61 N -8.46 -0.60 -0.05 1.64 2.96 -0.76 -0.45 118.68 112.97 1lgn s LEU 61 Ca -0.11 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1lgn s LEU 61 Cb 0.08 1.05 0.02 0.00 0.50 0.00 0.00 46.19 47.85 1lgn s LEU 61 CO 0.90 -0.31 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.38 1lgn s LEU 62 N 2.53 1.07 -0.42 -0.68 2.96 -1.05 -1.20 118.68 121.90 1lgn s LEU 62 Ca 0.12 -0.10 -0.12 0.00 -0.22 0.00 0.00 54.13 53.81 1lgn s LEU 62 Cb -0.15 -0.41 0.05 0.00 0.50 0.00 0.00 46.19 46.18 1lgn s LEU 62 CO -0.17 -0.11 0.28 -0.69 -1.32 0.00 0.00 176.35 174.35 1lgn s VAL 63 N 1.26 4.74 -0.01 1.68 1.01 -0.34 -1.06 120.40 127.69 1lgn s VAL 63 Ca -0.06 -1.03 0.07 0.00 0.00 0.00 0.00 61.98 60.97 1lgn s VAL 63 Cb -0.14 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1lgn s VAL 63 CO -0.02 -0.40 -0.24 -0.47 0.00 0.00 0.00 175.10 173.97 1lgn s TYR 64 N 1.56 2.41 -0.38 5.22 5.04 -0.67 -0.74 117.35 129.78 1lgn s TYR 64 Ca 0.03 -0.37 -0.09 0.00 -2.44 0.00 0.00 57.07 54.20 1lgn s TYR 64 Cb -0.21 -1.50 0.05 0.00 0.35 0.00 0.00 41.96 40.65 1lgn s TYR 64 CO 0.06 0.06 0.20 0.21 -1.34 0.00 0.00 175.55 174.73 1lgn s LYS 65 N -0.83 2.69 0.12 4.97 2.20 -0.67 -0.52 119.74 127.70 1lgn s LYS 65 Ca 0.11 -1.24 -0.19 0.00 -0.36 0.00 0.00 55.97 54.28 1lgn s LYS 65 Cb -0.10 -3.68 -0.06 0.00 -1.51 0.00 0.00 37.83 32.48 1lgn s LYS 65 CO 0.00 -0.78 1.74 0.93 -0.36 0.00 0.00 175.35 176.88 1lgn h GLU 66 N 8.37 0.30 0.00 4.03 4.39 -1.79 -2.77 114.58 127.11 1lgn h GLU 66 Ca -0.24 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.53 1lgn h GLU 66 Cb 1.09 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.66 1lgn h GLU 66 CO 0.68 0.24 0.25 2.89 -1.16 0.00 0.00 179.01 181.92 1lgn n ARG 67 N -4.90 0.10 -1.82 2.33 1.85 -1.25 -4.23 116.66 108.74 1lgn n ARG 67 Ca -0.03 -0.30 -0.42 0.00 -1.00 0.00 0.00 57.85 56.10 1lgn n ARG 67 Cb 0.05 0.46 -0.03 0.00 -1.05 0.00 0.00 32.46 31.89 1lgn n ARG 67 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1lgn s VAL 68 N -2.20 2.26 -1.41 8.89 1.01 -1.26 -2.46 120.40 125.23 1lgn s VAL 68 Ca 0.09 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1lgn s VAL 68 Cb -0.00 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1lgn s VAL 68 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1lgn n GLY 69 N 3.23 0.93 2.61 4.51 0.00 -1.26 -4.97 105.19 110.25 1lgn n GLY 69 Ca 0.12 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1lgn n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lgn s GLU 70 N -3.69 0.08 -0.09 1.61 2.12 -1.03 -0.65 118.70 117.05 1lgn s GLU 70 Ca 0.00 -0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.24 1lgn s GLU 70 Cb 0.00 -1.74 -0.03 0.00 0.26 0.00 0.00 34.13 32.62 1lgn s GLU 70 CO 0.00 -0.69 -0.09 0.71 -0.54 0.00 0.00 175.26 174.65 1lgn s TYR 71 N 2.15 2.88 0.11 5.30 1.51 -0.88 -2.51 117.35 125.91 1lgn s TYR 71 Ca 0.03 -0.20 0.09 0.00 -1.01 0.00 0.00 57.07 55.97 1lgn s TYR 71 Cb -0.16 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.89 1lgn s TYR 71 CO -0.11 0.13 -0.17 -1.12 -1.11 0.00 0.00 175.55 173.17 1lgn s SER 72 N -0.36 3.95 -0.05 2.29 0.01 0.32 -1.20 113.70 118.67 1lgn s SER 72 Ca 0.05 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 56.81 1lgn s SER 72 Cb -0.12 -0.59 0.01 0.00 0.21 0.00 0.00 66.02 65.52 1lgn s SER 72 CO 0.02 0.18 -0.12 -0.22 0.41 0.00 0.00 173.24 173.52 1lgn s LEU 73 N -2.10 1.70 -0.13 2.44 2.96 0.49 -1.68 118.68 122.36 1lgn s LEU 73 Ca 0.18 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1lgn s LEU 73 Cb -0.11 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.79 1lgn s LEU 73 CO 0.10 0.05 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.77 1lgn s TYR 74 N 0.48 2.86 -0.19 5.38 1.51 -0.23 -0.88 117.35 126.28 1lgn s TYR 74 Ca -0.11 -0.50 -0.01 0.00 -1.01 0.00 0.00 57.07 55.45 1lgn s TYR 74 Cb -0.14 -1.85 0.05 0.00 -0.11 0.00 0.00 41.96 39.92 1lgn s TYR 74 CO 0.03 -0.12 -0.02 0.42 -1.11 0.00 0.00 175.55 174.75 1lgn s ILE 75 N 0.21 1.02 -1.15 2.71 -1.09 0.42 -2.51 121.20 120.80 1lgn s ILE 75 Ca -0.07 -0.75 -0.11 0.00 -2.23 0.00 0.00 60.65 57.49 1lgn s ILE 75 Cb -0.15 -1.33 -0.03 0.00 -1.58 0.00 0.00 42.46 39.38 1lgn s ILE 75 CO 0.05 -0.04 0.81 0.61 -1.23 0.00 0.00 174.94 175.13 1lgn n GLY 76 N 4.88 -0.87 3.94 6.18 0.00 0.40 -1.31 105.19 118.42 1lgn n GLY 76 Ca -0.11 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1lgn n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lgn n ARG 77 N -3.91 0.00 -3.52 1.61 1.74 0.12 -4.95 116.66 107.75 1lgn n ARG 77 Ca -0.14 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.69 1lgn n ARG 77 Cb 0.62 -3.98 -0.02 0.00 -1.02 0.00 0.00 32.46 28.06 1lgn n ARG 77 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1lgn s HIS 78 N -1.57 3.49 0.01 -1.55 3.76 -0.43 -5.08 115.29 113.91 1lgn s HIS 78 Ca 0.00 0.35 0.00 0.00 -0.15 0.00 0.00 55.06 55.27 1lgn s HIS 78 Cb 0.00 -1.88 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 1lgn s HIS 78 CO 0.00 0.24 -0.01 0.21 -0.85 0.00 0.00 174.74 174.33 1lgn s LYS 79 N -3.87 0.10 0.04 1.40 2.20 -1.26 -0.44 119.74 117.91 1lgn s LYS 79 Ca 0.39 -0.16 0.04 0.00 -0.36 0.00 0.00 55.97 55.88 1lgn s LYS 79 Cb -0.10 0.00 -0.02 0.00 -1.51 0.00 0.00 37.83 36.20 1lgn s LYS 79 CO 0.32 -0.01 -0.12 0.14 -0.36 0.00 0.00 175.35 175.33 1lgn s VAL 80 N -0.37 0.92 -0.04 4.02 -7.23 -0.06 -4.97 120.40 112.67 1lgn s VAL 80 Ca -0.04 -1.