#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a3w s THR 2 N 0.00 0.94 -0.48 1.59 2.01 0.72 -4.82 115.64 115.60 2a3w s THR 2 Ca 0.00 -0.58 -0.22 0.00 0.31 0.00 0.00 61.69 61.21 2a3w s THR 2 Cb 0.00 -0.80 0.03 0.00 0.01 0.00 0.00 72.50 71.75 2a3w s THR 2 CO 0.00 0.21 0.73 -0.62 -0.69 0.00 0.00 174.62 174.26 2a3w s ASP 3 N -0.42 6.33 -0.29 3.53 -1.08 -1.25 0.07 116.67 123.57 2a3w s ASP 3 Ca 0.04 -0.40 0.11 0.00 -0.52 0.00 0.00 52.55 51.78 2a3w s ASP 3 Cb -0.05 -2.35 0.73 0.00 -1.46 0.00 0.00 42.92 39.79 2a3w s ASP 3 CO -0.00 -0.92 1.74 0.18 0.52 0.00 0.00 175.17 176.69 2a3w n LEU 4 N 6.59 5.71 -4.64 -1.34 4.32 -0.49 -4.98 117.00 122.18 2a3w n LEU 4 Ca -0.01 -3.18 -0.49 0.00 -0.02 0.00 0.00 56.01 52.31 2a3w n LEU 4 Cb 0.47 -0.71 -0.05 0.00 -1.62 0.00 0.00 43.42 41.51 2a3w n LEU 4 CO 0.57 0.78 1.08 -1.20 -1.22 0.00 0.00 177.39 177.40 2a3w n SER 5 N -0.09 2.43 -0.51 -1.43 7.64 -1.26 -1.66 113.62 118.74 2a3w n SER 5 Ca 0.36 1.09 -0.07 0.00 1.01 0.00 0.00 58.87 61.27 2a3w n SER 5 Cb 1.29 -1.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.15 2a3w n SER 5 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a3w n GLY 6 N 3.08 0.88 3.19 0.23 0.00 -1.26 -5.01 105.19 106.31 2a3w n GLY 6 Ca 0.18 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 2a3w n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3w s LYS 7 N -2.35 0.89 0.10 1.61 1.02 -0.66 -1.11 119.74 119.23 2a3w s LYS 7 Ca 0.00 -1.35 0.03 0.00 0.02 0.00 0.00 55.97 54.68 2a3w s LYS 7 Cb 0.00 -0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 36.93 2a3w s LYS 7 CO 0.00 0.02 -0.09 0.14 -0.92 0.00 0.00 175.35 174.50 2a3w s VAL 8 N -3.42 0.88 -0.04 3.17 -7.23 0.46 -4.47 120.40 109.74 2a3w s VAL 8 Ca 0.12 -1.74 -0.26 0.00 -1.81 0.00 0.00 61.98 58.29 2a3w s VAL 8 Cb 0.04 -1.47 -0.03 0.00 0.56 0.00 0.00 36.38 35.48 2a3w s VAL 8 CO -0.03 -0.66 0.82 -0.36 -0.31 0.00 0.00 175.10 174.56 2a3w s PHE 9 N -2.82 3.61 -0.27 2.82 0.08 0.14 -2.13 117.98 119.41 2a3w s PHE 9 Ca 0.08 1.43 -0.06 0.00 0.12 0.00 0.00 56.93 58.50 2a3w s PHE 9 Cb -0.00 -2.94 0.00 0.00 -0.57 0.00 0.00 43.02 39.51 2a3w s PHE 9 CO -0.01 0.04 0.05 0.08 -0.10 0.00 0.00 175.22 175.27 2a3w s VAL 10 N 0.92 3.81 -0.75 -0.44 1.01 0.15 -1.42 120.40 123.68 2a3w s VAL 10 Ca 0.43 -0.64 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 2a3w s VAL 10 Cb -0.19 -2.91 0.17 0.00 0.00 0.00 0.00 36.38 33.45 2a3w s VAL 10 CO 0.22 0.17 0.76 -0.36 0.00 0.00 0.00 175.10 175.89 2a3w s PHE 11 N 1.49 3.44 -1.38 5.22 0.40 0.40 -1.20 117.98 126.35 2a3w s PHE 11 Ca 0.03 -1.59 0.29 0.00 -0.60 0.00 0.00 56.93 55.06 2a3w s PHE 11 Cb -0.16 -3.92 1.43 0.00 0.51 0.00 0.00 43.02 40.87 2a3w s PHE 11 CO 0.01 -1.12 1.99 -2.30 0.70 0.00 0.00 175.22 174.50 2a3w n PRO 12 N 5.00 0.36 -3.68 0.24 -0.02 -1.26 -0.88 135.00 134.76 2a3w n PRO 12 Ca 0.06 0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.44 2a3w n PRO 12 Cb 0.45 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.37 2a3w n PRO 12 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2a3w s ARG 13 N -2.62 0.95 0.19 -0.52 1.70 -1.26 -4.92 118.95 112.46 2a3w s ARG 13 Ca 0.26 -0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 54.66 2a3w s ARG 13 Cb 0.19 0.42 -0.08 0.00 -0.57 0.00 0.00 34.95 34.91 2a3w s ARG 13 CO 0.45 -0.34 1.27 -2.00 -1.08 0.00 0.00 175.30 173.60 2a3w s GLU 14 N -3.09 4.42 0.32 3.89 2.12 -1.26 -4.77 118.70 120.34 2a3w s GLU 14 Ca -0.01 1.99 -0.19 0.00 0.36 0.00 0.00 54.97 57.12 2a3w s GLU 14 Cb 0.01 -3.21 0.04 0.00 0.26 0.00 0.00 34.13 31.22 2a3w s GLU 14 CO -0.07 -0.19 0.76 -1.54 -0.54 0.00 0.00 175.26 173.68 2a3w s SER 15 N 0.27 -0.14 0.00 -1.70 1.04 -1.26 -5.00 113.70 106.90 2a3w s SER 15 Ca 0.55 -0.84 0.17 0.00 0.48 0.00 0.00 55.95 56.32 2a3w s SER 15 Cb -0.35 0.77 0.45 0.00 0.10 0.00 0.00 66.02 66.99 2a3w s SER 15 CO 0.38 -1.48 1.37 0.55 0.98 0.00 0.00 173.24 175.03 2a3w n VAL 16 N -0.49 0.86 0.00 5.02 3.14 -1.26 -4.29 118.33 121.32 2a3w n VAL 16 Ca -0.06 -0.93 0.00 0.00 -2.96 0.00 0.00 64.34 60.39 2a3w n VAL 16 Cb 0.59 0.62 0.00 0.00 -1.06 0.00 0.00 33.84 33.99 2a3w n VAL 16 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2a3w n THR 17 N 1.12 0.00 -2.20 1.55 -1.04 -1.26 -4.75 114.28 107.70 2a3w n THR 17 Ca 0.18 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.76 2a3w n THR 17 Cb 0.52 -0.80 -0.03 0.00 -1.82 0.00 0.00 70.33 68.21 2a3w n THR 17 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2a3w s ASP 18 N -4.30 6.82 0.20 8.00 1.01 -1.26 -4.65 116.67 122.48 2a3w s ASP 18 Ca 0.00 2.07 -0.22 0.00 0.71 0.00 0.00 52.55 55.12 2a3w s ASP 18 Cb 0.00 -2.55 0.05 0.00 1.01 0.00 0.00 42.92 41.43 2a3w s ASP 18 CO 0.00 -0.78 0.62 -1.38 0.21 0.00 0.00 175.17 173.84 2a3w s HIS 19 N 2.99 -0.39 -0.12 4.23 -3.43 0.05 -4.32 115.29 114.30 2a3w s HIS 19 Ca 0.65 0.09 0.03 0.00 -0.80 0.00 0.00 55.06 55.03 2a3w s HIS 19 Cb -0.30 0.58 0.01 0.00 -1.43 0.00 0.00 32.58 31.44 2a3w s HIS 19 CO 0.25 -0.96 -0.21 0.08 -2.00 0.00 0.00 174.74 171.89 2a3w s VAL 20 N -3.81 1.97 0.16 -5.38 1.01 -0.34 -0.54 120.40 113.47 2a3w s VAL 20 Ca 0.05 -0.94 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 2a3w s VAL 20 Cb -0.02 -1.74 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 2a3w s VAL 20 CO -0.06 0.53 0.86 0.20 0.00 0.00 0.00 175.10 176.63 2a3w s ASN 21 N 0.72 7.47 -0.18 3.32 0.01 -0.24 -0.83 114.94 125.22 2a3w s ASN 21 Ca -0.10 1.75 -0.01 0.00 -0.71 0.00 0.00 52.86 53.78 2a3w s ASN 21 Cb -0.16 -2.55 -0.00 0.00 0.41 0.00 0.00 41.25 38.95 2a3w s ASN 21 CO 0.01 0.12 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.85 2a3w s LEU 22 N -0.80 2.66 -0.22 0.60 1.02 0.46 -1.07 118.68 121.34 2a3w s LEU 22 Ca 0.40 -0.43 -0.08 0.00 0.02 0.00 0.00 54.13 54.04 2a3w s LEU 22 Cb -0.24 -1.64 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 2a3w s LEU 22 CO 0.28 0.05 0.08 -0.63 0.02 0.00 0.00 176.35 176.15 2a3w s ILE 23 N 1.04 4.69 -0.01 -0.59 1.01 0.21 -4.04 121.20 123.53 2a3w s ILE 23 Ca -0.00 -0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.64 2a3w s ILE 23 Cb -0.15 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.15 2a3w s ILE 23 CO -0.02 0.39 -0.17 0.28 0.00 0.00 0.00 174.94 175.43 2a3w s THR 24 N 0.94 1.33 -1.20 2.92 -1.32 -1.26 -4.47 115.64 112.59 2a3w s THR 24 Ca 0.04 -0.75 -0.08 0.00 -1.21 0.00 0.00 61.69 59.70 2a3w s THR 24 Cb -0.14 -1.11 -0.05 0.00 -1.51 0.00 0.00 72.50 69.69 2a3w s THR 24 CO 0.03 0.36 2.91 -0.81 -2.21 0.00 0.00 174.62 174.89 2a3w n PRO 25 N 2.61 3.57 -3.49 7.08 -0.04 -1.26 -4.89 135.00 138.57 2a3w n PRO 25 Ca -0.15 -2.35 -0.42 0.00 -0.04 0.00 0.00 63.50 60.54 2a3w n PRO 25 Cb 0.54 -2.58 -0.08 0.00 -0.04 0.00 0.00 33.50 31.34 2a3w n PRO 25 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2a3w s LEU 26 N -0.64 5.53 -0.00 1.53 2.96 -1.26 -4.87 118.68 121.93 2a3w s LEU 26 Ca 0.65 -1.57 0.19 0.00 -0.22 0.00 0.00 54.13 53.18 2a3w s LEU 26 Cb 0.22 -2.08 -0.21 0.00 0.50 0.00 