#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cgw s ILE 3 N 0.00 1.67 -0.25 1.39 1.09 -0.18 -1.02 121.20 123.91 3cgw s ILE 3 Ca 0.00 -0.75 -0.28 0.00 -1.10 0.00 0.00 60.65 58.52 3cgw s ILE 3 Cb 0.00 -1.58 0.01 0.00 -1.06 0.00 0.00 42.46 39.83 3cgw s ILE 3 CO 0.00 0.42 1.01 -0.36 -0.10 0.00 0.00 174.94 175.92 3cgw s PHE 4 N 1.44 3.31 0.20 3.97 0.40 0.96 0.10 117.98 128.36 3cgw s PHE 4 Ca 0.04 1.38 0.04 0.00 -0.60 0.00 0.00 56.93 57.79 3cgw s PHE 4 Cb -0.13 -3.30 -0.05 0.00 0.51 0.00 0.00 43.02 40.05 3cgw s PHE 4 CO -0.11 -0.51 -0.04 0.45 0.70 0.00 0.00 175.22 175.71 3cgw s SER 5 N 1.29 1.85 0.00 1.36 0.15 -0.37 -1.95 113.70 116.03 3cgw s SER 5 Ca 0.43 -1.14 0.00 0.00 0.70 0.00 0.00 55.95 55.94 3cgw s SER 5 Cb -0.15 -0.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 3cgw s SER 5 CO 0.08 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.69 3cgw n GLY 6 N -0.34 -1.59 7.00 9.45 0.00 -1.26 -2.59 105.19 115.86 3cgw n GLY 6 Ca -0.07 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3cgw n GLY 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cgw n GLY 7 N -0.21 2.31 0.00 -0.02 0.00 -1.26 -3.90 105.19 102.11 3cgw n GLY 7 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3cgw n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3cgw n THR 8 N 0.00 0.00 0.16 2.61 -1.04 -1.26 -4.78 114.28 109.97 3cgw n THR 8 Ca 0.00 -0.35 -0.07 0.00 -2.04 0.00 0.00 64.05 61.59 3cgw n THR 8 Cb 0.00 1.10 -0.03 0.00 -1.82 0.00 0.00 70.33 69.57 3cgw n THR 8 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 3cgw h GLY 9 N 0.00 -0.48 0.21 3.41 0.00 -1.68 -3.32 103.07 101.22 3cgw h GLY 9 Ca 0.00 0.18 0.05 0.00 0.00 0.00 0.00 47.33 47.56 3cgw h GLY 9 CO 0.00 -0.18 -0.26 -0.84 0.00 0.00 0.00 176.54 175.26 3cgw h THR 10 N -0.86 0.37 0.00 4.70 2.02 -1.71 -1.39 112.91 116.04 3cgw h THR 10 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3cgw h THR 10 Cb 0.35 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3cgw h THR 10 CO 0.08 0.00 0.17 1.55 0.37 0.00 0.00 175.52 177.69 3cgw h PRO 11 N -0.31 0.00 0.19 6.66 0.13 -1.79 0.39 132.00 137.26 3cgw h PRO 11 Ca 0.11 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.93 3cgw h PRO 11 Cb 0.48 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.63 3cgw h PRO 11 CO -0.34 0.00 -1.41 -0.22 -0.23 0.00 0.00 178.00 175.80 3cgw h LYS 12 N 0.00 0.40 0.00 0.86 3.64 -1.35 -2.81 116.57 117.31 3cgw h LYS 12 Ca 0.00 -0.69 -0.10 0.00 -1.27 0.00 0.00 60.65 58.59 3cgw h LYS 12 Cb 0.34 0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3cgw h LYS 12 CO 0.00 1.32 -0.49 1.25 -2.27 0.00 0.00 179.45 179.26 3cgw h LEU 13 N 0.11 0.00 0.17 5.20 5.85 -0.15 -3.16 115.31 123.33 3cgw h LEU 13 Ca -0.21 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 3cgw h LEU 13 Cb 2.