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1lgn s VAL 80 Cb -0.03 -0.87 0.02 0.00 0.56 0.00 0.00 36.38 36.06 1lgn s VAL 80 CO -0.00 -0.11 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.72 1lgn s THR 81 N -0.97 0.65 -0.00 5.32 2.01 -1.26 -0.38 115.64 121.00 1lgn s THR 81 Ca -0.02 -0.22 0.05 0.00 0.31 0.00 0.00 61.69 61.82 1lgn s THR 81 Cb -0.08 -0.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.78 1lgn s THR 81 CO 0.01 0.24 -0.16 -0.44 -0.69 0.00 0.00 174.62 173.58 1lgn s SER 82 N 0.71 1.91 0.28 3.53 0.01 -0.34 -4.97 113.70 114.83 1lgn s SER 82 Ca -0.10 -0.32 -0.04 0.00 1.31 0.00 0.00 55.95 56.80 1lgn s SER 82 Cb -0.13 -0.20 -0.05 0.00 0.21 0.00 0.00 66.02 65.85 1lgn s SER 82 CO 0.01 0.18 0.53 -0.54 0.41 0.00 0.00 173.24 173.83 1lgn s LYS 83 N -0.50 3.60 0.02 12.44 1.02 -1.26 -2.07 119.74 132.99 1lgn s LYS 83 Ca 0.06 -0.08 -0.20 0.00 0.02 0.00 0.00 55.97 55.77 1lgn s LYS 83 Cb -0.07 -2.68 0.04 0.00 -0.52 0.00 0.00 37.83 34.61 1lgn s LYS 83 CO -0.00 0.24 0.45 0.54 -0.92 0.00 0.00 175.35 175.66 1lgn s VAL 84 N -2.07 0.04 -0.22 3.17 0.11 0.18 -4.74 120.40 116.86 1lgn s VAL 84 Ca 0.43 -0.35 -0.22 0.00 -2.93 0.00 0.00 61.98 58.90 1lgn s VAL 84 Cb -0.11 -0.89 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1lgn s VAL 84 CO 0.30 -0.19 0.71 -0.63 -3.33 0.00 0.00 175.10 171.96 1lgn s ILE 85 N -2.04 4.94 0.05 7.04 1.01 -1.26 -4.42 121.20 126.52 1lgn s ILE 85 Ca -0.08 1.33 -0.13 0.00 0.00 0.00 0.00 60.65 61.77 1lgn s ILE 85 Cb -0.02 -4.01 0.02 0.00 0.01 0.00 0.00 42.46 38.46 1lgn s ILE 85 CO 0.01 0.02 0.30 -1.83 0.00 0.00 0.00 174.94 173.44 1lgn s GLU 86 N 2.39 0.83 0.52 2.79 -1.05 -1.26 -5.05 118.70 117.88 1lgn s GLU 86 Ca 0.31 -0.56 -0.05 0.00 -0.15 0.00 0.00 54.97 54.52 1lgn s GLU 86 Cb -0.16 0.36 -0.02 0.00 -0.44 0.00 0.00 34.13 33.87 1lgn s GLU 86 CO 0.09 -0.27 0.83 0.15 0.95 0.00 0.00 175.26 177.01 1lgn s LYS 87 N -2.76 3.29 -0.06 -4.83 1.02 -1.26 -4.82 119.74 110.32 1lgn s LYS 87 Ca -0.04 0.10 -0.02 0.00 0.02 0.00 0.00 55.97 56.03 1lgn s LYS 87 Cb -0.00 -2.34 0.04 0.00 -0.52 0.00 0.00 37.83 35.01 1lgn s LYS 87 CO -0.05 -0.40 0.13 0.12 -0.92 0.00 0.00 175.35 174.23 1lgn s PHE 88 N -2.83 -0.12 0.45 3.18 5.36 -1.26 -4.09 117.98 118.67 1lgn s PHE 88 Ca 0.50 0.45 -0.02 0.00 -0.96 0.00 0.00 56.93 56.90 1lgn s PHE 88 Cb -0.10 -0.20 -0.02 0.00 -0.34 0.00 0.00 43.02 42.36 1lgn s PHE 88 CO 0.45 -0.19 0.70 -2.14 -1.46 0.00 0.00 175.22 172.58 1lgn s PRO 89 N 1.59 3.25 -0.22 10.12 0.02 -1.26 -5.19 135.00 143.31 1lgn s PRO 89 Ca -0.04 -0.23 -0.29 0.00 0.02 0.00 0.00 61.00 60.46 1lgn s PRO 89 Cb -0.12 -2.50 0.15 0.00 0.02 0.00 0.00 34.50 32.05 1lgn s PRO 89 CO -0.05 -0.22 1.12 0.00 -0.33 0.00 0.00 177.00 177.52 1lgn s ALA 90 N -2.60 -2.01 0.66 -1.55 0.00 -1.26 -5.10 121.76 109.90 1lgn s ALA 90 Ca 0.47 1.71 -0.16 0.00 0.00 0.00 0.00 51.96 53.97 1lgn s ALA 90 Cb -0.10 -1.09 -0.00 0.00 0.00 0.00 0.00 23.12 21.93 1lgn s ALA 90 CO 0.40 -0.27 1.18 -2.14 0.00 0.00 0.00 175.76 174.94 1lgn s PRO 91 N -0.82 2.63 0.04 0.00 0.02 -1.26 -4.63 135.00 130.98 1lgn s PRO 91 Ca 0.02 1.69 0.01 0.00 0.02 0.00 0.00 61.00 62.74 1lgn s PRO 91 Cb -0.02 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 1lgn s PRO 91 CO -0.03 -1.44 -0.05 0.54 -0.33 0.00 0.00 177.00 175.69 1lgn s VAL 92 N -1.93 0.33 -0.23 3.83 0.11 -0.06 -5.00 120.40 117.45 1lgn s VAL 92 Ca 0.74 -1.17 0.02 0.00 -2.93 0.00 0.00 61.98 58.63 1lgn s VAL 92 Cb -0.27 -0.66 0.05 0.00 -1.53 0.00 0.00 36.38 33.97 1lgn s VAL 92 CO 0.39 -0.55 -0.10 -2.28 -3.33 0.00 0.00 175.10 169.23 1lgn s HIS 93 N -1.92 2.78 -0.11 1.54 2.46 -1.26 -1.62 115.29 117.16 1lgn s HIS 93 Ca -0.09 -1.94 -0.02 0.00 0.47 0.00 0.00 55.06 53.48 1lgn s HIS 93 Cb -0.06 -1.76 -0.03 0.00 -0.13 0.00 0.00 32.58 30.60 1lgn s HIS 93 CO -0.02 -0.81 -0.03 0.42 -2.47 0.00 0.00 174.74 171.83 1lgn s ILE 94 N 1.27 4.03 -0.06 0.89 1.01 -0.26 -0.26 121.20 127.82 1lgn s ILE 94 Ca -0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1lgn s ILE 94 Cb -0.18 -2.72 0.03 0.00 0.01 0.00 0.00 42.46 39.60 1lgn s ILE 94 CO -0.07 0.55 0.02 0.00 0.00 0.00 0.00 174.94 175.45 1lgn s VAL 96 N 2.00 1.77 0.02 0.00 0.11 0.68 -0.45 120.40 124.53 1lgn s VAL 96 Ca 0.04 -0.96 0.02 0.00 -2.93 0.00 0.00 61.98 58.15 1lgn s VAL 96 Cb -0.12 -1.47 -0.01 0.00 -1.53 0.00 0.00 36.38 33.24 1lgn s VAL 96 CO -0.04 0.50 -0.06 -0.94 -3.33 0.00 0.00 175.10 171.23 1lgn s SER 97 N -0.53 0.66 0.04 3.54 1.04 -0.37 -0.38 113.70 117.69 1lgn s SER 97 