0.00 46.19 44.62 2a3w s LEU 26 CO -0.07 -0.64 0.79 -0.62 -1.32 0.00 0.00 176.35 174.48 2a3w n GLU 27 N 5.04 0.79 -3.58 1.98 1.02 -1.26 -2.62 120.64 122.01 2a3w n GLU 27 Ca -0.11 -0.01 -0.37 0.00 -0.02 0.00 0.00 57.16 56.65 2a3w n GLU 27 Cb 0.42 -1.39 -0.09 0.00 -0.02 0.00 0.00 31.44 30.36 2a3w n GLU 27 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2a3w s LYS 28 N -2.79 4.07 0.46 3.49 2.20 -1.26 -4.77 119.74 121.14 2a3w s LYS 28 Ca 0.07 -0.16 -0.23 0.00 -0.36 0.00 0.00 55.97 55.28 2a3w s LYS 28 Cb 0.14 -3.56 -0.09 0.00 -1.51 0.00 0.00 37.83 32.81 2a3w s LYS 28 CO 0.77 -0.01 1.13 -2.30 -0.36 0.00 0.00 175.35 174.58 2a3w n PRO 29 N 4.47 1.52 -3.27 4.03 -0.02 -1.26 -4.60 135.00 135.87 2a3w n PRO 29 Ca -0.13 0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 61.50 2a3w n PRO 29 Cb 0.52 -2.24 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 2a3w n PRO 29 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2a3w s LEU 30 N -1.46 4.10 -0.10 2.45 1.43 0.11 -4.90 118.68 120.32 2a3w s LEU 30 Ca 0.65 0.57 -0.06 0.00 -1.03 0.00 0.00 54.13 54.26 2a3w s LEU 30 Cb -0.50 -2.64 -0.27 0.00 0.03 0.00 0.00 46.19 42.81 2a3w s LEU 30 CO 0.55 -0.20 0.46 0.06 0.23 0.00 0.00 176.35 177.44 2a3w h GLN 31 N 7.70 0.27 -4.67 1.70 3.07 -1.88 -1.48 115.11 119.81 2a3w h GLN 31 Ca -0.32 -0.46 -0.34 0.00 0.09 0.00 0.00 58.65 57.62 2a3w h GLN 31 Cb 1.15 0.17 -0.25 0.00 0.08 0.00 0.00 27.48 28.63 2a3w h GLN 31 CO 0.72 1.17 -0.76 -0.80 0.09 0.00 0.00 178.83 179.26 2a3w s ASN 32 N -7.01 0.99 0.13 0.06 0.01 -1.26 -1.31 114.94 106.55 2a3w s ASN 32 Ca -0.19 -0.33 -0.17 0.00 -0.71 0.00 0.00 52.86 51.46 2a3w s ASN 32 Cb 0.06 -0.05 0.04 0.00 0.41 0.00 0.00 41.25 41.71 2a3w s ASN 32 CO 0.79 -0.02 0.43 0.72 -1.51 0.00 0.00 177.10 177.51 2a3w s PHE 33 N -0.69 -0.23 -0.02 2.20 -0.12 -0.76 -3.54 117.98 114.80 2a3w s PHE 33 Ca -0.02 -0.07 0.02 0.00 -0.05 0.00 0.00 56.93 56.81 2a3w s PHE 33 Cb -0.06 0.29 0.01 0.00 -0.63 0.00 0.00 43.02 42.63 2a3w s PHE 33 CO 0.00 -0.72 -0.06 0.99 -0.05 0.00 0.00 175.22 175.38 2a3w s THR 34 N -3.80 0.57 -0.11 -4.49 2.01 -0.50 -1.20 115.64 108.12 2a3w s THR 34 Ca 0.03 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.81 2a3w s THR 34 Cb 0.01 -0.53 0.02 0.00 0.01 0.00 0.00 72.50 72.01 2a3w s THR 34 CO -0.12 0.19 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.65 2a3w s LEU 35 N 0.31 1.65 0.05 4.42 2.96 0.61 -0.88 118.68 127.81 2a3w s LEU 35 Ca -0.04 -0.41 0.09 0.00 -0.22 0.00 0.00 54.13 53.55 2a3w s LEU 35 Cb -0.08 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 2a3w s LEU 35 CO 0.00 -0.01 -0.25 0.00 -1.32 0.00 0.00 176.35 174.78 2a3w s PHE 37 N -0.82 -0.19 -0.11 0.00 -0.71 -0.05 -0.25 117.98 115.85 2a3w s PHE 37 Ca 0.10 -0.10 0.03 0.00 -1.04 0.00 0.00 56.93 55.92 2a3w s PHE 37 Cb -0.10 0.63 -0.01 0.00 -1.21 0.00 0.00 43.02 42.33 2a3w s PHE 37 CO 0.02 -0.82 -0.20 0.50 -1.34 0.00 0.00 175.22 173.38 2a3w s ARG 38 N -3.34 3.16 0.07 1.99 3.52 0.32 -0.55 118.95 124.12 2a3w s ARG 38 Ca 0.10 -0.81 0.05 0.00 -0.13 0.00 0.00 55.73 54.94 2a3w s ARG 38 Cb -0.02 -2.41 -0.03 0.00 -1.56 0.00 0.00 34.95 30.93 2a3w s ARG 38 CO 0.00 0.20 -0.14 0.00 -0.81 0.00 0.00 175.30 174.55 2a3w s ALA 39 N 0.33 1.13 -0.20 6.12 0.00 -0.23 -0.70 121.76 128.20 2a3w s ALA 39 Ca -0.16 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 2a3w s ALA 39 Cb -0.17 -0.09 0.08 0.00 0.00 0.00 0.00 23.12 22.94 2a3w s ALA 39 CO 0.08 0.16 0.17 -0.47 0.00 0.00 0.00 175.76 175.70 2a3w s TYR 40 N -1.24 -0.08 -0.06 0.00 5.04 0.42 -1.13 117.35 120.30 2a3w s TYR 40 Ca -0.02 -0.07 -0.09 0.00 -2.44 0.00 0.00 57.07 54.45 2a3w s TYR 40 Cb -0.10 -0.52 0.02 0.00 0.35 0.00 0.00 41.96 41.71 2a3w s TYR 40 CO 0.02 -0.60 0.22 0.45 -1.34 0.00 0.00 175.55 174.30 2a3w s SER 41 N 2.25 -0.17 -0.25 4.32 0.15 -1.26 -0.64 113.70 118.10 2a3w s SER 41 Ca 0.05 0.26 0.13 0.00 0.70 0.00 0.00 55.95 57.09 2a3w s SER 41 Cb -0.16 0.39 0.55 0.00 -1.71 0.00 0.00 66.02 65.09 2a3w s SER 41 CO -0.14 -0.20 1.50 -0.90 1.20 0.00 0.00 173.24 174.70 2a3w n ASP 42 N 2.38 3.45 -4.74 5.45 5.68 -1.26 -4.56 116.55 122.96 2a3w n ASP 42 Ca -0.16 -3.34 -0.41 0.00 -0.50 0.00 0.00 54.79 50.37 2a3w n ASP 42 Cb 0.57 -0.61 -0.03 0.00 -1.14 0.00 0.00 41.12 39.91 2a3w n ASP 42 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2a3w s LEU 43 N -3.02 4.44 -0.07 -2.12 1.43 -1.26 -4.95 118.68 113.13 2a3w s LEU 43 Ca 0.45 2.21 0.17 0.00 -1.03 0.00 0.00 54.13 55.93 2a3w s LEU 43 Cb 0.38 -3.60 -0.22 0.00 0.03 0.00 0.00 46.19 42.77 2a3w s LEU 43 CO 0.06 -0.38 0.46 -1.20 0.23 0.00 0.00 176.35 175.52 2a3w n SER 44 N 2.64 0.42 -4.77 2.29 7.64 -1.26 -4.95 113.62 115.62 2a3w n SER 44 Ca 0.05 0.19 -0.29 0.00 1.01 0.00 0.00 58.87 59.83 2a3w n SER 44 Cb 0.45 0.69 0.13 0.00 -1.01 0.00 0.00 64.21 64.48 2a3w n SER 44 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2a3w s ARG 45 N -2.79 1.21 0.50 1.43 1.70 -1.26 -4.56 118.95 115.18 2a3w s ARG 45 Ca -0.07 0.41 -0.22 0.00 -0.47 0.00 0.00 55.73 55.39 2a3w s ARG 45 Cb 0.08 -1.84 -0.06 0.00 -0.57 0.00 0.00 34.95 32.56 2a3w s ARG 45 CO 0.83 -2.18 1.22 0.00 -1.08 0.00 0.00 175.30 174.10 2a3w s ALA 46 N -3.19 2.89 0.10 7.88 0.00 -1.24 -4.82 121.76 123.38 2a3w s ALA 46 Ca 0.63 1.05 -0.15 0.00 0.00 0.00 0.00 51.96 53.49 2a3w s ALA 46 Cb -0.15 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.55 2a3w s ALA 46 CO 0.54 -0.90 0.36 1.52 0.00 0.00 0.00 175.76 177.28 2a3w s TYR 47 N -1.49 -0.15 -0.08 0.00 -0.85 -0.45 -4.40 117.35 109.93 2a3w s TYR 47 Ca 0.67 -0.13 -0.19 0.00 -0.52 0.00 0.00 57.07 56.91 2a3w s TYR 47 Cb -0.32 0.19 -0.04 0.00 0.38 0.00 0.00 41.96 42.17 2a3w s TYR 47 CO 0.38 -0.64 0.53 0.45 -1.52 0.00 0.00 175.55 174.75 2a3w s SER 48 N -2.63 6.80 -0.14 -0.18 0.15 -0.57 -0.86 113.70 116.27 2a3w s SER 48 Ca 0.01 0.95 -0.05 0.00 0.70 0.00 0.00 55.95 57.56 2a3w s SER 48 Cb 0.02 -2.32 -0.25 0.00 -1.71 0.00 0.00 66.02 61.76 2a3w s SER 48 CO -0.10 0.03 0.30 0.18 1.20 0.00 0.00 173.24 174.85 2a3w n LEU 49 N 3.34 2.63 -3.48 3.45 7.99 0.11 -4.42 117.00 126.62 2a3w n LEU 49 Ca -0.07 0.17 -0.08 0.00 -0.01 0.00 0.00 56.01 56.03 2a3w n LEU 49 Cb 0.51 -1.05 -0.08 0.00 -0.11 0.00 0.00 43.42 42.69 2a3w n LEU 49 CO 0.43 0.85 0.00 0.12 -1.51 0.00 0.00 177.39 177.29 2a3w s PHE 50 N -2.55 -0.87 -0.18 -1.77 2.19 -1.13 -4.64 117.98 109.02 2a3w s PHE 50 Ca -0.23 1.23 -0.01 0.00 0.33 0.00 0.00 56.93 58.24 2a3w s PHE 50 Cb 0.07 0.20 -0.00 0.00 -1.31 0.00 0.00 43.02 41.97 2a3w s PHE 50 CO 0.75 -0.62 -0.11 0.45 1.83 0.00 0.00 175.22 177.52 2a3w s SER 51 N 2.60 3.92 -0.23 6.13 0.15 -0.81 -1.09 113.70 124.37 2a3w s SER 51 Ca 0.06 -0.42 -0.02 0.00 0.70 0.00 0.00 55.95 56.27 2a3w s SER 51 Cb -0.14 -1.63 0.07 0.00 -1.71 0.00 0.00 66.02 62.62 2a3w s SER 51 CO -0.15 0.06 0.05 -0.47 1.20 0.00 0.00 173.24 173.93 2a3w s TYR 52 N 0.99 1.21 0.20 3.44 6.14 -0.09 -0.66 117.35 128.58 2a3w s TYR 52 Ca -0.01 -1.13 0.11 0.00 0.64 0.00 0.00 57.07 56.68 2a3w