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.11 3cgw h LEU 13 CO 0.23 0.49 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.67 3cgw h LEU 14 N 0.00 -0.19 -0.67 2.25 3.38 -0.62 -0.03 115.31 119.43 3cgw h LEU 14 Ca -0.00 -0.27 0.16 0.00 0.09 0.00 0.00 57.88 57.86 3cgw h LEU 14 Cb 1.07 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 3cgw h LEU 14 CO 0.06 0.18 1.09 -0.78 0.09 0.00 0.00 178.44 179.08 3cgw h ASP 15 N -0.59 0.00 0.00 -0.43 3.58 -1.45 1.56 116.42 119.08 3cgw h ASP 15 Ca -0.02 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.10 3cgw h ASP 15 Cb 0.45 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.43 3cgw h ASP 15 CO 0.04 0.00 -2.25 0.61 -2.88 0.00 0.00 179.24 174.76 3cgw n GLY 16 N -1.61 -0.69 0.31 -0.78 0.00 -0.99 -4.30 105.19 97.13 3cgw n GLY 16 Ca 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 3cgw n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3cgw h LEU 17 N 0.00 0.74 -1.84 0.99 6.46 0.40 -1.49 115.31 120.57 3cgw h LEU 17 Ca -0.49 -0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 57.15 3cgw h LEU 17 Cb 2.00 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 41.73 3cgw h LEU 17 CO -0.01 0.66 -0.12 0.07 -0.62 0.00 0.00 178.44 178.42 3cgw h LYS 18 N 0.80 0.00 -0.61 1.25 2.10 -0.80 -1.78 116.57 117.53 3cgw h LYS 18 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 3cgw h LYS 18 Cb 0.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 3cgw h LYS 18 CO -0.02 0.12 0.00 0.39 -2.00 0.00 0.00 179.45 177.94 3cgw n GLU 19 N -3.56 2.90 -0.00 0.07 -0.58 -0.57 -4.14 120.64 114.76 3cgw n GLU 19 Ca -0.01 -2.18 0.01 0.00 -0.42 0.00 0.00 57.16 54.55 3cgw n GLU 19 Cb 0.26 -1.67 -0.01 0.00 -0.57 0.00 0.00 31.44 29.45 3cgw n GLU 19 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 3cgw n ILE 20 N 0.94 0.00 -3.67 -3.67 0.13 -0.68 -5.07 119.36 107.34 3cgw n ILE 20 Ca 0.20 -0.09 -0.13 0.00 -1.10 0.00 0.00 62.75 61.64 3cgw n ILE 20 Cb 0.65 0.53 -0.06 0.00 -0.84 0.00 0.00 39.64 39.92 3cgw n ILE 20 CO 0.00 0.00 0.00 -1.48 2.80 0.00 0.00 176.55 177.87 3cgw s LEU 21 N -2.97 0.42 0.05 9.51 0.05 -1.17 -5.10 118.68 119.47 3cgw s LEU 21 Ca -0.00 -0.02 -0.36 0.00 0.05 0.00 0.00 54.13 53.79 3cgw s LEU 21 Cb 0.01 1.73 -0.15 0.00 -2.05 0.00 0.00 46.19 45.73 3cgw s LEU 21 CO 0.06 -0.67 1.53 -0.81 -0.55 0.00 0.00 176.35 175.91 3cgw n PRO 22 N 0.48 1.62 -0.29 1.48 -0.04 -1.26 -4.74 135.00 132.24 3cgw n PRO 22 Ca -0.18 0.59 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 3cgw n PRO 22 Cb 0.60 -2.30 0.28 0.00 -0.04 0.00 0.00 33.50 32.04 3cgw n PRO 22 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3cgw h GLU 23 N 5.89 0.23 -0.94 0.54 5.08 -1.89 -1.24 114.58 122.26 3cgw h GLU 23 Ca -0.47 -0.01 0.24 0.00 -1.00 0.00 0.00 59.36 58.12 3cgw h GLU 23 Cb 1.30 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 30.37 3cgw h GLU 23 CO 0.86 0.15 0.46 0.93 -1.00 0.00 0.00 179.01 180.41 3cgw h GLU 24 N 0.24 0.41 0.00 2.33 3.07 -1.89 0.24 114.58 118.97 3cgw h GLU 24 Ca 0.54 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 3cgw h GLU 24 Cb 1.06 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.88 3cgw h GLU 24 CO -0.62 0.27 0.00 0.39 -1.40 0.00 0.00 179.01 177.65 3cgw n GLU 25 N -5.02 0.20 -3.37 2.33 1.02 -0.47 -4.70 120.64 110.63 3cgw n GLU 25 Ca 0.25 0.10 -0.38 0.00 -0.02 0.00 0.00 57.16 57.11 3cgw n GLU 25 Cb 0.73 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.59 