Ca 0.09 -0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.21 1lgn s SER 97 Cb -0.09 -0.00 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 1lgn s SER 97 CO -0.01 -0.09 -0.07 0.86 0.98 0.00 0.00 173.24 174.91 1lgn s TRP 98 N -0.79 0.64 -0.15 5.02 -0.00 -0.89 -0.50 118.94 122.27 1lgn s TRP 98 Ca -0.05 -0.45 -0.04 0.00 -0.00 0.00 0.00 56.10 55.55 1lgn s TRP 98 Cb -0.06 -0.39 0.05 0.00 -0.00 0.00 0.00 33.47 33.07 1lgn s TRP 98 CO 0.00 -0.08 0.08 -2.00 -0.00 0.00 0.00 176.95 174.95 1lgn s GLU 99 N -1.41 0.14 0.21 5.86 2.12 -1.21 -1.83 118.70 122.57 1lgn s GLU 99 Ca -0.09 -0.06 -0.10 0.00 0.36 0.00 0.00 54.97 55.09 1lgn s GLU 99 Cb -0.09 -1.66 0.31 0.00 0.26 0.00 0.00 34.13 32.95 1lgn s GLU 99 CO 0.00 -0.61 1.67 1.03 -0.54 0.00 0.00 175.26 176.82 1lgn h SER 100 N 8.40 -0.18 -0.70 -1.70 0.87 -1.31 0.51 113.55 119.43 1lgn h SER 100 Ca -0.15 0.14 0.14 0.00 -1.23 0.00 0.00 61.79 60.69 1lgn h SER 100 Cb 1.14 0.24 -0.10 0.00 -0.44 0.00 0.00 62.40 63.24 1lgn h SER 100 CO 0.28 -0.08 0.19 0.77 -0.53 0.00 0.00 176.83 177.45 1lgn h SER 101 N 0.16 0.07 0.00 6.23 4.64 -1.91 0.60 113.55 123.34 1lgn h SER 101 Ca 0.33 0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.72 1lgn h SER 101 Cb 0.52 0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1lgn h SER 101 CO -0.49 0.01 -1.98 -1.54 -0.87 0.00 0.00 176.83 171.95 1lgn n SER 102 N -5.11 0.39 0.00 4.97 3.41 -1.08 -4.55 113.62 111.64 1lgn n SER 102 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 1lgn n SER 102 Cb 0.40 1.76 0.00 0.00 -0.26 0.00 0.00 64.21 66.12 1lgn n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lgn n GLY 103 N 1.44 0.68 3.63 5.00 0.00 0.18 -4.79 105.19 111.33 1lgn n GLY 103 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1lgn n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lgn s ILE 104 N -2.84 3.90 -0.05 -0.61 -1.09 -1.23 -0.45 121.20 118.83 1lgn s ILE 104 Ca 0.00 1.02 -0.17 0.00 -2.23 0.00 0.00 60.65 59.27 1lgn s ILE 104 Cb 0.00 -3.93 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 1lgn s ILE 104 CO 0.00 -0.39 0.45 0.00 -1.23 0.00 0.00 174.94 173.77 1lgn s ALA 105 N 4.85 3.58 -0.13 9.38 0.00 0.15 -3.34 121.76 136.25 1lgn s ALA 105 Ca 0.64 -0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 1lgn s ALA 105 Cb -0.21 -2.53 0.04 0.00 0.00 0.00 0.00 23.12 20.43 1lgn s ALA 105 CO 0.27 0.25 0.01 -2.00 0.00 0.00 0.00 175.76 174.28 1lgn s GLU 106 N -0.29 0.75 0.04 0.00 2.12 0.34 -2.42 118.70 119.24 1lgn s GLU 106 Ca 0.25 -0.16 -0.07 0.00 0.36 0.00 0.00 54.97 55.35 1lgn s GLU 106 Cb -0.16 -1.53 -0.05 0.00 0.26 0.00 0.00 34.13 32.65 1lgn s GLU 106 CO 0.12 -0.44 0.31 -0.06 -0.54 0.00 0.00 175.26 174.65 1lgn s PHE 107 N 1.89 3.57 -0.37 5.30 0.08 -1.26 -1.24 117.98 125.95 1lgn s PHE 107 Ca 0.02 0.61 0.00 0.00 0.12 0.00 0.00 56.93 57.69 1lgn s PHE 107 Cb -0.14 -2.02 0.12 0.00 -0.57 0.00 0.00 43.02 40.41 1lgn s PHE 107 CO -0.07 0.57 0.19 -1.58 -0.10 0.00 0.00 175.22 174.23 1lgn s TRP 108 N -1.36 1.34 -0.25 0.36 0.52 0.40 -1.61 118.94 118.34 1lgn s TRP 108 Ca 0.30 -1.85 -0.23 0.00 0.02 0.00 0.00 56.10 54.35 1lgn s TRP 108 Cb -0.13 -1.44 -0.01 0.00 -1.15 0.00 0.00 33.47 30.74 1lgn s TRP 108 CO 0.18 -0.82 0.74 0.42 0.02 0.00 0.00 176.95 177.48 1lgn s ILE 109 N 1.06 4.90 -1.31 2.03 -1.09 0.59 -2.77 121.20 124.61 1lgn s ILE 109 Ca 0.15 1.35 -0.08 0.00 -2.23 0.00 0.00 60.65 59.83 1lgn s ILE 109 Cb -0.22 -4.03 0.00 0.00 -1.58 0.00 0.00 42.46 36.63 1lgn s ILE 109 CO -0.09 -0.04 0.54 0.59 -1.23 0.00 0.00 174.94 174.71 1lgn n ASN 110 N 5.88 -2.01 -0.11 3.58 3.02 0.64 -0.81 115.26 125.45 1lgn n ASN 110 Ca 0.03 -1.03 -0.01 0.00 -0.03 0.00 0.00 54.58 53.53 1lgn n ASN 110 Cb 0.48 -3.06 -0.01 0.00 -0.61 0.00 0.00 39.78 36.59 1lgn n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lgn n GLY 111 N -1.90 0.33 3.25 7.41 0.00 -1.26 -4.98 105.19 108.04 1lgn n GLY 111 Ca -0.24 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1lgn n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lgn s THR 112 N -1.52 2.36 0.00 2.61 2.01 0.01 -4.99 115.64 116.12 1lgn s THR 112 Ca 0.00 -0.90 -0.29 0.00 0.31 0.00 0.00 61.69 60.81 1lgn s THR 112 Cb 0.00 -1.94 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1lgn s THR 112 CO 0.00 0.54 0.93 -2.16 -0.69 0.00 0.00 174.62 173.25 1lgn s PRO 113 N 0.46 4.55 0.72 4.92 0.04 -1.26 -0.30 135.00 144.14 1lgn s PRO 113 Ca -0.14 1.34 -0.03 0.00 0.04 0.00 0.00 61.00 62.21 1lgn s PRO 113 Cb -0.17 -3.45 0.11 0.00 0.04 0.00 0.00 34.50 31.04 1lgn s PRO 113 CO 0.06 -0.00 1.00 -0.51 0.04 0.00 0.00 177.00 177.59 1lgn s LEU 114 N 0.87 2.97 0.28 -3.56 1.43 -0.63 -4.96 118.68 115.07 1lgn s LEU 114 Ca 0.49 -0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 53.16 1lgn s LEU 114 Cb -0.21 -2.29 -0.10 0.00 0.03 0.00 0.00 46.19 43.62 1lgn s LEU 114 CO 0.27 -1.83 1.39 -0.69 0.23 0.00 0.00 176.35 175.72 1lgn s VAL 115 N -3.19 2.69 0.35 -1.59 1.01 -1.26 -4.68 