s TYR 52 Cb -0.15 -1.22 -0.04 0.00 0.42 0.00 0.00 41.96 40.97 2a3w s TYR 52 CO -0.01 -0.70 -0.20 -0.80 0.64 0.00 0.00 175.55 174.47 2a3w s ASN 53 N 1.79 3.65 0.35 4.32 -0.87 -0.95 -1.31 114.94 121.93 2a3w s ASN 53 Ca 0.02 -0.81 0.05 0.00 -1.57 0.00 0.00 52.86 50.55 2a3w s ASN 53 Cb -0.17 -0.37 -0.07 0.00 -0.02 0.00 0.00 41.25 40.62 2a3w s ASN 53 CO -0.15 0.11 0.05 0.42 -2.57 0.00 0.00 177.10 174.96 2a3w s THR 54 N -1.74 1.37 -0.12 1.60 -4.23 -1.04 -1.12 115.64 110.36 2a3w s THR 54 Ca 0.22 -2.00 -0.35 0.00 -1.18 0.00 0.00 61.69 58.38 2a3w s THR 54 Cb -0.08 -2.82 -0.13 0.00 1.34 0.00 0.00 72.50 70.81 2a3w s THR 54 CO 0.12 0.00 1.84 0.00 -0.54 0.00 0.00 174.62 176.03 2a3w n GLN 55 N -0.77 1.96 -1.15 3.99 1.13 -1.26 -0.66 117.38 120.62 2a3w n GLN 55 Ca -0.03 0.72 -0.05 0.00 -1.94 0.00 0.00 57.00 55.69 2a3w n GLN 55 Cb 0.67 -2.53 -0.02 0.00 0.11 0.00 0.00 30.24 28.47 2a3w n GLN 55 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2a3w n GLY 56 N 4.31 0.69 2.65 1.08 0.00 -1.26 -4.98 105.19 107.68 2a3w n GLY 56 Ca 0.23 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2a3w n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a3w s ARG 57 N -1.93 0.45 0.44 1.61 0.52 0.17 -5.13 118.95 115.08 2a3w s ARG 57 Ca 0.00 -0.71 -0.22 0.00 -0.52 0.00 0.00 55.73 54.28 2a3w s ARG 57 Cb 0.00 -1.65 -0.09 0.00 0.52 0.00 0.00 34.95 33.73 2a3w s ARG 57 CO 0.00 -0.94 1.01 0.34 0.02 0.00 0.00 175.30 175.73 2a3w s ASP 58 N 1.88 6.69 -1.55 0.23 2.15 -1.26 -2.50 116.67 122.30 2a3w s ASP 58 Ca 0.08 1.88 -0.12 0.00 0.43 0.00 0.00 52.55 54.82 2a3w s ASP 58 Cb -0.17 -2.56 0.09 0.00 -0.30 0.00 0.00 42.92 39.98 2a3w s ASP 58 CO -0.27 -0.53 0.81 0.59 -0.17 0.00 0.00 175.17 175.59 2a3w n ASN 59 N -0.53 -3.28 -0.26 -0.34 3.02 -1.26 -4.12 115.26 108.49 2a3w n ASN 59 Ca 0.07 -0.90 -0.07 0.00 -0.03 0.00 0.00 54.58 53.66 2a3w n ASN 59 Cb 0.52 -3.38 0.05 0.00 -0.61 0.00 0.00 39.78 36.36 2a3w n ASN 59 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2a3w h GLU 60 N -1.83 1.08 -2.08 3.52 4.57 -1.66 -1.75 114.58 116.43 2a3w h GLU 60 Ca -0.59 -0.21 -0.18 0.00 -1.18 0.00 0.00 59.36 57.19 2a3w h GLU 60 Cb 1.38 -0.17 -0.31 0.00 -0.16 0.00 0.00 28.75 29.49 2a3w h GLU 60 CO 0.69 0.90 -0.51 -1.17 -1.18 0.00 0.00 179.01 177.75 2a3w s LEU 61 N -9.70 -0.51 -0.02 1.64 2.96 -0.43 -0.97 118.68 111.64 2a3w s LEU 61 Ca -0.12 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 2a3w s LEU 61 Cb 0.15 0.96 0.02 0.00 0.50 0.00 0.00 46.19 47.82 2a3w s LEU 61 CO 0.83 -0.30 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.33 2a3w s LEU 62 N 2.50 1.36 -0.31 -0.68 2.96 -0.75 -0.92 118.68 122.84 2a3w s LEU 62 Ca 0.11 -0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.89 2a3w s LEU 62 Cb -0.15 -0.22 0.00 0.00 0.50 0.00 0.00 46.19 46.32 2a3w s LEU 62 CO -0.15 -0.07 0.14 -0.69 -1.32 0.00 0.00 176.35 174.26 2a3w s VAL 63 N 0.77 4.41 -0.08 1.68 1.01 -0.25 -0.66 120.40 127.28 2a3w s VAL 63 Ca -0.08 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2a3w s VAL 63 Cb -0.11 -3.29 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2a3w s VAL 63 CO -0.01 0.03 -0.15 -0.47 0.00 0.00 0.00 175.10 174.50 2a3w s TYR 64 N 1.57 1.80 -0.41 5.22 5.04 -0.22 -0.71 117.35 129.64 2a3w s TYR 64 Ca 0.04 -0.73 -0.15 0.00 -2.44 0.00 0.00 57.07 53.79 2a3w s TYR 64 Cb -0.17 -1.28 0.02 0.00 0.35 0.00 0.00 41.96 40.88 2a3w s TYR 64 CO 0.05 -0.35 0.30 0.21 -1.34 0.00 0.00 175.55 174.42 2a3w s LYS 65 N 0.68 2.96 0.05 4.97 2.20 -0.04 -0.13 119.74 130.43 2a3w s LYS 65 Ca -0.14 -1.05 -0.16 0.00 -0.36 0.00 0.00 55.97 54.26 2a3w s LYS 65 Cb -0.16 -3.97 -0.23 0.00 -1.51 0.00 0.00 37.83 31.96 2a3w s LYS 65 CO 0.04 -0.77 1.17 0.93 -0.36 0.00 0.00 175.35 176.35 2a3w h GLU 66 N 8.62 0.59 -2.61 4.03 4.39 -1.82 -1.20 114.58 126.59 2a3w h GLU 66 Ca -0.27 -0.62 0.12 0.00 0.34 0.00 0.00 59.36 58.94 2a3w h GLU 66 Cb 1.12 0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 29.88 2a3w h GLU 66 CO 0.74 1.23 0.42 -0.98 -1.16 0.00 0.00 179.01 179.25 2a3w s ARG 67 N -3.33 1.50 0.16 2.33 1.70 -1.26 -3.62 118.95 116.43 2a3w s ARG 67 Ca -0.11 -0.88 -0.34 0.00 -0.47 0.00 0.00 55.73 53.93 2a3w s ARG 67 Cb 0.06 0.48 -0.15 0.00 -0.57 0.00 0.00 34.95 34.77 2a3w s ARG 67 CO 0.88 -0.69 1.44 0.28 -1.08 0.00 0.00 175.30 176.13 2a3w n VAL 68 N -0.52 0.26 -1.00 4.99 0.31 -1.26 -1.93 118.33 119.19 2a3w n VAL 68 Ca -0.05 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2a3w n VAL 68 Cb 0.60 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 2a3w n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a3w n GLY 69 N 2.81 0.59 2.86 2.92 0.00 -1.26 -5.00 105.19 108.11 2a3w n GLY 69 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2a3w n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a3w s GLU 70 N -0.06 1.11 -0.07 1.61 2.02 -0.81 -0.77 118.70 121.72 2a3w s GLU 70 Ca 0.00 -0.11 0.05 0.00 0.02 0.00 0.00 54.97 54.93 2a3w s GLU 70 Cb 0.00 -1.25 -0.00 0.00 0.10 0.00 0.00 34.13 32.98 2a3w s GLU 70 CO 0.00 -0.24 -0.23 0.71 0.02 0.00 0.00 175.26 175.53 2a3w s TYR 71 N 1.63 2.31 -0.03 1.61 1.51 -0.70 -3.25 117.35 120.44 2a3w s TYR 71 Ca 0.02 -0.79 0.06 0.00 -1.01 0.00 0.00 57.07 55.34 2a3w s TYR 71 Cb -0.13 -1.54 -0.02 0.00 -0.11 0.00 0.00 41.96 40.16 2a3w s TYR 71 CO -0.05 -0.28 -0.20 -1.12 -1.11 0.00 0.00 175.55 172.78 2a3w s SER 72 N 0.09 3.54 -0.16 2.29 0.01 0.82 -1.05 113.70 119.24 2a3w s SER 72 Ca -0.10 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 56.83 2a3w s SER 72 Cb -0.15 -0.59 -0.00 0.00 0.21 0.00 0.00 66.02 65.49 2a3w s SER 72 CO 0.05 0.33 -0.15 -0.22 0.41 0.00 0.00 173.24 173.66 2a3w s LEU 73 N -0.69 2.48 -0.15 2.44 2.96 0.30 -1.06 118.68 124.95 2a3w s LEU 73 Ca 0.11 -0.47 -0.06 0.00 -0.22 0.00 0.00 54.13 53.48 2a3w s LEU 73 Cb -0.10 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2a3w s LEU 73 CO -0.00 0.08 0.07 -0.31 -1.32 0.00 0.00 176.35 174.87 2a3w s TYR 74 N 0.83 3.31 -0.11 5.38 1.51 0.17 -0.93 117.35 127.50 2a3w s TYR 74 Ca -0.05 0.19 -0.00 0.00 -1.01 0.00 0.00 57.07 56.20 2a3w s TYR 74 Cb -0.15 -2.00 0.02 0.00 -0.11 0.00 0.00 41.96 39.72 2a3w s TYR 74 CO -0.00 0.33 -0.08 0.42 -1.11 0.00 0.00 175.55 175.10 2a3w s ILE 75 N -0.12 1.07 -1.46 2.71 -1.09 0.62 -1.81 121.20 121.12 2a3w s ILE 75 Ca 0.07 -0.33 -0.05 0.00 -2.23 0.00 0.00 60.65 58.12 2a3w s ILE 75 Cb -0.12 -1.07 0.04 0.00 -1.58 0.00 0.00 42.46 39.72 2a3w s ILE 75 CO 0.01 0.37 0.58 0.61 -1.23 0.00 0.00 174.94 175.28 2a3w n GLY 76 N 4.84 -0.30 4.08 6.18 0.00 -0.15 -1.22 105.19 118.63 2a3w n GLY 76 Ca -0.14 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2a3w n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3w n ARG 77 N -4.41 0.00 -2.54 1.61 1.74 -0.66 -4.96 116.66 107.44 2a3w n ARG 77 Ca -0.20 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.54 2a3w n ARG 77 Cb 0.63 -0.62 -0.03 0.00 -1.02 0.00 0.00 32.46 31.42 2a3w n ARG 77 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2a3w