3cgw n GLU 25 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3cgw s LEU 26 N -2.72 4.28 -0.18 -4.62 1.43 0.84 -4.72 118.68 112.99 3cgw s LEU 26 Ca 0.17 0.77 -0.04 0.00 -1.03 0.00 0.00 54.13 54.00 3cgw s LEU 26 Cb 0.14 -2.63 0.08 0.00 0.03 0.00 0.00 46.19 43.81 3cgw s LEU 26 CO 0.35 0.04 0.19 0.28 0.23 0.00 0.00 176.35 177.44 3cgw s THR 27 N 0.48 -0.28 -0.17 5.49 -1.32 -1.26 -0.91 115.64 117.67 3cgw s THR 27 Ca 0.24 -0.06 -0.08 0.00 -1.21 0.00 0.00 61.69 60.58 3cgw s THR 27 Cb -0.15 -0.61 -0.04 0.00 -1.51 0.00 0.00 72.50 70.19 3cgw s THR 27 CO 0.09 -0.17 0.11 0.68 -2.21 0.00 0.00 174.62 173.12 3cgw s VAL 28 N 2.29 5.21 -0.38 5.08 -7.23 0.00 -1.01 120.40 124.37 3cgw s VAL 28 Ca 0.05 0.11 -0.14 0.00 -1.81 0.00 0.00 61.98 60.19 3cgw s VAL 28 Cb -0.15 -3.34 0.01 0.00 0.56 0.00 0.00 36.38 33.45 3cgw s VAL 28 CO -0.11 0.49 0.29 -0.69 -0.31 0.00 0.00 175.10 174.77 3cgw s VAL 29 N -0.01 5.26 0.07 1.32 1.01 0.11 -1.64 120.40 126.53 3cgw s VAL 29 Ca 0.08 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 3cgw s VAL 29 Cb -0.12 -3.85 -0.06 0.00 0.00 0.00 0.00 36.38 32.35 3cgw s VAL 29 CO 0.00 -0.20 0.46 -0.69 0.00 0.00 0.00 175.10 174.67 3cgw s VAL 30 N 1.72 4.97 0.23 2.92 1.01 0.10 -1.24 120.40 130.11 3cgw s VAL 30 Ca 0.06 0.78 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 3cgw s VAL 30 Cb -0.18 -3.72 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 3cgw s VAL 30 CO 0.10 0.42 1.17 0.21 0.00 0.00 0.00 175.10 177.01 3cgw s ASN 31 N -1.42 7.12 0.00 3.32 2.47 -1.07 -4.42 114.94 120.95 3cgw s ASN 31 Ca 0.30 2.29 0.06 0.00 0.42 0.00 0.00 52.86 55.94 3cgw s ASN 31 Cb -0.16 -2.62 0.07 0.00 -1.45 0.00 0.00 41.25 37.10 3cgw s ASN 31 CO 0.17 -0.31 0.78 0.35 -3.72 0.00 0.00 177.10 174.37 3cgw n THR 32 N 1.88 0.19 1.12 -5.21 -2.24 -1.26 -4.56 114.28 104.20 3cgw n THR 32 Ca 0.02 -0.59 0.02 0.00 -2.27 0.00 0.00 64.05 61.22 3cgw n THR 32 Cb 0.44 1.01 0.10 0.00 -2.10 0.00 0.00 70.33 69.79 3cgw n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cgw n ALA 33 N 0.30 2.08 0.21 6.98 0.00 -1.23 -1.82 120.51 127.03 3cgw n ALA 33 Ca 0.04 -0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.49 3cgw n ALA 33 Cb 0.19 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 3cgw n ALA 33 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3cgw n GLU 34 N -0.60 4.18 -1.32 0.00 -0.58 -1.26 -1.81 120.64 119.26 3cgw n GLU 34 Ca 0.03 -0.01 -0.35 0.00 -0.42 0.00 0.00 57.16 56.40 3cgw n GLU 34 Cb 0.01 -0.84 0.09 0.00 -0.57 0.00 0.00 31.44 30.14 3cgw n GLU 34 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3cgw n ASP 35 N -1.24 0.62 -3.64 1.62 8.00 -0.76 -4.73 116.55 116.42 3cgw n ASP 35 Ca 0.01 0.65 -0.07 0.00 0.71 0.00 0.00 54.79 56.09 3cgw n ASP 35 Cb 0.10 -1.43 -0.07 0.00 -0.02 0.00 0.00 41.12 39.70 3cgw n ASP 35 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3cgw s LEU 36 N -3.60 -0.66 -0.42 0.64 2.96 -0.97 -4.93 118.68 111.70 3cgw s LEU 36 Ca 0.73 1.12 -0.29 0.00 -0.22 0.00 0.00 54.13 55.48 3cgw s LEU 36 Cb -0.33 2.06 0.02 0.00 0.50 0.00 0.00 46.19 48.44 3cgw s LEU 36 CO 0.50 -0.18 1.19 0.26 -1.32 