120.40 113.73 1lgn s VAL 115 Ca 0.65 0.62 -0.27 0.00 0.00 0.00 0.00 61.98 62.98 1lgn s VAL 115 Cb -0.07 -3.40 -0.09 0.00 0.00 0.00 0.00 36.38 32.83 1lgn s VAL 115 CO 0.44 0.12 1.11 -0.54 0.00 0.00 0.00 175.10 176.24 1lgn s LYS 116 N -0.93 4.32 0.15 2.72 1.02 -1.26 -4.74 119.74 121.02 1lgn s LYS 116 Ca 0.55 1.75 0.05 0.00 0.02 0.00 0.00 55.97 58.34 1lgn s LYS 116 Cb -0.41 -2.85 -0.04 0.00 -0.52 0.00 0.00 37.83 34.01 1lgn s LYS 116 CO 0.47 -0.06 -0.10 0.15 -0.92 0.00 0.00 175.35 174.89 1lgn s LYS 117 N -2.01 1.08 0.00 1.68 -0.14 -1.01 -5.00 119.74 114.33 1lgn s LYS 117 Ca 0.52 -1.46 0.05 0.00 -1.36 0.00 0.00 55.97 53.72 1lgn s LYS 117 Cb -0.29 -0.63 -0.02 0.00 -1.68 0.00 0.00 37.83 35.21 1lgn s LYS 117 CO 0.37 0.07 -0.16 0.20 -0.76 0.00 0.00 175.35 175.07 1lgn s GLY 118 N -3.18 0.82 0.00 -3.33 0.00 -1.26 0.30 107.32 100.67 1lgn s GLY 118 Ca 0.17 -0.76 -0.25 0.00 0.00 0.00 0.00 44.72 43.88 1lgn s GLY 118 CO 0.01 -0.66 0.57 0.48 0.00 0.00 0.00 173.10 173.49 1lgn s LEU 119 N -0.62 -0.24 -1.23 0.66 2.34 0.40 -4.96 118.68 115.02 1lgn s LEU 119 Ca 0.05 0.40 -0.23 0.00 0.06 0.00 0.00 54.13 54.42 1lgn s LEU 119 Cb -0.07 2.22 0.02 0.00 -0.56 0.00 0.00 46.19 47.80 1lgn s LEU 119 CO 0.00 -0.64 0.64 0.54 -1.06 0.00 0.00 176.35 175.83 1lgn n ARG 120 N 0.72 -1.04 -2.10 1.48 1.74 -1.26 -4.54 116.66 111.65 1lgn n ARG 120 Ca -0.19 0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.73 1lgn n ARG 120 Cb 0.58 -3.46 -0.03 0.00 -1.02 0.00 0.00 32.46 28.53 1lgn n ARG 120 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1lgn s GLN 121 N -6.77 4.26 0.00 5.56 0.74 -1.26 -2.72 119.66 119.46 1lgn s GLN 121 Ca 0.39 2.12 0.00 0.00 0.05 0.00 0.00 55.36 57.92 1lgn s GLN 121 Cb -0.18 -3.53 0.00 0.00 1.10 0.00 0.00 33.01 30.40 1lgn s GLN 121 CO 0.92 -0.61 0.00 0.41 -0.55 0.00 0.00 175.29 175.46 1lgn n GLY 122 N 3.75 0.45 3.99 2.59 0.00 0.21 -4.97 105.19 111.21 1lgn n GLY 122 Ca 0.14 -0.97 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 1lgn n GLY 122 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lgn s TYR 123 N -2.00 3.04 -0.07 1.61 6.14 -1.10 -5.03 117.35 119.93 1lgn s TYR 123 Ca 0.00 -0.26 0.00 0.00 0.64 0.00 0.00 57.07 57.46 1lgn s TYR 123 Cb 0.00 -2.10 0.02 0.00 0.42 0.00 0.00 41.96 40.30 1lgn s TYR 123 CO 0.00 -0.13 -0.05 -0.06 0.64 0.00 0.00 175.55 175.95 1lgn s PHE 124 N -2.23 1.04 -0.03 4.97 0.08 -1.26 -4.72 117.98 115.82 1lgn s PHE 124 Ca 0.48 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.83 1lgn s PHE 124 Cb -0.10 -0.92 -0.04 0.00 -0.57 0.00 0.00 43.02 41.39 1lgn s PHE 124 CO 0.32 -0.34 1.26 0.14 -0.10 0.00 0.00 175.22 176.50 1lgn s VAL 125 N 1.41 4.07 0.34 -0.44 -7.23 0.28 -4.83 120.40 114.00 1lgn s VAL 125 Ca -0.02 1.42 -0.28 0.00 -1.81 0.00 0.00 61.98 61.29 1lgn s VAL 125 Cb -0.13 -3.91 -0.12 0.00 0.56 0.00 0.00 36.38 32.77 1lgn s VAL 125 CO -0.03 0.00 1.36 -0.62 -0.31 0.00 0.00 175.10 175.50 1lgn n GLU 126 N 5.18 2.29 -1.10 4.82 1.02 -1.26 -0.60 120.64 130.99 1lgn n GLU 126 Ca 0.11 0.80 -0.30 0.00 -0.02 0.00 0.00 57.16 57.76 1lgn n GLU 126 Cb 0.45 -2.44 0.25 0.00 -0.02 0.00 0.00 31.44 29.69 1lgn n GLU 126 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1lgn n ALA 127 N 0.55 -3.32 -3.48 0.62 0.00 -1.26 -4.60 120.51 109.02 1lgn n ALA 127 Ca 0.04 -1.64 -0.17 0.00 0.00 0.00 0.00 53.44 51.67 1lgn n ALA 127 Cb 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.71 1lgn n ALA 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1lgn n GLN 128 N -4.79 -1.57 -2.76 0.00 6.02 0.91 -4.89 117.38 110.31 1lgn n GLN 128 Ca 0.15 1.14 -0.21 0.00 -0.01 0.00 0.00 57.00 58.08 1lgn n GLN 128 Cb 0.59 -3.56 0.07 0.00 1.02 0.00 0.00 30.24 28.36 1lgn n GLN 128 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1lgn s PRO 129 N -3.94 2.18 -0.28 -1.09 0.04 -1.26 -4.59 135.00 126.07 1lgn s PRO 129 Ca 0.06 -1.17 0.01 0.00 0.04 0.00 0.00 61.00 59.93 1lgn s PRO 129 Cb -0.01 -2.50 0.08 0.00 0.04 0.00 0.00 34.50 32.11 1lgn s PRO 129 CO 0.84 -0.98 0.01 0.21 0.04 0.00 0.00 177.00 177.12 1lgn s LYS 130 N -4.84 1.39 -0.37 4.56 2.47 0.16 -4.94 119.74 118.18 1lgn s LYS 130 Ca 0.62 -1.26 -0.11 0.00 -1.56 0.00 0.00 55.97 53.65 1lgn s LYS 130 Cb -0.07 -2.63 0.02 0.00 -1.46 0.00 0.00 37.83 33.69 1lgn s LYS 130 CO 0.40 -0.78 0.21 0.42 0.16 0.00 0.00 175.35 175.76 1lgn s ILE 131 N 1.30 4.65 0.09 5.43 1.01 -1.26 -1.70 121.20 130.72 1lgn s ILE 131 Ca 0.02 -0.77 0.08 0.00 0.00 0.00 0.00 60.65 59.98 1lgn s ILE 131 Cb -0.19 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 1lgn s ILE 131 CO -0.11 -0.19 -0.16 0.68 0.00 0.00 0.00 174.94 175.16 1lgn s VAL 132 N 1.58 2.98 -0.07 2.92 -7.23 -0.66 -1.40 120.40 118.52 1lgn s VAL 132 Ca 0.03 -1.33 0.03 0.00 -1.81 0.00 0.00 61.98 58.89 1lgn s VAL 132 Cb -0.19 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 1lgn s VAL 132 CO 0.07 0.18 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.14 1lgn s LEU 133 N -1.93 2.70 