s HIS 78 N -0.40 3.00 0.02 -1.55 3.76 -0.36 -5.01 115.29 114.76 2a3w s HIS 78 Ca 0.00 1.58 0.05 0.00 -0.15 0.00 0.00 55.06 56.54 2a3w s HIS 78 Cb 0.00 -3.08 -0.02 0.00 1.11 0.00 0.00 32.58 30.59 2a3w s HIS 78 CO 0.00 -0.84 -0.16 0.21 -0.85 0.00 0.00 174.74 173.10 2a3w s LYS 79 N -3.18 1.15 0.07 1.40 2.20 -1.26 -0.28 119.74 119.84 2a3w s LYS 79 Ca 0.67 -0.70 0.06 0.00 -0.36 0.00 0.00 55.97 55.63 2a3w s LYS 79 Cb -0.17 -1.16 -0.03 0.00 -1.51 0.00 0.00 37.83 34.97 2a3w s LYS 79 CO 0.21 0.30 -0.15 0.14 -0.36 0.00 0.00 175.35 175.48 2a3w s VAL 80 N -0.63 1.21 -0.02 4.02 -7.23 -0.11 -4.99 120.40 112.66 2a3w s VAL 80 Ca 0.05 -1.31 0.03 0.00 -1.81 0.00 0.00 61.98 58.94 2a3w s VAL 80 Cb -0.07 -1.14 -0.00 0.00 0.56 0.00 0.00 36.38 35.72 2a3w s VAL 80 CO 0.01 -0.17 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.62 2a3w s THR 81 N -1.20 0.96 0.05 5.32 2.01 -1.26 -0.54 115.64 120.98 2a3w s THR 81 Ca -0.00 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.54 2a3w s THR 81 Cb -0.10 -0.83 -0.02 0.00 0.01 0.00 0.00 72.50 71.56 2a3w s THR 81 CO 0.02 0.28 -0.10 -0.44 -0.69 0.00 0.00 174.62 173.69 2a3w s SER 82 N -0.06 1.20 0.18 3.53 0.01 -0.22 -4.99 113.70 113.36 2a3w s SER 82 Ca 0.01 -0.53 0.06 0.00 1.31 0.00 0.00 55.95 56.80 2a3w s SER 82 Cb -0.07 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.10 2a3w s SER 82 CO 0.00 -0.11 0.08 -0.54 0.41 0.00 0.00 173.24 173.08 2a3w s LYS 83 N -1.47 2.68 -0.02 12.44 1.02 -1.26 -1.71 119.74 131.42 2a3w s LYS 83 Ca -0.05 -1.01 -0.22 0.00 0.02 0.00 0.00 55.97 54.70 2a3w s LYS 83 Cb -0.09 -2.50 0.04 0.00 -0.52 0.00 0.00 37.83 34.77 2a3w s LYS 83 CO 0.01 0.46 0.48 0.54 -0.92 0.00 0.00 175.35 175.92 2a3w s VAL 84 N -1.82 0.03 -0.15 3.17 0.11 0.05 -4.73 120.40 117.06 2a3w s VAL 84 Ca 0.30 -0.27 -0.29 0.00 -2.93 0.00 0.00 61.98 58.79 2a3w s VAL 84 Cb -0.09 -0.82 -0.01 0.00 -1.53 0.00 0.00 36.38 33.93 2a3w s VAL 84 CO 0.22 -0.15 1.05 -0.63 -3.33 0.00 0.00 175.10 172.26 2a3w s ILE 85 N -1.44 4.67 0.03 7.04 1.01 -1.26 -4.41 121.20 126.83 2a3w s ILE 85 Ca -0.11 1.97 -0.07 0.00 0.00 0.00 0.00 60.65 62.44 2a3w s ILE 85 Cb -0.02 -4.27 -0.00 0.00 0.01 0.00 0.00 42.46 38.17 2a3w s ILE 85 CO 0.06 -0.07 0.14 -1.83 0.00 0.00 0.00 174.94 173.23 2a3w s GLU 86 N 2.54 0.58 0.49 2.79 -1.05 -1.26 -5.06 118.70 117.73 2a3w s GLU 86 Ca 0.48 -0.59 -0.18 0.00 -0.15 0.00 0.00 54.97 54.53 2a3w s GLU 86 Cb -0.18 0.23 -0.09 0.00 -0.44 0.00 0.00 34.13 33.66 2a3w s GLU 86 CO 0.14 -0.15 0.98 0.15 0.95 0.00 0.00 175.26 177.33 2a3w s LYS 87 N -2.14 3.99 -0.04 -4.83 1.02 -1.26 -4.89 119.74 111.59 2a3w s LYS 87 Ca -0.09 1.04 0.01 0.00 0.02 0.00 0.00 55.97 56.95 2a3w s LYS 87 Cb -0.04 -2.14 0.02 0.00 -0.52 0.00 0.00 37.83 35.16 2a3w s LYS 87 CO -0.02 -0.24 -0.02 0.12 -0.92 0.00 0.00 175.35 174.27 2a3w s PHE 88 N -2.45 0.53 0.47 3.18 5.36 -1.26 -3.62 117.98 120.18 2a3w s PHE 88 Ca 0.60 -0.10 -0.14 0.00 -0.96 0.00 0.00 56.93 56.33 2a3w s PHE 88 Cb -0.10 -0.53 -0.07 0.00 -0.34 0.00 0.00 43.02 41.97 2a3w s PHE 88 CO 0.26 -0.16 0.90 -1.25 -1.46 0.00 0.00 175.22 173.51 2a3w s PRO 89 N 0.94 3.88 -0.19 10.12 0.04 -1.26 -5.20 135.00 143.33 2a3w s PRO 89 Ca -0.11 0.76 -0.19 0.00 0.04 0.00 0.00 61.00 61.50 2a3w s PRO 89 Cb -0.14 -2.24 0.05 0.00 0.04 0.00 0.00 34.50 32.21 2a3w s PRO 89 CO -0.01 -0.17 0.54 0.00 0.04 0.00 0.00 177.00 177.40 2a3w s ALA 90 N -2.52 -1.33 0.62 8.56 0.00 -1.24 -5.11 121.76 120.75 2a3w s ALA 90 Ca 0.56 1.48 -0.18 0.00 0.00 0.00 0.00 51.96 53.82 2a3w s ALA 90 Cb -0.10 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 2a3w s ALA 90 CO 0.31 -0.26 1.12 -2.30 0.00 0.00 0.00 175.76 174.63 2a3w n PRO 91 N 2.69 1.01 -3.81 0.00 -0.02 -1.26 -4.66 135.00 128.96 2a3w n PRO 91 Ca -0.14 0.40 -0.12 0.00 -2.02 0.00 0.00 63.50 61.61 2a3w n PRO 91 Cb 0.56 -2.33 -0.12 0.00 -0.02 0.00 0.00 33.50 31.59 2a3w n PRO 91 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2a3w s VAL 92 N -1.45 0.00 -0.22 -1.45 0.11 -0.28 -5.02 120.40 112.10 2a3w s VAL 92 Ca 0.79 -0.03 -0.08 0.00 -2.93 0.00 0.00 61.98 59.73 2a3w s VAL 92 Cb -0.40 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.14 2a3w s VAL 92 CO 0.44 -0.01 0.09 -2.28 -3.33 0.00 0.00 175.10 170.01 2a3w s HIS 93 N 0.04 3.22 -0.12 1.54 2.46 -1.26 -1.07 115.29 120.11 2a3w s HIS 93 Ca -0.01 0.00 0.02 0.00 0.47 0.00 0.00 55.06 55.55 2a3w s HIS 93 Cb -0.02 -2.18 -0.00 0.00 -0.13 0.00 0.00 32.58 30.25 2a3w s HIS 93 CO 0.00 -0.00 -0.20 0.42 -2.47 0.00 0.00 174.74 172.49 2a3w s ILE 94 N 0.89 2.41 0.09 0.89 1.01 0.29 -0.33 121.20 126.45 2a3w s ILE 94 Ca 0.05 -0.89 0.10 0.00 0.00 0.00 0.00 60.65 59.91 2a3w s ILE 94 Cb -0.13 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 2a3w s ILE 94 CO 0.03 0.55 -0.26 0.00 0.00 0.00 0.00 174.94 175.25 2a3w s VAL 96 N -0.93 -0.05 0.11 0.00 0.11 0.30 0.17 120.40 120.12 2a3w s VAL 96 Ca 0.13 0.17 0.10 0.00 -2.93 0.00 0.00 61.98 59.44 2a3w s VAL 96 Cb -0.10 -0.20 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 2a3w s VAL 96 CO 0.04 0.07 -0.24 -0.94 -3.33 0.00 0.00 175.10 170.70 2a3w s SER 97 N 1.02 3.49 0.02 3.54 1.04 -0.20 -0.28 113.70 122.33 2a3w s SER 97 Ca -0.08 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 55.70 2a3w s SER 97 Cb -0.11 -0.34 -0.01 0.00 0.10 0.00 0.00 66.02 65.66 2a3w s SER 97 CO -0.05 0.19 -0.05 0.86 0.98 0.00 0.00 173.24 175.18 2a3w s TRP 98 N -1.05 0.42 -0.14 5.02 -0.00 -0.34 -0.87 118.94 121.99 2a3w s TRP 98 Ca 0.15 -0.31 -0.03 0.00 -0.00 0.00 0.00 56.10 55.91 2a3w s TRP 98 Cb -0.10 -0.27 0.05 0.00 -0.00 0.00 0.00 33.47 33.15 2a3w s TRP 98 CO 0.07 -0.07 0.04 -2.00 -0.00 0.00 0.00 176.95 174.98 2a3w s GLU 99 N -0.88 0.47 0.22 5.86 2.12 -0.98 -1.83 118.70 123.67 2a3w s GLU 99 Ca -0.06 -0.12 -0.08 0.00 0.36 0.00 0.00 54.97 55.06 2a3w s GLU 99 Cb -0.06 -1.57 0.24 0.00 0.26 0.00 0.00 34.13 33.00 2a3w s GLU 99 CO -0.00 -0.51 1.85 1.03 -0.54 0.00 0.00 175.26 177.08 2a3w h SER 100 N 8.32 0.76 -0.17 -1.70 0.87 -1.48 0.34 113.55 120.49 2a3w h SER 100 Ca -0.17 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.38 2a3w h SER 100 Cb 1.13 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.92 2a3w h SER 100 CO 0.29 0.51 0.07 0.77 -0.53 0.00 0.00 176.83 177.93 2a3w h SER 101 N 0.90 0.29 0.00 6.23 4.64 -1.91 0.19 113.55 123.89 2a3w h SER 101 Ca 0.32 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2a3w h SER 101 Cb 0.07 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2a3w h SER 101 CO -0.13 0.30 -0.86 -1.54 -0.87 0.00 0.00 176.83 173.72 2a3w n SER 102 N -4.41 1.47 0.00 4.97 3.41 -1.16 -4.70 113.62 113.19 2a3w n SER 102 Ca 0.00 -0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 2a3w n SER 102 Cb 0.15 1.19 0.00 0.00 -0.26 0.00 0.00 64.21 65.28 2a3w n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a3w n GLY 103 N 1.54 1.18 3.70 5.00 0.00 0.12 -4.82 105.19 111.91 2a3w n GLY 103 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2a3w