0.00 0.00 176.35 176.80 3cgw s TRP 37 N 1.07 2.78 -0.04 5.38 0.52 -1.26 -1.60 118.94 125.79 3cgw s TRP 37 Ca -0.06 0.80 0.05 0.00 0.02 0.00 0.00 56.10 56.91 3cgw s TRP 37 Cb -0.05 -4.25 -0.02 0.00 -1.15 0.00 0.00 33.47 28.00 3cgw s TRP 37 CO -0.13 -1.37 -0.19 0.08 0.02 0.00 0.00 176.95 175.37 3cgw s VAL 38 N 4.50 2.65 -0.52 4.03 1.01 -0.34 -4.67 120.40 127.07 3cgw s VAL 38 Ca 0.51 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.61 3cgw s VAL 38 Cb -0.10 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.28 3cgw s VAL 38 CO 0.29 0.58 0.00 -1.20 0.00 0.00 0.00 175.10 174.77 3cgw n SER 39 N 2.44 -1.85 0.00 3.32 7.64 -1.26 0.17 113.62 124.09 3cgw n SER 39 Ca -0.17 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.96 3cgw n SER 39 Cb 0.52 -1.82 0.00 0.00 -1.01 0.00 0.00 64.21 61.90 3cgw n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cgw n GLY 40 N -0.37 0.84 3.12 0.23 0.00 -1.26 -5.07 105.19 102.67 3cgw n GLY 40 Ca -0.06 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 3cgw n GLY 40 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cgw s ASN 41 N -2.12 -0.32 0.04 1.61 -0.87 0.13 -5.05 114.94 108.37 3cgw s ASN 41 Ca 0.00 0.60 -0.30 0.00 -1.57 0.00 0.00 52.86 51.59 3cgw s ASN 41 Cb 0.00 0.52 -0.07 0.00 -0.02 0.00 0.00 41.25 41.67 3cgw s ASN 41 CO 0.00 -0.15 1.60 -0.22 -2.57 0.00 0.00 177.10 175.75 3cgw s LEU 42 N 1.01 4.35 -0.27 0.60 2.96 -1.26 -1.20 118.68 124.88 3cgw s LEU 42 Ca -0.07 2.38 -0.05 0.00 -0.22 0.00 0.00 54.13 56.17 3cgw s LEU 42 Cb -0.08 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.06 3cgw s LEU 42 CO -0.07 -0.85 0.03 -0.63 -1.32 0.00 0.00 176.35 173.51 3cgw s ILE 43 N 2.71 3.69 -0.85 6.68 1.01 -0.62 -4.71 121.20 129.10 3cgw s ILE 43 Ca 0.72 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 60.60 3cgw s ILE 43 Cb -0.37 -2.84 0.22 0.00 0.01 0.00 0.00 42.46 39.48 3cgw s ILE 43 CO 0.31 0.19 0.77 -0.44 0.00 0.00 0.00 174.94 175.76 3cgw s SER 44 N 1.47 6.47 0.20 3.58 0.01 -1.26 -2.29 113.70 121.89 3cgw s SER 44 Ca 0.03 -3.01 -0.13 0.00 1.31 0.00 0.00 55.95 54.15 3cgw s SER 44 Cb -0.16 -2.10 0.24 0.00 0.21 0.00 0.00 66.02 64.21 3cgw s SER 44 CO 0.00 -0.43 1.65 1.55 0.41 0.00 0.00 173.24 176.42 3cgw h PRO 45 N 7.22 0.06 -0.24 12.44 0.13 -1.93 -0.00 132.00 149.67 3cgw h PRO 45 Ca 0.10 -0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.13 3cgw h PRO 45 Cb 0.97 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 3cgw h PRO 45 CO 0.80 0.04 -0.24 -0.44 -0.23 0.00 0.00 178.00 177.93 3cgw h ASP 46 N 0.06 0.62 -0.28 1.44 3.32 -1.91 -2.29 116.42 117.38 3cgw h ASP 46 Ca 0.29 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.87 3cgw h ASP 46 Cb 0.47 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3cgw h ASP 46 CO -0.55 0.97 0.19 0.25 -1.72 0.00 0.00 179.24 178.38 3cgw h LEU 47 N 0.28 0.33 -1.37 1.55 5.85 -1.69 -2.64 115.31 117.62 3cgw h LEU 47 Ca 0.04 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3cgw h LEU 47 Cb 0.80 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3cgw h LEU 47 CO 0.06 0.24 0.03 0.44 -0.34 0.00 0.00 178.44 178.87 3cgw h