0.00 1.32 1.02 -0.29 -2.74 118.68 118.75 1lgn s LEU 133 Ca 0.18 -0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1lgn s LEU 133 Cb -0.11 -1.56 0.00 0.00 0.02 0.00 0.00 46.19 44.54 1lgn s LEU 133 CO 0.09 0.29 0.00 0.61 0.02 0.00 0.00 176.35 177.36 1lgn n GLY 134 N 2.71 2.32 3.20 -3.19 0.00 -1.26 -1.49 105.19 107.48 1lgn n GLY 134 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1lgn n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lgn s GLN 135 N -0.83 0.95 -0.29 1.61 -1.52 -1.26 -2.49 119.66 115.83 1lgn s GLN 135 Ca 0.00 -1.31 -0.03 0.00 -1.95 0.00 0.00 55.36 52.07 1lgn s GLN 135 Cb 0.00 0.28 0.04 0.00 -0.22 0.00 0.00 33.01 33.11 1lgn s GLN 135 CO 0.00 -0.29 -0.00 -2.00 -0.25 0.00 0.00 175.29 172.75 1lgn s GLU 136 N -4.00 2.63 0.32 2.91 -6.30 -1.26 -4.58 118.70 108.41 1lgn s GLU 136 Ca 0.19 -1.14 -0.29 0.00 -2.50 0.00 0.00 54.97 51.24 1lgn s GLU 136 Cb 0.06 -3.17 -0.10 0.00 0.00 0.00 0.00 34.13 30.92 1lgn s GLU 136 CO -0.01 -0.54 1.25 -0.65 0.02 0.00 0.00 175.26 175.33 1lgn s GLN 137 N 1.31 4.42 0.00 4.30 -0.21 -1.26 -3.84 119.66 124.38 1lgn s GLN 137 Ca -0.03 2.10 0.00 0.00 0.02 0.00 0.00 55.36 57.45 1lgn s GLN 137 Cb -0.19 -3.09 0.00 0.00 1.00 0.00 0.00 33.01 30.73 1lgn s GLN 137 CO -0.01 -0.09 0.83 -0.25 -2.12 0.00 0.00 175.29 173.65 1lgn n ASP 138 N 0.88 1.54 -2.83 5.90 8.00 -0.15 -4.69 116.55 125.21 1lgn n ASP 138 Ca -0.00 -1.69 -0.13 0.00 0.71 0.00 0.00 54.79 53.68 1lgn n ASP 138 Cb 0.43 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.51 1lgn n ASP 138 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1lgn n SER 139 N -0.35 -1.46 -4.57 -2.24 3.41 -1.09 -4.91 113.62 102.41 1lgn n SER 139 Ca 0.00 -2.72 -0.35 0.00 -0.26 0.00 0.00 58.87 55.55 1lgn n SER 139 Cb 0.24 2.63 -0.03 0.00 -0.26 0.00 0.00 64.21 66.79 1lgn n SER 139 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1lgn s TYR 140 N -2.98 2.28 0.00 7.33 5.04 -1.26 -3.18 117.35 124.59 1lgn s TYR 140 Ca 0.25 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.50 1lgn s TYR 140 Cb -0.02 -4.37 0.00 0.00 0.35 0.00 0.00 41.96 37.93 1lgn s TYR 140 CO 0.18 -1.62 0.00 0.41 -1.34 0.00 0.00 175.55 173.17 1lgn n GLY 141 N 6.08 0.77 0.00 8.97 0.00 -1.26 -5.03 105.19 114.72 1lgn n GLY 141 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1lgn n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lgn n GLY 142 N -2.26 4.37 3.63 -0.02 0.00 -1.19 -4.99 105.19 104.73 1lgn n GLY 142 Ca 0.00 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 1lgn n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lgn n LYS 143 N 0.00 -1.30 -2.58 1.61 5.02 -1.26 -0.98 118.16 118.67 1lgn n LYS 143 Ca 0.00 0.52 -0.37 0.00 -2.02 0.00 0.00 58.31 56.43 1lgn n LYS 143 Cb 0.00 -4.26 -0.05 0.00 -0.02 0.00 0.00 35.03 30.70 1lgn n LYS 143 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1lgn s PHE 144 N -3.44 3.41 -0.18 2.13 0.08 -1.26 -2.85 117.98 115.88 1lgn s PHE 144 Ca 0.46 1.68 -0.04 0.00 0.12 0.00 0.00 56.93 59.16 1lgn s PHE 144 Cb -0.16 -3.11 -0.02 0.00 -0.57 0.00 0.00 43.02 39.17 1lgn s PHE 144 CO 0.85 -0.43 -0.04 0.34 -0.10 0.00 0.00 175.22 175.85 1lgn s ASP 145 N -1.46 4.61 0.36 1.36 -1.08 -1.25 -5.02 116.67 114.19 1lgn s ASP 145 Ca 0.54 -0.23 0.07 0.00 -0.52 0.00 0.00 52.55 52.41 1lgn s ASP 145 Cb -0.23 -1.77 0.68 0.00 -1.46 0.00 0.00 42.92 40.15 1lgn s ASP 145 CO 0.29 0.10 1.88 -0.09 0.52 0.00 0.00 175.17 177.87 1lgn h ARG 146 N 7.24 0.36 0.00 4.34 2.43 -1.95 -2.71 114.38 124.08 1lgn h ARG 146 Ca -0.34 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 1lgn h ARG 146 Cb 1.18 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1lgn h ARG 146 CO 0.61 0.47 0.00 -1.13 -1.51 0.00 0.00 179.97 178.41 1lgn n SER 147 N -4.26 0.00 0.00 -3.80 3.41 -1.26 -2.37 113.62 105.34 1lgn n SER 147 Ca 0.00 -1.35 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1lgn n SER 147 Cb 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1lgn n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lgn n GLN 148 N -0.72 0.81 -2.22 4.33 6.02 -1.03 -4.69 117.38 119.90 1lgn n GLN 148 Ca 0.09 -0.87 -0.40 0.00 -0.01 0.00 0.00 57.00 55.81 1lgn n GLN 148 Cb 0.04 -0.92 -0.02 0.00 1.02 0.00 0.00 30.24 30.36 1lgn n GLN 148 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1lgn s SER 149 N -0.41 6.81 -0.18 1.08 1.04 -1.00 -1.57 113.70 119.47 1lgn s SER 149 Ca 0.00 2.54 -0.14 0.00 0.48 0.00 0.00 55.95 58.83 1lgn s SER 149 Cb 0.00 -2.64 -0.05 0.00 0.10 0.00 0.00 66.02 63.44 1lgn s SER 149 CO 0.00 -0.49 0.29 0.12 0.98 0.00 0.00 173.24 174.14 1lgn s PHE 150 N -1.19 3.42 -0.13 5.02 2.19 -1.04 -4.74 117.98 121.51 1lgn s PHE 150 Ca 0.50 0.54 -0.00 0.00 0.33 0.00 0.00 56.93 58.30 1lgn s PHE 150 Cb -0.37 -2.36 0.02 0.00 -1.31 0.00 0.00 43.02 39.01 1lgn s PHE 150 CO 0.48 0.17 -0.11 0.54 1.83 0.00 0.00 175.22 178.13 1lgn s VAL 151 N 0.69 1.31 -3.18 3.12 0.11 -1.26 -4.81 120.40 116.38 1lgn s VAL 151 Ca 0.15 