n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a3w s ILE 104 N -3.09 3.35 -0.16 -0.61 -1.09 -1.16 -0.87 121.20 117.57 2a3w s ILE 104 Ca 0.00 0.85 -0.04 0.00 -2.23 0.00 0.00 60.65 59.23 2a3w s ILE 104 Cb 0.00 -3.55 -0.03 0.00 -1.58 0.00 0.00 42.46 37.30 2a3w s ILE 104 CO 0.00 0.02 -0.03 0.00 -1.23 0.00 0.00 174.94 173.71 2a3w s ALA 105 N 1.96 3.03 -0.24 9.38 0.00 0.21 -2.31 121.76 133.79 2a3w s ALA 105 Ca 0.67 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.83 2a3w s ALA 105 Cb -0.36 -1.59 0.05 0.00 0.00 0.00 0.00 23.12 21.22 2a3w s ALA 105 CO 0.29 0.20 -0.13 -1.21 0.00 0.00 0.00 175.76 174.92 2a3w s GLU 106 N 0.38 2.35 -0.03 0.00 2.02 -0.05 -2.10 118.70 121.27 2a3w s GLU 106 Ca -0.03 -1.17 -0.15 0.00 0.02 0.00 0.00 54.97 53.63 2a3w s GLU 106 Cb -0.14 -2.76 -0.05 0.00 0.10 0.00 0.00 34.13 31.27 2a3w s GLU 106 CO 0.03 -0.48 0.41 -0.06 0.02 0.00 0.00 175.26 175.18 2a3w s PHE 107 N 1.18 3.67 -0.14 1.61 0.08 -1.26 -1.03 117.98 122.09 2a3w s PHE 107 Ca -0.05 0.95 0.00 0.00 0.12 0.00 0.00 56.93 57.95 2a3w s PHE 107 Cb -0.18 -2.34 0.02 0.00 -0.57 0.00 0.00 43.02 39.95 2a3w s PHE 107 CO -0.07 0.53 -0.13 -1.58 -0.10 0.00 0.00 175.22 173.86 2a3w s TRP 108 N -0.66 2.07 -0.20 0.36 0.52 0.13 -0.78 118.94 120.38 2a3w s TRP 108 Ca 0.24 -1.15 -0.02 0.00 0.02 0.00 0.00 56.10 55.19 2a3w s TRP 108 Cb -0.16 -1.54 0.00 0.00 -1.15 0.00 0.00 33.47 30.62 2a3w s TRP 108 CO 0.12 -0.64 -0.10 0.42 0.02 0.00 0.00 176.95 176.77 2a3w s ILE 109 N 1.49 2.86 -1.61 2.03 -1.09 0.25 -0.56 121.20 124.58 2a3w s ILE 109 Ca 0.04 -0.67 -0.14 0.00 -2.23 0.00 0.00 60.65 57.66 2a3w s ILE 109 Cb -0.13 -2.27 0.11 0.00 -1.58 0.00 0.00 42.46 38.59 2a3w s ILE 109 CO -0.10 0.47 0.73 0.59 -1.23 0.00 0.00 174.94 175.40 2a3w n ASN 110 N 4.72 -2.86 0.00 3.58 3.02 0.55 -0.69 115.26 123.59 2a3w n ASN 110 Ca -0.19 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 2a3w n ASN 110 Cb 0.51 -3.00 0.00 0.00 -0.61 0.00 0.00 39.78 36.68 2a3w n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a3w n GLY 111 N -1.58 0.83 3.55 7.41 0.00 -1.26 -5.02 105.19 109.12 2a3w n GLY 111 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2a3w n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a3w s THR 112 N -3.34 4.65 0.11 2.61 2.01 0.14 -4.93 115.64 116.88 2a3w s THR 112 Ca 0.00 -0.07 -0.30 0.00 0.31 0.00 0.00 61.69 61.63 2a3w s THR 112 Cb 0.00 -3.14 -0.07 0.00 0.01 0.00 0.00 72.50 69.30 2a3w s THR 112 CO 0.00 0.39 1.23 -2.16 -0.69 0.00 0.00 174.62 173.39 2a3w s PRO 113 N 1.01 4.43 0.61 4.92 0.04 -1.26 -0.58 135.00 144.16 2a3w s PRO 113 Ca 0.04 1.86 -0.02 0.00 0.04 0.00 0.00 61.00 62.92 2a3w s PRO 113 Cb -0.14 -3.29 0.04 0.00 0.04 0.00 0.00 34.50 31.15 2a3w s PRO 113 CO 0.03 -0.24 0.87 -0.51 0.04 0.00 0.00 177.00 177.19 2a3w s LEU 114 N 0.66 3.12 0.16 -3.56 1.43 0.04 -4.95 118.68 115.58 2a3w s LEU 114 Ca 0.58 0.20 -0.32 0.00 -1.03 0.00 0.00 54.13 53.56 2a3w s LEU 114 Cb -0.32 -3.00 -0.12 0.00 0.03 0.00 0.00 46.19 42.79 2a3w s LEU 114 CO 0.32 -1.29 1.77 0.52 0.23 0.00 0.00 176.35 177.89 2a3w n VAL 115 N -2.56 0.18 -1.85 -1.59 0.31 -1.26 -4.68 118.33 106.88 2a3w n VAL 115 Ca 0.08 -0.03 -0.40 0.00 -0.01 0.00 0.00 64.34 63.97 2a3w n VAL 115 Cb 0.60 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 2a3w n VAL 115 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2a3w s LYS 116 N 1.94 3.95 0.40 5.55 1.02 -1.26 -4.77 119.74 126.56 2a3w s LYS 116 Ca 0.79 2.44 0.03 0.00 0.02 0.00 0.00 55.97 59.26 2a3w s LYS 116 Cb -0.51 -2.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2a3w s LYS 116 CO 0.35 -0.61 0.09 0.15 -0.92 0.00 0.00 175.35 174.42 2a3w s LYS 117 N -2.22 1.88 -0.11 1.68 -0.14 -0.89 -4.99 119.74 114.94 2a3w s LYS 117 Ca 0.56 -2.12 -0.09 0.00 -1.36 0.00 0.00 55.97 52.96 2a3w s LYS 117 Cb -0.44 -0.82 0.03 0.00 -1.68 0.00 0.00 37.83 34.92 2a3w s LYS 117 CO 0.58 -0.37 0.28 0.20 -0.76 0.00 0.00 175.35 175.29 2a3w s GLY 118 N -3.61 -0.21 -0.06 -3.33 0.00 -1.26 0.64 107.32 99.49 2a3w s GLY 118 Ca 0.26 0.86 -0.27 0.00 0.00 0.00 0.00 44.72 45.57 2a3w s GLY 118 CO 0.13 0.82 0.60 0.48 0.00 0.00 0.00 173.10 175.13 2a3w s LEU 119 N 0.37 -0.33 -1.38 0.66 2.34 -0.05 -4.97 118.68 115.34 2a3w s LEU 119 Ca -0.02 0.65 -0.08 0.00 0.06 0.00 0.00 54.13 54.74 2a3w s LEU 119 Cb -0.04 2.24 0.03 0.00 -0.56 0.00 0.00 46.19 47.87 2a3w s LEU 119 CO -0.02 -0.54 1.08 0.54 -1.06 0.00 0.00 176.35 176.36 2a3w n ARG 120 N 1.18 -7.00 -1.69 1.48 1.74 -1.26 -4.53 116.66 106.58 2a3w n ARG 120 Ca -0.19 0.76 -0.44 0.00 -0.77 0.00 0.00 57.85 57.21 2a3w n ARG 120 Cb 0.57 -5.74 -0.04 0.00 -1.02 0.00 0.00 32.46 26.23 2a3w n ARG 120 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2a3w n GLN 121 N -4.76 2.48 0.00 5.56 7.27 -1.26 -1.61 117.38 125.06 2a3w n GLN 121 Ca -0.05 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.92 2a3w n GLN 121 Cb 0.58 -2.72 0.00 0.00 2.41 0.00 0.00 30.24 30.50 2a3w n GLN 121 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2a3w n GLY 122 N 3.86 1.74 3.83 1.69 0.00 0.64 -4.97 105.19 111.98 2a3w n GLY 122 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2a3w n GLY 122 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2a3w s TYR 123 N -2.34 3.34 -0.20 1.61 5.04 -0.63 -5.01 117.35 119.16 2a3w s TYR 123 Ca 0.00 1.51 -0.02 0.00 -2.44 0.00 0.00 57.07 56.12 2a3w s TYR 123 Cb 0.00 -2.78 0.00 0.00 0.35 0.00 0.00 41.96 39.53 2a3w s TYR 123 CO 0.00 -0.10 -0.10 -0.06 -1.34 0.00 0.00 175.55 173.95 2a3w s PHE 124 N -2.20 2.89 0.07 4.97 0.40 -1.26 -4.70 117.98 118.15 2a3w s PHE 124 Ca 0.60 -1.15 -0.31 0.00 -0.60 0.00 0.00 56.93 55.47 2a3w s PHE 124 Cb -0.09 -2.03 -0.07 0.00 0.51 0.00 0.00 43.02 41.34 2a3w s PHE 124 CO 0.16 -0.61 1.45 0.54 0.70 0.00 0.00 175.22 177.46 2a3w s VAL 125 N 1.34 3.36 0.59 -0.44 0.11 -0.56 -4.80 120.40 120.00 2a3w s VAL 125 Ca 0.04 0.88 -0.19 0.00 -2.93 0.00 0.00 61.98 59.79 2a3w s VAL 125 Cb -0.14 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.11 2a3w s VAL 125 CO -0.06 0.03 1.19 -1.61 -3.33 0.00 0.00 175.10 171.32 2a3w s GLU 126 N 1.83 3.03 0.00 1.54 0.41 -1.26 0.10 118.70 124.35 2a3w s GLU 126 Ca 0.66 1.77 0.00 0.00 -0.41 0.00 0.00 54.97 57.00 2a3w s GLU 126 Cb -0.36 -1.94 0.00 0.00 -1.78 0.00 0.00 34.13 30.05 2a3w s GLU 126 CO 0.29 -1.14 0.00 0.00 -0.49 0.00 0.00 175.26 173.92 2a3w n ALA 127 N -1.56 0.00 -3.61 5.21 0.00 -1.26 -4.70 120.51 114.59 2a3w n ALA 127 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.34 2a3w n ALA 127 Cb 0.50 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.99 2a3w n ALA 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2a3w n GLN 128 N -0.78 -3.49 -2.80 0.00 1.13 -1.08 -4.84 117.38 105.54 2a3w n GLN 128 Ca 0.00 0.63 -0.30 0.00 -1.94 0.00 0.00 57.00 55.39 2a3w n GLN 128 Cb 0.00 -5.03 -0.02 0.00 0.11 0.00 0.00 30.24 25.29 2a3w n GLN 128 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2a3w s PRO 129 N -5.68 3.72 -0.27 -1.09 0.04 -1.26 -4.58 135.00 125.88 2a3w s PRO 129 Ca 0.21 0.41 -0.08 0.00 0.04 0.00 0.00 61.00 61.58 2a3w s PRO 129 Cb -0.06 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 2a3w s PRO 129 CO 0.81 -0.08 0.11 0.15 0.04 0.00 0.00 177.00 178.03 2a3w s LYS 130 N -4.05 3.63 -0.19 4.56 1.02 -0.27 -4.92 119.74 119.51 2a3w s LYS 130 Ca 0.50 -0.51 -0.03 0.00 0.02 0.00 0.00 55.97 55.95 2a3w s LYS 130 Cb -0.10 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.75 2a3w s LYS 130 CO 0.35 -0.24 -0.05 0.42 -0.92 0.00 0.00 175.35 174.90 2a3w s ILE 131 N 1.64 3.55 0.06 2.17 1.01 -1.26 -2.23 121.20 126.15 2a3w s ILE 131 Ca 0.06 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.30 2a3w s ILE 131 Cb -0.16 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 2a3w s ILE 131 CO 0.06 0.46 -0.13 0.68 0.00 0.00 0.00 174.94 176.00 2a3w s VAL 132 N 0.94 1.05 0.02 2.92 -7.23 0.17 -0.40 120.40 117.87 2a3w s VAL 132 Ca -0.00 -1.22 0.07 0.00 -1.81 0.00 0.00 61.98 59.02 2a3w s VAL 132 Cb -0.15 -1.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.75 2a3w s VAL 132 CO 0.01 -0.20 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.64 2a3w s LEU 133 N -1.61 2.45 0.00 1.32 1.02 -0.01 -1.92 118.68 119.94 2a3w s LEU 133 Ca -0.02 -0.43 0.00 0.00 0.02 0.00 0.00 54.13 53.70 2a3w s LEU 133 Cb -0.10 -1.45 0.00 0.00 0.02 0.00 0.00 46.19 44.67 2a3w s LEU 133 CO 0.02 0.28 0.00 0.61 0.02 0.00 0.00 176.35 177.28 2a3w n GLY 134 N 1.86 3.11 3.17 -3.19 0.00 -1.26 -1.20 105.19 107.68 2a3w n GLY 134 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 2a3w n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2a3w s GLN 135 N -0.34 0.84 -0.18 1.61 -1.52 -1.26 -1.04 119.66 117.75 2a3w s GLN 135 Ca 0.00 -1.29 -0.10 0.00 -1.95 0.00 0.00 55.36 52.02 2a3w s GLN 135 Cb 0.00 -0.28 -0.05 0.00 -0.22 0.00 0.00 33.01 32.47 2a3w s GLN 135 CO 0.00 0.00 0.14 -2.00 -0.25 0.00 0.00 175.29 173.18 2a3w s GLU 136 N -3.60 4.06 0.11 2.91 -6.30 -1.26 -4.61 118.70 110.01 2a3w s GLU 136 Ca 0.10 -0.19 -0.24 0.00 -2.50 0.00 0.00 54.97 52.14 2a3w s GLU 136 Cb 0.03 -3.38 -0.07 0.00 0.00 0.00 0.00 34.13 30.72 2a3w s GLU 136 CO -0.04 0.38 0.73 -0.65 0.02 0.00 0.00 175.26 175.71 2a3w s GLN 137 N 0.11 4.48 0.00 4.30 -0.21 -1.26 -4.10 119.66 122.98 2a3w s GLN 137 Ca 0.10 1.04 0.05 0.00 0.02 0.00 0.00 55.36 56.57 2a3w s GLN 137 Cb -0.11 -3.29 0.00 0.00 1.00 0.00 0.00 33.01 30.61 2a3w s GLN 137 CO -0.01 0.49 0.47 -0.25 -2.12 0.00 0.00 175.29 173.88 2a3w n ASP 138 N 2.00 0.93 -2.86 5.90 8.00 -0.53 -4.62 116.55 125.38 2a3w n ASP 138 Ca -0.06 -0.97 -0.14 0.00 0.71 0.00 0.00 54.79 54.34 2a3w n ASP 138 Cb 0.50 0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 41.97 2a3w n ASP 138 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2a3w n SER 139 N -0.28 1.32 -4.57 -2.24 3.41 -1.03 -4.82 113.62 105.40 2a3w n SER 139 Ca 0.02 -2.18 -0.40 0.00 -0.26 0.00 0.00 58.87 56.06 2a3w n SER 139 Cb 0.11 0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 2a3w n SER 139 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2a3w s TYR 140 N -2.32 2.54 0.00 7.33 5.04 -1.26 -3.71 117.35 124.97 2a3w s TYR 140 Ca 0.10 -0.98 0.00 0.00 -2.44 0.00 0.00 57.07 53.75 2a3w s TYR 140 Cb 0.00 -4.61 0.00 0.00 0.35 0.00 0.00 41.96 37.70 2a3w s TYR 140 CO 0.07 -1.79 0.00 0.41 -1.34 0.00 0.00 175.55 172.89 2a3w n GLY 141 N 6.09 1.59 0.00 8.97 0.00 -1.26 -5.02 105.19 115.55 2a3w n GLY 141 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2a3w n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3w n GLY 142 N -0.93 4.56 3.71 -0.02 0.00 -1.24 -4.99 105.19 106.28 2a3w n GLY 142 Ca 0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 2a3w n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a3w n LYS 143 N 0.00 -2.52 -1.37 1.61 5.02 -1.26 -1.45 118.16 118.18 2a3w n LYS 143 Ca 0.00 0.51 -0.29 0.00 -2.02 0.00 0.00 58.31 56.51 2a3w n LYS 143 Cb 0.00 -4.55 0.15 0.00 -0.02 0.00 0.00 35.03 30.61 2a3w n LYS 143 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2a3w s PHE 144 N -3.61 2.33 -0.17 2.13 0.08 -1.26 -2.73 117.98 114.75 2a3w s PHE 144 Ca 0.27 0.91 -0.04 0.00 0.12 0.00 0.00 56.93 58.19 2a3w s PHE 144 Cb -0.09 -3.33 0.08 0.00 -0.57 0.00 0.00 43.02 39.11 2a3w s PHE 144 CO 0.85 -2.61 0.19 0.34 -0.10 0.00 0.00 175.22 173.89 2a3w s ASP 145 N -3.77 1.29 0.37 1.36 -1.08 -1.26 -4.98 116.67 108.60 2a3w s ASP 145 Ca 0.64 -0.09 0.14 0.00 -0.52 0.00 0.00 52.55 52.73 2a3w s ASP 145 Cb -0.16 0.30 0.99 0.00 -1.46 0.00 0.00 42.92 42.59 2a3w s ASP 145 CO 0.55 -0.31 1.79 -0.09 0.52 0.00 0.00 175.17 177.63 2a3w h ARG 146 N 8.34 0.49 0.00 4.34 2.43 -1.90 0.13 114.38 128.21 2a3w h ARG 146 Ca -0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2a3w h ARG 146 Cb 1.14 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2a3w h ARG 146 CO 0.24 0.32 0.00 -1.13 -1.51 0.00 0.00 179.97 177.89 2a3w n SER 147 N -4.66 0.00 -0.32 -3.80 3.41 -1.26 -2.45 113.62 104.54 2a3w n SER 147 Ca 0.24 0.13 0.04 0.00 -0.26 0.00 0.00 58.87 59.01 2a3w n SER 147 Cb 0.76 -0.35 0.04 0.00 -0.26 0.00 0.00 64.21 64.39 2a3w n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a3w n GLN 148 N -1.35 0.44 -2.18 4.33 6.02 0.43 -4.61 117.38 120.46 2a3w n GLN 148 Ca 0.09 -1.08 -0.38 0.00 -0.01 0.00 0.00 57.00 55.63 2a3w n GLN 148 Cb 0.21 -1.15 -0.01 0.00 1.02 0.00 0.00 30.24 30.31 2a3w n GLN 148 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2a3w s SER 149 N -0.68 6.21 -0.25 1.08 1.04 -1.00 -1.52 113.70 118.58 2a3w s SER 149 Ca 0.10 2.43 -0.15 0.00 0.48 0.00 0.00 55.95 58.81 2a3w s SER 149 Cb 0.07 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.53 2a3w s SER 149 CO 0.10 -0.90 0.38 0.12 0.98 0.00 0.00 173.24 173.91 2a3w s PHE 150 N -1.43 3.28 -0.17 5.02 5.36 -0.21 -4.73 117.98 125.10 2a3w s PHE 150 Ca 0.61 0.46 -0.03 0.00 -0.96 0.00 0.00 56.93 57.01 2a3w s PHE 150 Cb -0.32 -2.56 -0.02 0.00 -0.34 0.00 0.00 43.02 39.78 2a3w s PHE 150 CO 0.40 -0.18 -0.05 0.08 -1.46 0.00 0.00 175.22 174.01 2a3w s VAL 151 N 1.90 3.59 -3.73 3.12 1.01 -1.26 -4.74 120.40 120.29 2a3w s VAL 151 Ca 0.16 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.69 2a3w s VAL 151 Cb -0.15 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.64 2a3w s VAL 151 CO 0.09 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.28 2a3w n GLY 152 N 3.89 0.70 3.21 4.51 0.00 -0.06 -4.48 105.19 112.97 2a3w n GLY 152 Ca -0.18 -1.81 -0.28 0.00 0.00 0.00 0.00 46.02 43.76 2a3w n GLY 152 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a3w s GLU 153 N -1.49 1.88 -0.06 1.61 2.02 0.19 -0.45 118.70 122.40 2a3w s GLU 153 Ca 0.00 -0.75 0.02 0.00 0.02 0.00 0.00 54.97 54.26 2a3w s GLU 153 Cb 0.00 -1.73 0.01 0.00 0.10 0.00 0.00 34.13 32.51 2a3w s GLU 153 CO 0.00 0.39 -0.11 0.42 0.02 0.00 0.00 175.26 175.98 2a3w s ILE 154 N -0.31 1.03 0.33 -1.63 1.01 -0.51 -0.44 121.20 120.68 2a3w s ILE 154 Ca 0.03 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.29 2a3w s ILE 154 Cb -0.10 -0.95 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 2a3w s ILE 154 CO 0.01 0.33 0.33 -0.83 0.00 0.00 0.00 174.94 174.78 2a3w s GLY 155 N 0.60 2.02 -1.47 6.18 0.00 0.12 -0.68 107.32 114.07 2a3w s GLY 155 Ca -0.12 -1.88 -0.05 0.00 0.00 0.00 0.00 44.72 42.67 2a3w s GLY 155 CO 0.03 -1.32 0.52 1.22 0.00 0.00 0.00 173.10 173.55 2a3w n ASP 156 N -1.44 -1.14 -4.65 1.64 8.00 -1.26 -0.52 116.55 117.18 2a3w n ASP 156 Ca 0.05 -1.