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.72 1lgn s VAL 151 Cb -0.13 -1.28 0.00 0.00 -1.53 0.00 0.00 36.38 33.44 1lgn s VAL 151 CO 0.04 0.40 0.00 0.61 -3.33 0.00 0.00 175.10 172.82 1lgn n GLY 152 N 4.85 -0.51 3.22 6.54 0.00 -0.89 -4.53 105.19 113.87 1lgn n GLY 152 Ca -0.15 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 1lgn n GLY 152 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lgn s GLU 153 N -1.88 1.14 -0.01 1.61 2.02 0.15 -1.03 118.70 120.70 1lgn s GLU 153 Ca 0.00 -0.95 0.01 0.00 0.02 0.00 0.00 54.97 54.05 1lgn s GLU 153 Cb 0.00 -1.25 0.00 0.00 0.10 0.00 0.00 34.13 32.98 1lgn s GLU 153 CO 0.00 0.31 -0.03 0.42 0.02 0.00 0.00 175.26 175.98 1lgn s ILE 154 N -0.96 0.25 0.35 -1.63 1.01 -0.47 -1.38 121.20 118.37 1lgn s ILE 154 Ca 0.05 -0.10 -0.13 0.00 0.00 0.00 0.00 60.65 60.47 1lgn s ILE 154 Cb -0.09 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.17 1lgn s ILE 154 CO 0.02 0.09 0.66 -0.83 0.00 0.00 0.00 174.94 174.89 1lgn s GLY 155 N 0.16 0.62 -1.54 6.18 0.00 -0.65 -0.74 107.32 111.34 1lgn s GLY 155 Ca -0.01 -0.91 -0.09 0.00 0.00 0.00 0.00 44.72 43.71 1lgn s GLY 155 CO -0.00 -0.50 0.60 1.22 0.00 0.00 0.00 173.10 174.42 1lgn n ASP 156 N -1.17 -1.83 -4.72 1.64 9.92 -1.26 -0.98 116.55 118.15 1lgn n ASP 156 Ca -0.05 -1.00 -0.41 0.00 -0.53 0.00 0.00 54.79 52.81 1lgn n ASP 156 Cb 0.60 -2.95 -0.04 0.00 -0.64 0.00 0.00 41.12 38.09 1lgn n ASP 156 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1lgn s LEU 157 N -7.13 4.40 -0.08 0.64 1.98 -1.26 -3.84 118.68 113.40 1lgn s LEU 157 Ca 0.35 1.54 -0.08 0.00 -2.89 0.00 0.00 54.13 53.05 1lgn s LEU 157 Cb -0.19 -3.40 0.02 0.00 0.66 0.00 0.00 46.19 43.28 1lgn s LEU 157 CO 0.90 -0.14 0.22 -0.31 -1.89 0.00 0.00 176.35 175.14 1lgn s TYR 158 N 0.56 -0.23 -0.05 5.38 1.51 -0.33 -2.24 117.35 121.95 1lgn s TYR 158 Ca 0.45 0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 57.05 1lgn s TYR 158 Cb -0.21 0.08 0.03 0.00 -0.11 0.00 0.00 41.96 41.75 1lgn s TYR 158 CO 0.25 -0.13 0.03 1.41 -1.11 0.00 0.00 175.55 176.00 1lgn s MET 159 N 0.02 0.21 0.20 -0.62 1.75 0.12 -1.54 119.30 119.44 1lgn s MET 159 Ca -0.01 0.26 0.06 0.00 -1.25 0.00 0.00 55.69 54.75 1lgn s MET 159 Cb -0.02 -0.69 -0.04 0.00 2.84 0.00 0.00 34.83 36.92 1lgn s MET 159 CO 0.00 -0.31 0.11 -1.58 -0.65 0.00 0.00 175.02 172.59 1lgn s TRP 160 N 2.03 3.03 -2.23 4.11 0.51 -0.52 -0.34 118.94 125.53 1lgn s TRP 160 Ca 0.04 -0.09 0.19 0.00 -2.12 0.00 0.00 56.10 54.12 1lgn s TRP 160 Cb -0.12 -1.42 0.63 0.00 -0.81 0.00 0.00 33.47 31.75 1lgn s TRP 160 CO -0.04 0.53 1.48 -0.40 -0.51 0.00 0.00 176.95 178.01 1lgn n ASP 161 N -0.55 1.87 -4.67 2.95 5.75 -1.26 -1.80 116.55 118.84 1lgn n ASP 161 Ca -0.08 -1.79 -0.28 0.00 -0.01 0.00 0.00 54.79 52.62 1lgn n ASP 161 Cb 0.56 -0.15 -0.10 0.00 -1.03 0.00 0.00 41.12 40.40 1lgn n ASP 161 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1lgn s SER 162 N -1.43 4.01 -0.50 -1.12 1.04 -1.26 -3.94 113.70 110.49 1lgn s SER 162 Ca 0.31 -1.38 -0.18 0.00 0.48 0.00 0.00 55.95 55.18 1lgn s SER 162 Cb 0.17 -0.23 0.07 0.00 0.10 0.00 0.00 66.02 66.13 1lgn s SER 162 CO 0.25 -0.54 0.54 -0.69 0.98 0.00 0.00 173.24 173.77 1lgn s VAL 163 N -2.73 5.02 0.34 5.02 1.01 -1.26 -2.67 120.40 125.13 1lgn s VAL 163 Ca 0.31 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 1lgn s VAL 163 Cb 0.08 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.10 1lgn s VAL 163 CO 0.16 -0.75 1.34 -0.76 0.00 0.00 0.00 175.10 175.08 1lgn s LEU 164 N 2.23 4.40 0.58 3.92 1.02 -1.26 -5.04 118.68 124.53 1lgn s LEU 164 Ca 0.10 2.75 -0.10 0.00 0.02 0.00 0.00 54.13 56.90 1lgn s LEU 164 Cb -0.22 -3.66 -0.04 0.00 0.02 0.00 0.00 46.19 42.29 1lgn s LEU 164 CO 0.09 -0.60 0.97 -2.16 0.02 0.00 0.00 176.35 174.67 1lgn s PRO 165 N -1.86 3.61 0.31 1.29 0.04 -1.26 -4.83 135.00 132.30 1lgn s PRO 165 Ca 0.50 0.64 0.01 0.00 0.04 0.00 0.00 61.00 62.19 1lgn s PRO 165 Cb -0.41 -2.15 0.74 0.00 0.04 0.00 0.00 34.50 32.71 1lgn s PRO 165 CO 0.55 -0.46 1.57 -1.35 0.04 0.00 0.00 177.00 177.35 1lgn h PRO 166 N -0.09 0.01 -0.71 0.56 0.11 -2.00 0.90 132.00 130.78 1lgn h PRO 166 Ca -0.45 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.72 1lgn h PRO 166 Cb 1.19 -0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.25 1lgn h PRO 166 CO 0.62 0.00 0.41 0.93 -0.21 0.00 0.00 178.00 179.76 1lgn h GLU 167 N 0.01 0.74 0.00 1.05 3.07 -2.00 -1.43 114.58 116.02 1lgn h GLU 167 Ca 0.59 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 59.33 1lgn h GLU 167 Cb 1.20 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.93 1lgn h GLU 167 CO -0.93 0.49 -0.39 -0.91 -1.40 0.00 0.00 179.01 175.87 1lgn h ASN 168 N 0.76 0.00 0.17 1.42 2.35 -1.20 -2.22 115.58 116.86 1lgn h ASN 168 Ca 0.31 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.06 1lgn h ASN 168 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1lgn h ASN 168 CO -0.17 0.39 -0.08 0.40 -1.65 0.00 0.00 177.43 176.31 1lgn h ILE 169 N 0.00 0.93 -0.57 2.81 1.08 -0.75 -2.89 117.51 118.12 1lgn h ILE 169 Ca -0.00 -0.93 0.02 0.00 -0.39 0.00 0.00 64.86 63.55 1lgn h ILE 169 Cb 0.85 1.46 -0.03 0.00 -3.07 0.00 0.00 36.82 36.03 1lgn h ILE 169 CO 0.05 0.20 0.38 -0.07 -0.69 0.00 0.00 178.15 178.02 1lgn h LEU 170 N -0.72 0.62 -0.32 1.44 3.38 -1.31 -0.70 115.31 117.70 1lgn h LEU 170 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1lgn h LEU 170 Cb 0.51 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1lgn h LEU 170 CO 0.04 0.44 0.13 0.28 0.09 0.00 0.00 178.44 179.42 1lgn h SER 171 N 0.73 0.43 -0.90 -0.43 0.02 -1.44 0.26 113.55 112.23 1lgn h SER 171 Ca 0.22 -0.17 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1lgn h SER 171 Cb -0.01 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.36 1lgn h SER 171 CO -0.05 0.48 0.58 0.00 -1.14 0.00 0.00 176.83 176.70 1lgn h ALA 172 N 0.97 1.18 -0.34 3.77 0.00 -1.14 -0.49 119.26 123.22 1lgn h ALA 172 Ca 0.11 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1lgn h ALA 172 Cb 0.18 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1lgn h ALA 172 CO -0.01 0.45 -0.14 -0.92 0.00 0.00 0.00 179.25 178.62 1lgn h TYR 173 N 1.14 0.65 -0.00 0.00 3.20 -0.61 -2.70 116.97 118.64 1lgn h TYR 173 Ca 0.36 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1lgn h TYR 173 Cb -0.00 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.10 1lgn h TYR 173 CO -0.01 0.71 -0.05 1.04 -1.64 0.00 0.00 178.16 178.20 1lgn n GLN 174 N -4.17 0.73 -0.06 1.82 6.02 0.88 -4.92 117.38 117.68 1lgn n GLN 174 Ca 0.01 -0.17 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 1lgn n GLN 174 Cb 0.35 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.12 1lgn n GLN 174 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1lgn n GLY 175 N 1.22 0.89 2.44 1.08 0.00 -0.58 -5.02 105.19 105.22 1lgn n GLY 175 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1lgn n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lgn n THR 176 N -2.05 1.27 -1.66 2.61 -2.24 -0.33 -5.00 114.28 106.88 1lgn n THR 176 Ca 0.00 -4.88 -0.33 0.00 -2.27 0.00 0.00 64.05 56.58 1lgn n THR 176 Cb 0.00 -1.56 0.06 0.00 -2.10 0.00 0.00 70.33 66.73 1lgn n THR 176 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1lgn s PRO 177 N -2.37 2.70 0.56 -0.78 0.04 -1.25 -4.21 135.00 129.68 1lgn s PRO 177 Ca 0.41 1.34 -0.16 0.00 0.04 0.00 0.00 61.00 62.62 1lgn s PRO 177 Cb 0.22 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.77 1lgn s PRO 177 CO -0.08 -1.32 1.03 -0.51 0.04 0.00 0.00 177.00 176.15 1lgn s LEU 178 N -5.09 3.57 0.18 -3.56 1.02 -1.26 -4.96 118.68 108.58 1lgn s LEU 178 Ca 0.66 1.72 -0.32 0.00 0.02 0.00 0.00 54.13 56.21 1lgn s LEU 178 Cb -0.20 -4.52 -0.10 0.00 0.02 0.00 0.00 46.19 41.39 1lgn s LEU 178 CO 0.45 -0.91 1.59 -2.84 0.02 0.00 0.00 176.35 174.66 1lgn s PRO 179 N -4.03 4.20 0.22 1.29 0.02 -1.26 -4.98 135.00 130.45 1lgn s PRO 179 Ca 0.62 2.41 -0.10 0.00 0.02 0.00 0.00 61.00 63.95 1lgn s PRO 179 Cb -0.13 -3.14 -0.07 0.00 0.02 0.00 0.00 34.50 31.18 1lgn s PRO 179 CO 0.34 -0.63 0.55 0.00 -0.33 0.00 0.00 177.00 176.93 1lgn s ALA 180 N 1.11 3.56 -0.29 -1.55 0.00 -1.26 -4.99 121.76 118.34 1lgn s ALA 180 Ca 0.71 -0.26 0.10 0.00 0.00 0.00 0.00 51.96 52.51 1lgn s ALA 180 Cb -0.45 -2.44 -0.13 0.00 0.00 0.00 0.00 23.12 20.10 1lgn s ALA 180 CO 0.32 0.50 0.35 0.27 0.00 0.00 0.00 175.76 177.20 1lgn n ASN 181 N -0.07 1.35 -0.11 0.00 0.23 -1.18 -4.65 115.26 110.83 1lgn n ASN 181 Ca 0.00 -0.44 -0.14 0.00 -0.53 0.00 0.00 54.58 53.48 1lgn n ASN 181 Cb 0.52 1.19 -0.14 0.00 -2.08 0.00 0.00 39.78 39.28 1lgn n ASN 181 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 1lgn n ILE 182 N -1.49 1.44 -3.67 1.53 5.41 0.54 -4.97 119.36 118.15 1lgn n ILE 182 Ca 0.00 -0.73 -0.09 0.00 1.00 0.00 0.00 62.75 62.94 1lgn n ILE 182 Cb 0.20 -0.91 -0.09 0.00 -0.71 0.00 0.00 39.64 38.13 1lgn n ILE 182 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1lgn s LEU 183 N -5.97 -0.47 -0.05 1.39 1.02 -0.94 -4.79 118.68 108.86 1lgn s LEU 183 Ca -0.22 1.14 0.01 0.00 0.02 0.00 0.00 54.13 55.08 1lgn s LEU 183 Cb 0.07 1.73 0.02 0.00 0.02 0.00 0.00 46.19 48.03 1lgn s LEU 183 CO 0.72 -0.21 -0.05 -0.62 0.02 0.00 0.00 176.35 176.21 1lgn s ASP 184 N 1.66 1.17 0.51 2.29 -1.08 -1.26 -0.70 116.67 119.26 1lgn s ASP 184 Ca -0.09 -0.15 0.25 0.00 -0.52 0.00 0.00 52.55 52.04 1lgn s ASP 184 Cb -0.08 -0.51 1.37 0.00 -1.46 0.00 0.00 42.92 42.24 1lgn s ASP 184 CO -0.15 -0.06 2.06 -0.25 0.52 0.00 0.00 175.17 177.29 1lgn h TRP 185 N 7.32 0.00 -0.21 -5.34 2.91 -1.82 -1.78 115.95 117.04 1lgn h TRP 185 Ca -0.35 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.67 1lgn h TRP 185 Cb 1.15 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.80 1lgn h TRP 185 CO 0.49 0.13 0.00 1.04 -1.03 0.00 0.00 178.44 179.07 1lgn n GLN 186 N -3.80 1.68 -2.71 2.65 6.02 -1.26 -0.87 117.38 119.09 1lgn n GLN 186 Ca -0.02 -1.03 -0.07 0.00 -0.01 0.00 