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.15 2a3w n ASP 156 Cb 0.62 -3.03 -0.05 0.00 -0.02 0.00 0.00 41.12 38.63 2a3w n ASP 156 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2a3w s LEU 157 N -7.05 4.11 0.01 0.64 1.98 -1.26 -3.84 118.68 113.28 2a3w s LEU 157 Ca 0.19 0.87 0.02 0.00 -2.89 0.00 0.00 54.13 52.32 2a3w s LEU 157 Cb -0.10 -2.97 -0.01 0.00 0.66 0.00 0.00 46.19 43.77 2a3w s LEU 157 CO 0.89 -0.36 -0.07 -0.31 -1.89 0.00 0.00 176.35 174.61 2a3w s TYR 158 N 2.26 0.65 -0.05 5.38 1.51 0.65 -1.30 117.35 126.46 2a3w s TYR 158 Ca 0.30 -0.23 -0.02 0.00 -1.01 0.00 0.00 57.07 56.11 2a3w s TYR 158 Cb -0.16 -0.41 0.03 0.00 -0.11 0.00 0.00 41.96 41.32 2a3w s TYR 158 CO 0.10 -0.02 0.03 1.41 -1.11 0.00 0.00 175.55 175.95 2a3w s MET 159 N -0.62 0.23 0.14 -0.62 1.75 0.23 -0.55 119.30 119.85 2a3w s MET 159 Ca -0.01 0.26 0.05 0.00 -1.25 0.00 0.00 55.69 54.74 2a3w s MET 159 Cb -0.05 -0.71 -0.04 0.00 2.84 0.00 0.00 34.83 36.87 2a3w s MET 159 CO 0.00 -0.32 0.07 -1.58 -0.65 0.00 0.00 175.02 172.55 2a3w s TRP 160 N 2.08 3.06 -0.35 4.11 0.51 -0.06 -1.15 118.94 127.14 2a3w s TRP 160 Ca 0.05 -0.03 0.03 0.00 -2.12 0.00 0.00 56.10 54.04 2a3w s TRP 160 Cb -0.12 -1.51 0.34 0.00 -0.81 0.00 0.00 33.47 31.37 2a3w s TRP 160 CO -0.04 0.51 1.32 -0.40 -0.51 0.00 0.00 176.95 177.84 2a3w n ASP 161 N 0.01 3.32 -4.08 2.95 5.75 -1.26 -1.41 116.55 121.83 2a3w n ASP 161 Ca -0.09 -2.66 -0.10 0.00 -0.01 0.00 0.00 54.79 51.93 2a3w n ASP 161 Cb 0.54 -0.64 -0.09 0.00 -1.03 0.00 0.00 41.12 39.90 2a3w n ASP 161 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2a3w s SER 162 N -0.18 0.20 -0.44 -1.12 1.04 -1.23 -4.37 113.70 107.60 2a3w s SER 162 Ca 0.27 -1.10 -0.27 0.00 0.48 0.00 0.00 55.95 55.33 2a3w s SER 162 Cb 0.22 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.72 2a3w s SER 162 CO 0.06 -0.80 0.99 -0.69 0.98 0.00 0.00 173.24 173.78 2a3w s VAL 163 N -4.03 4.43 0.15 5.02 1.01 -1.26 -2.04 120.40 123.68 2a3w s VAL 163 Ca 0.23 1.02 -0.31 0.00 0.00 0.00 0.00 61.98 62.92 2a3w s VAL 163 Cb 0.06 -4.46 -0.08 0.00 0.00 0.00 0.00 36.38 31.90 2a3w s VAL 163 CO 0.02 -0.80 1.32 -0.76 0.00 0.00 0.00 175.10 174.88 2a3w s LEU 164 N 3.87 4.40 0.75 3.92 1.02 -1.26 -5.03 118.68 126.35 2a3w s LEU 164 Ca 0.41 2.32 -0.13 0.00 0.02 0.00 0.00 54.13 56.75 2a3w s LEU 164 Cb -0.10 -3.60 0.05 0.00 0.02 0.00 0.00 46.19 42.56 2a3w s LEU 164 CO 0.25 -0.56 1.12 -2.16 0.02 0.00 0.00 176.35 175.03 2a3w s PRO 165 N 0.45 2.26 0.39 1.29 0.04 -1.26 -4.78 135.00 133.39 2a3w s PRO 165 Ca 0.60 1.39 0.20 0.00 0.04 0.00 0.00 61.00 63.22 2a3w s PRO 165 Cb -0.36 -1.88 1.17 0.00 0.04 0.00 0.00 34.50 33.47 2a3w s PRO 165 CO 0.34 -1.67 1.70 -1.35 0.04 0.00 0.00 177.00 176.06 2a3w h PRO 166 N -0.70 0.30 -0.65 0.56 0.11 -1.99 -1.07 132.00 128.56 2a3w h PRO 166 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2a3w h PRO 166 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2a3w h PRO 166 CO 0.51 0.20 0.13 1.05 -0.21 0.00 0.00 178.00 179.68 2a3w h GLU 167 N 0.31 1.05 0.00 1.05 9.09 -1.99 -0.87 114.58 123.21 2a3w h GLU 167 Ca 0.69 -0.25 -0.14 0.00 0.05 0.00 0.00 59.36 59.70 2a3w h GLU 167 Cb 1.81 -0.14 -0.02 0.00 -1.65 0.00 0.00 28.75 28.75 2a3w h GLU 167 CO -0.42 0.94 -0.69 -0.91 0.05 0.00 0.00 179.01 177.98 2a3w h ASN 168 N 0.99 0.00 0.14 3.06 2.35 -1.56 -0.67 115.58 119.89 2a3w h ASN 168 Ca 0.20 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 2a3w h ASN 168 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2a3w h ASN 168 CO 0.01 0.69 -0.07 0.40 -1.65 0.00 0.00 177.43 176.81 2a3w h ILE 169 N 0.00 0.95 -0.77 2.81 1.08 -1.15 -1.72 117.51 118.72 2a3w h ILE 169 Ca -0.01 -0.39 0.09 0.00 -0.39 0.00 0.00 64.86 64.16 2a3w h ILE 169 Cb 1.25 1.19 -0.07 0.00 -3.07 0.00 0.00 36.82 36.12 2a3w h ILE 169 CO 0.09 0.09 0.42 -0.07 -0.69 0.00 0.00 178.15 178.00 2a3w h LEU 170 N -0.38 0.60 -0.25 1.44 3.38 -1.09 -0.78 115.31 118.23 2a3w h LEU 170 Ca -0.02 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.06 2a3w h LEU 170 Cb 0.30 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 2a3w h LEU 170 CO 0.03 0.35 -0.17 0.28 0.09 0.00 0.00 178.44 179.03 2a3w h SER 171 N 0.73 -0.55 -0.62 -0.43 0.02 -0.98 0.26 113.55 111.98 2a3w h SER 171 Ca 0.37 0.12 0.01 0.00 -0.84 0.00 0.00 61.79 61.44 2a3w h SER 171 Cb 0.33 0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 2a3w h SER 171 CO -0.24 -0.21 0.41 0.00 -1.14 0.00 0.00 176.83 175.65 2a3w h ALA 172 N 1.00 0.80 -0.76 3.77 0.00 -0.52 -0.28 119.26 123.26 2a3w h ALA 172 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2a3w h ALA 172 Cb 0.37 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2a3w h ALA 172 CO -0.35 0.21 0.50 -0.92 0.00 0.00 0.00 179.25 178.69 2a3w h TYR 173 N 0.83 0.97 0.00 0.00 3.20 -0.53 -2.65 116.97 118.80 2a3w h TYR 173 Ca 0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.12 2a3w h TYR 173 Cb -0.08 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 37.87 2a3w h TYR 173 CO -0.03 0.62 0.00 1.04 -1.64 0.00 0.00 178.16 178.15 2a3w n GLN 174 N -4.54 0.16 0.00 1.82 6.02 0.87 -4.89 117.38 116.82 2a3w n GLN 174 Ca 0.07 0.28 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 2a3w n GLN 174 Cb 0.02 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 29.54 2a3w n GLN 174 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2a3w n GLY 175 N 0.55 1.11 2.57 1.08 0.00 -0.80 -5.03 105.19 104.68 2a3w n GLY 175 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2a3w n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a3w n THR 176 N -1.63 1.97 -2.21 2.61 -2.24 -0.18 -5.01 114.28 107.60 2a3w n THR 176 Ca 0.00 -5.15 -0.36 0.00 -2.27 0.00 0.00 64.05 56.27 2a3w n THR 176 Cb 0.00 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.68 2a3w n THR 176 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2a3w s PRO 177 N -2.73 3.43 0.58 -0.78 0.04 -1.24 -4.23 135.00 130.07 2a3w s PRO 177 Ca 0.43 1.72 -0.18 0.00 0.04 0.00 0.00 61.00 63.00 2a3w s PRO 177 Cb 0.23 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 2a3w s PRO 177 CO -0.08 -0.81 1.14 -0.51 0.04 0.00 0.00 177.00 176.78 2a3w s LEU 178 N -3.57 3.64 0.47 -3.56 1.02 -1.26 -4.95 118.68 110.47 2a3w s LEU 178 Ca 0.70 2.18 -0.23 0.00 0.02 0.00 0.00 54.13 56.81 2a3w s LEU 178 Cb -0.27 -4.58 -0.09 0.00 0.02 0.00 0.00 46.19 41.27 2a3w s LEU 178 CO 0.31 -1.40 0.99 -2.65 0.02 0.00 0.00 176.35 173.61 2a3w n PRO 179 N -1.63 1.23 -4.93 1.29 -0.02 -1.26 -5.00 135.00 124.68 2a3w n PRO 179 Ca 0.12 0.45 -0.27 0.00 -2.02 0.00 0.00 63.50 61.77 2a3w n PRO 179 Cb 0.51 -2.07 -0.16 0.00 -0.02 0.00 0.00 33.50 31.76 2a3w n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a3w s ALA 180 N -1.35 1.67 -0.90 3.55 0.00 -1.26 -5.00 121.76 118.46 2a3w s ALA 180 Ca 0.66 -0.77 0.25 0.00 0.00 0.00 0.00 51.96 52.11 2a3w s ALA 180 Cb -0.51 -0.55 0.53 0.00 0.00 0.00 0.00 23.12 22.59 2a3w s ALA 180 CO 0.54 0.30 1.44 0.27 0.00 0.00 0.00 175.76 178.31 2a3w n ASN 181 N 3.13 0.50 -0.11 0.00 6.94 -1.23 -4.32 115.26 120.18 2a3w n ASN 181 Ca -0.18 -0.08 -0.18 0.00 -0.02 0.00 0.00 54.58 54.12 2a3w n ASN 181 Cb 0.53 0.16 -0.07 0.00 -2.36 0.00 0.00 39.78 38.04 2a3w n ASN 181 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 2a3w n ILE 182 N -1.67 1.50 -4.13 1.53 5.41 -0.30 -4.95 119.36 116.76 2a3w n ILE 182 Ca 0.05 -0.07 -0.17 0.00 1.00 0.00 0.00 62.75 63.56 2a3w n ILE 182 Cb 0.36 -2.14 -0.15 0.00 -0.71 0.00 0.00 39.64 37.00 2a3w n ILE 182 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2a3w s LEU 183 N -7.80 1.76 -0.07 1.39 1.02 -0.95 -4.66 118.68 109.38 2a3w s LEU 183 Ca -0.31 -0.09 -0.02 0.00 0.02 0.00 0.00 54.13 53.73 2a3w s LEU 183 Cb 0.08 -0.29 0.04 0.00 0.02 0.00 0.00 46.19 46.03 2a3w s LEU 183 CO 0.45 0.02 0.06 -0.62 0.02 0.00 0.00 176.35 176.27 2a3w s ASP 184 N 0.23 1.43 0.41 2.29 -1.08 -1.26 -0.60 116.67 118.09 2a3w s ASP 184 Ca -0.02 -0.08 0.16 0.00 -0.52 0.00 0.00 52.55 52.09 2a3w s ASP 184 Cb -0.06 -0.20 1.03 0.00 -1.46 0.00 0.00 42.92 42.23 2a3w s ASP 184 CO -0.00 -0.26 1.87 -0.25 0.52 0.00 0.00 175.17 177.04 2a3w h TRP 185 N 8.42 0.58 -0.00 -5.34 2.91 -1.56 0.50 115.95 121.46 2a3w h TRP 185 Ca -0.13 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.90 2a3w h TRP 185 Cb 1.13 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.60 2a3w h TRP 185 CO 0.42 0.18 -0.08 1.04 -1.03 0.00 0.00 178.44 178.97 2a3w n GLN 186 N -4.52 0.82 -2.98 2.65 6.02 -1.26 -1.40 117.38 116.72 2a3w n GLN 186 Ca 0.18 -0.27 -0.14 0.00 -0.01 0.00 0.00 57.00 56.76 2a3w n GLN 186 Cb 0.63 -1.49 0.02 0.00 1.02 0.00 0.00 30.24 30.42 2a3w n GLN 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2a3w n ALA 187 N -0.85 0.73 -2.71 -1.58 0.00 0.07 -3.74 120.51 112.43 2a3w n ALA 187 Ca 0.16 -2.52 -0.37 0.00 0.00 0.00 0.00 53.44 50.71 2a3w n ALA 187 Cb 0.26 -1.04 -0.07 0.00 0.00 0.00 0.00 19.45 18.61 2a3w n ALA 187 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2a3w s LEU 188 N -2.28 4.22 -0.37 0.00 2.96 0.11 -4.43 118.68 118.89 2a3w s LEU 188 Ca 0.32 0.59 -0.14 0.00 -0.22 0.00 0.00 54.13 54.68 2a3w s LEU 188 Cb 0.32 -2.51 -0.00 0.00 0.50 0.00 0.00 46.19 44.50 2a3w s LEU 188 CO -0.07 0.01 0.27 0.21 -1.32 0.00 0.00 176.35 175.45 2a3w s ASN 189 N 0.72 6.09 0.05 3.68 2.47 -1.26 -0.20 114.94 126.49 2a3w s ASN 189 Ca 0.20 -0.62 -0.06 0.00 0.42 0.00 0.00 52.86 52.81 2a3w s ASN 189 Cb -0.14 -2.15 -0.01 0.00 -1.45 0.00 0.00 41.25 37.49 2a3w s ASN 189 CO 0.07 -0.34 0.10 -0.72 -3.72 0.00 0.00 177.10 172.49 2a3w s TYR 190 N 1.73 0.25 -0.13 0.43 1.13 -1.26 -0.62 117.35 118.88 2a3w s TYR 190 Ca 0.06 -0.63 0.01 0.00 -1.41 0.00 0.00 57.07 55.10 2a3w s TYR 190 Cb -0.18 -0.17 0.02 0.00 -1.10 0.00 0.00 41.96 40.53 2a3w s TYR 190 CO 0.10 -0.42 -0.14 -1.21 -2.51 0.00 0.00 175.55 171.37 2a3w s GLU 191 N -3.23 2.22 -0.13 -3.49 2.02 -0.23 -4.97 118.70 110.89 2a3w s GLU 191 Ca 0.00 -0.54 -0.25 0.00 0.02 0.00 0.00 54.97 54.20 2a3w s GLU 191 Cb 0.02 -1.98 -0.02 0.00 0.10 0.00 0.00 34.13 32.25 2a3w s GLU 191 CO -0.07 -0.16 0.80 0.42 0.02 0.00 0.00 175.26 176.26 2a3w s ILE 192 N 1.27 4.93 -0.20 -1.63 1.01 -1.26 -1.07 121.20 124.24 2a3w s ILE 192 Ca -0.00 1.59 0.01 0.00 0.00 0.00 0.00 60.65 62.25 2a3w s ILE 192 Cb -0.14 -4.12 0.05 0.00 0.01 0.00 0.00 42.46 38.26 2a3w s ILE 192 CO -0.06 0.11 -0.09 -0.13 0.00 0.00 0.00 174.94 174.76 2a3w s ARG 193 N 1.65 1.91 1.98 2.79 1.81 0.30 -5.01 118.95 124.38 2a3w s ARG 193 Ca 0.39 -0.84 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 2a3w s ARG 193 Cb -0.17 -2.40 0.00 0.00 -0.45 0.00 0.00 34.95 31.92 2a3w s ARG 193 CO 0.15 -0.45 0.00 0.41 -0.68 0.00 0.00 175.30 174.73 2a3w n GLY 194 N 4.70 -0.06 3.46 -3.53 0.00 -1.26 -0.77 105.19 107.73 2a3w n GLY 194 Ca -0.14 -1.35 -0.44 0.00 0.00 0.00 0.00 46.02 44.09 2a3w n GLY 194 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2a3w s TYR 195 N 0.00 3.27 -0.05 1.61 5.04 -1.26 -4.93 117.35 121.02 2a3w s TYR 195 Ca 0.00 -1.71 0.01 0.00 -2.44 0.00 0.00 57.07 52.93 2a3w s TYR 195 Cb 0.00 -4.31 0.02 0.00 0.35 0.00 0.00 41.96 38.02 2a3w s TYR 195 CO 0.00 -1.46 -0.07 0.08 -1.34 0.00 0.00 175.55 172.76 2a3w s VAL 196 N 2.28 0.76 -0.07 3.14 1.01 -1.26 -4.30 120.40 121.96 2a3w s VAL 196 Ca 0.38 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 62.16 2a3w s VAL 196 Cb -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.59 2a3w s VAL 196 CO -0.05 0.28 -0.23 -0.63 0.00 0.00 0.00 175.10 174.47 2a3w s ILE 197 N 0.89 2.23 -0.14 2.22 -1.09 -0.34 -4.93 121.20 120.04 2a3w s ILE 197 Ca -0.11 -1.00 -0.23 0.00 -2.23 0.00 0.00 60.65 57.08 2a3w s ILE 197 Cb -0.15 -1.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.88 2a3w s ILE 197 CO 0.01 0.57 0.71 -0.63 -1.23 0.00 0.00 174.94 174.36 2a3w s ILE 198 N -0.14 4.99 0.10 2.92 1.01 -1.26 0.31 121.20 129.13 2a3w s ILE 198 Ca -0.04 1.39 0.02 0.00 0.00 0.00 0.00 60.65 62.03 2a3w s ILE 198 Cb -0.14 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 2a3w s ILE 198 CO 0.04 0.14 -0.06 -0.54 0.00 0.00 0.00 174.94 174.52 2a3w s LYS 199 N 1.56 0.86 0.50 2.79 -0.14 -0.90 -4.97 119.74 119.43 2a3w s LYS 199 Ca 0.34 -1.35 -0.23 0.00 -1.36 0.00 0.00 55.97 53.37 2a3w s LYS 199 Cb -0.17 -0.23 -0.07 0.00 -1.68 0.00 0.00 37.83 35.68 2a3w s LYS 199 CO 0.14 -0.02 1.32 -2.30 -0.76 0.00 0.00 175.35 173.73 2a3w n PRO 200 N -0.06 1.81 -2.48 -1.68 -0.02 -1.26 -0.41 135.00 130.90 2a3w n PRO 200 Ca -0.12 0.66 -0.43 0.00 -2.02 0.00 0.00 63.50 61.59 2a3w n PRO 200 Cb 0.61 -2.51 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 2a3w n PRO 200 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2a3w s LEU 201 N -2.70 3.92 0.00 2.45 2.96 -0.27 -4.63 118.68 120.40 2a3w s LEU 201 Ca 0.67 1.20 0.03 0.00 -0.22 0.00 0.00 54.13 55.81 2a3w s LEU 201 Cb -0.45 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 42.70 2a3w s LEU 201 CO 0.53 -1.00 0.36 1.33 -1.32 0.00 0.00 176.35 176.25 2a3w n VAL 202 N 6.04 0.00 -0.20 1.68 0.24 -1.26 -4.66 118.33 120.17 2a3w n VAL 202 Ca 0.14 -0.47 0.09 0.00 -2.04 0.00 0.00 64.34 62.06 2a3w n VAL 202 Cb 0.47 1.03 0.23 0.00 -1.47 0.00 0.00 33.84 34.10 2a3w n VAL 202 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 2a3w n TRP 203 N -0.45 0.68 0.72 6.34 4.27 -1.26 -5.28 117.44 122.46 2a3w n TRP 203 Ca 0.01 -0.46 0.09 0.00 -3.89 0.00 0.00 57.50 53.25 2a3w n TRP 203 Cb 0.06 -0.01 0.07 0.00 -1.36 0.00 0.00 31.31 30.07 2a3w n TRP 203 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68