0.00 57.00 55.87 1lgn n GLN 186 Cb 0.23 -1.34 0.09 0.00 1.02 0.00 0.00 30.24 30.25 1lgn n GLN 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1lgn n ALA 187 N 0.27 -1.11 -2.15 -1.58 0.00 -0.73 -3.94 120.51 111.28 1lgn n ALA 187 Ca 0.14 -1.13 -0.36 0.00 0.00 0.00 0.00 53.44 52.08 1lgn n ALA 187 Cb 0.29 -1.57 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 1lgn n ALA 187 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1lgn s LEU 188 N -2.16 4.38 -0.50 0.00 2.96 0.24 -4.50 118.68 119.11 1lgn s LEU 188 Ca 0.20 1.36 0.01 0.00 -0.22 0.00 0.00 54.13 55.49 1lgn s LEU 188 Cb 0.29 -3.44 0.13 0.00 0.50 0.00 0.00 46.19 43.68 1lgn s LEU 188 CO -0.09 0.08 0.26 0.21 -1.32 0.00 0.00 176.35 175.49 1lgn s ASN 189 N -1.57 4.78 0.45 3.68 2.47 -1.26 -0.09 114.94 123.41 1lgn s ASN 189 Ca 0.40 -2.66 0.04 0.00 0.42 0.00 0.00 52.86 51.06 1lgn s ASN 189 Cb -0.17 -1.72 -0.05 0.00 -1.45 0.00 0.00 41.25 37.86 1lgn s ASN 189 CO 0.21 -0.34 0.01 -0.72 -3.72 0.00 0.00 177.10 172.54 1lgn s TYR 190 N 0.21 2.16 -0.25 0.43 1.13 -1.26 0.12 117.35 119.89 1lgn s TYR 190 Ca 0.15 -0.84 -0.04 0.00 -1.41 0.00 0.00 57.07 54.93 1lgn s TYR 190 Cb -0.23 -1.65 0.09 0.00 -1.10 0.00 0.00 41.96 39.07 1lgn s TYR 190 CO -0.03 0.30 0.15 -1.21 -2.51 0.00 0.00 175.55 172.25 1lgn s GLU 191 N -3.80 0.18 -0.01 -3.49 2.02 0.79 -4.93 118.70 109.46 1lgn s GLU 191 Ca 0.21 -0.29 -0.30 0.00 0.02 0.00 0.00 54.97 54.61 1lgn s GLU 191 Cb 0.06 -1.27 -0.04 0.00 0.10 0.00 0.00 34.13 32.98 1lgn s GLU 191 CO 0.11 -0.89 1.13 0.42 0.02 0.00 0.00 175.26 176.04 1lgn s ILE 192 N 2.17 4.37 -0.10 -1.63 1.01 -1.26 -0.95 121.20 124.81 1lgn s ILE 192 Ca 0.07 1.70 -0.01 0.00 0.00 0.00 0.00 60.65 62.41 1lgn s ILE 192 Cb -0.16 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.25 1lgn s ILE 192 CO -0.27 0.07 -0.06 -0.13 0.00 0.00 0.00 174.94 174.56 1lgn s ARG 193 N 1.55 1.29 0.96 2.79 1.81 -0.24 -5.00 118.95 122.12 1lgn s ARG 193 Ca 0.55 -0.17 0.00 0.00 -1.72 0.00 0.00 55.73 54.40 1lgn s ARG 193 Cb -0.25 -1.42 0.00 0.00 -0.45 0.00 0.00 34.95 32.84 1lgn s ARG 193 CO 0.25 -0.26 0.00 0.41 -0.68 0.00 0.00 175.30 175.02 1lgn n GLY 194 N 4.94 -1.20 3.45 -3.53 0.00 -1.26 -0.30 105.19 107.30 1lgn n GLY 194 Ca -0.12 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1lgn n GLY 194 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lgn s TYR 195 N 0.00 2.80 -0.18 1.61 5.04 -1.26 -4.89 117.35 120.46 1lgn s TYR 195 Ca 0.00 -0.79 -0.05 0.00 -2.44 0.00 0.00 57.07 53.79 1lgn s TYR 195 Cb 0.00 -4.29 0.09 0.00 0.35 0.00 0.00 41.96 38.11 1lgn s TYR 195 CO 0.00 -1.60 0.32 0.54 -1.34 0.00 0.00 175.55 173.47 1lgn s VAL 196 N 3.68 -0.50 0.13 3.14 0.11 -1.26 -4.42 120.40 121.27 1lgn s VAL 196 Ca 0.25 0.14 -0.04 0.00 -2.93 0.00 0.00 61.98 59.40 1lgn s VAL 196 Cb -0.14 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.06 1lgn s VAL 196 CO 0.05 0.03 0.35 -0.63 -3.33 0.00 0.00 175.10 171.56 1lgn s ILE 197 N 2.49 5.20 -0.18 7.04 -1.09 -0.85 -4.91 121.20 128.90 1lgn s ILE 197 Ca 0.03 -0.02 -0.05 0.00 -2.23 0.00 0.00 60.65 58.39 1lgn s ILE 197 Cb -0.13 -3.62 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1lgn s ILE 197 CO -0.11 0.06 -0.00 -0.63 -1.23 0.00 0.00 174.94 173.02 1lgn s ILE 198 N -1.63 4.10 0.15 2.92 1.01 -1.26 -0.13 121.20 126.35 1lgn s ILE 198 Ca 0.40 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.76 1lgn s ILE 198 Cb -0.12 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1lgn s ILE 198 CO 0.25 0.46 0.08 -0.54 0.00 0.00 0.00 174.94 175.19 1lgn s LYS 199 N 0.62 0.99 0.56 2.79 -0.14 -0.83 -4.97 119.74 118.76 1lgn s LYS 199 Ca -0.01 -1.46 -0.17 0.00 -1.36 0.00 0.00 55.97 52.97 1lgn s LYS 199 Cb -0.14 0.25 -0.05 0.00 -1.68 0.00 0.00 37.83 36.21 1lgn s LYS 199 CO 0.02 -0.29 1.06 -1.25 -0.76 0.00 0.00 175.35 174.12 1lgn s PRO 200 N -4.06 3.45 -0.71 -1.68 0.04 -1.26 0.01 135.00 130.78 1lgn s PRO 200 Ca 0.26 1.27 -0.27 0.00 0.04 0.00 0.00 61.00 62.31 1lgn s PRO 200 Cb 0.07 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.60 1lgn s PRO 200 CO 0.04 -0.71 1.25 -1.17 0.04 0.00 0.00 177.00 176.44 1lgn s LEU 201 N -4.17 3.28 0.07 -3.56 2.96 -0.07 -4.65 118.68 112.53 1lgn s LEU 201 Ca 0.65 -0.41 0.22 0.00 -0.22 0.00 0.00 54.13 54.38 1lgn s LEU 201 Cb -0.17 -2.63 -0.08 0.00 0.50 0.00 0.00 46.19 43.81 1lgn s LEU 201 CO 0.31 -1.77 0.88 1.33 -1.32 0.00 0.00 176.35 175.79 1lgn n VAL 202 N 6.39 0.25 -0.38 1.68 0.24 -1.26 -4.45 118.33 120.80 1lgn n VAL 202 Ca 0.03 -0.39 0.05 0.00 -2.04 0.00 0.00 64.34 61.98 1lgn n VAL 202 Cb 0.49 0.02 0.29 0.00 -1.47 0.00 0.00 33.84 33.17 1lgn n VAL 202 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 1lgn n TRP 203 N -2.24 1.53 -0.55 6.34 4.27 -1.26 -5.28 117.44 120.25 1lgn n TRP 203 Ca -0.00 -0.55 0.00 0.00 -3.89 0.00 0.00 57.50 53.06 1lgn n TRP 203 Cb 0.50 -0.41 0.00 0.00 -1.36 0.00 0.00 31.31 30.04 1lgn n TRP 203 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68