ASP 48 N 0.38 0.42 -0.01 1.25 3.45 -1.02 -0.94 116.42 119.95 3cgw h ASP 48 Ca 0.10 -0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 3cgw h ASP 48 Cb -0.04 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 38.62 3cgw h ASP 48 CO -0.02 0.46 0.00 0.74 -1.57 0.00 0.00 179.24 178.85 3cgw h THR 49 N 0.45 1.12 -0.13 0.35 2.02 -1.07 0.58 112.91 116.23 3cgw h THR 49 Ca 0.10 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 3cgw h THR 49 Cb 0.24 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 3cgw h THR 49 CO 0.00 0.10 0.07 0.58 0.37 0.00 0.00 175.52 176.64 3cgw h VAL 50 N -0.14 1.09 -0.19 3.16 2.07 -1.16 -0.52 116.25 120.57 3cgw h VAL 50 Ca 0.00 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.32 3cgw h VAL 50 Cb 0.15 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 3cgw h VAL 50 CO -0.00 0.09 -0.31 -0.07 0.02 0.00 0.00 177.57 177.30 3cgw h LEU 51 N 0.12 -0.97 -2.80 2.57 4.07 -1.06 0.45 115.31 117.69 3cgw h LEU 51 Ca 0.05 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3cgw h LEU 51 Cb 0.07 0.42 0.00 0.00 1.08 0.00 0.00 40.66 42.24 3cgw h LEU 51 CO -0.01 -0.34 0.00 1.88 -1.08 0.00 0.00 178.44 178.89 3cgw h TYR 52 N -0.35 0.00 0.00 1.13 0.99 -0.52 -2.44 116.97 115.78 3cgw h TYR 52 Ca 0.11 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.84 3cgw h TYR 52 Cb 0.53 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.26 3cgw h TYR 52 CO -0.42 0.00 0.00 -0.11 -0.00 0.00 0.00 178.16 177.63 3cgw n LEU 53 N -3.06 0.34 0.00 3.88 0.00 0.07 -0.13 117.00 118.09 3cgw n LEU 53 Ca -0.03 0.56 0.00 0.00 0.00 0.00 0.00 56.01 56.55 3cgw n LEU 53 Cb 0.09 -0.42 0.00 0.00 0.00 0.00 0.00 43.42 43.09 3cgw n LEU 53 CO 0.21 -0.42 0.23 0.49 0.00 0.00 0.00 177.39 177.89 3cgw n PHE 54 N -1.76 0.00 -1.08 1.96 3.01 -0.69 -0.76 117.46 118.14 3cgw n PHE 54 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 3cgw n PHE 54 Cb 0.00 0.00 0.22 0.00 -0.01 0.00 0.00 39.48 39.69 3cgw n PHE 54 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3cgw n SER 55 N -0.95 3.23 -4.40 4.37 7.64 -0.93 -4.73 113.62 117.86 3cgw n SER 55 Ca 0.00 -3.14 -0.40 0.00 1.01 0.00 0.00 58.87 56.34 3cgw n SER 55 Cb 0.00 -0.52 -0.08 0.00 -1.01 0.00 0.00 64.21 62.60 3cgw n SER 55 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3cgw n ASP 56 N -0.87 -1.54 -0.21 6.43 8.00 0.06 -4.75 116.55 123.67 3cgw n ASP 56 Ca 0.21 -1.20 0.01 0.00 0.71 0.00 0.00 54.79 54.53 3cgw n ASP 56 Cb 0.83 -1.53 0.02 0.00 -0.02 0.00 0.00 41.12 40.42 3cgw n ASP 56 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cgw n GLN 57 N -3.94 0.49 -2.73 -1.24 10.64 -0.58 -5.05 117.38 114.96 3cgw n GLN 57 Ca 0.08 -1.08 -0.41 0.00 -1.83 0.00 0.00 57.00 53.76 3cgw n GLN 57 Cb 0.45 -0.68 -0.05 0.00 -0.86 0.00 0.00 30.24 29.10 3cgw n GLN 57 CO 0.00 0.00 0.00 -1.50 -1.83 0.00 0.00 177.06 173.73 3cgw s ILE 58 N -0.48 4.46 -0.66 -0.39 1.10 0.82 -2.47 121.20 123.58 3cgw s ILE 58 Ca 0.04 2.07 -0.26 0.00 -0.51 0.00 0.00 60.65 61.99 3cgw s ILE 58 Cb 0.04 -4.32 -0.03 0.00 0.15 0.00 0.00 42.46 38.29 3cgw s ILE 58 CO 0.00 0.33 1.91 -0.62 -2.11 0.00 0.00 174.94 174.45 3cgw s ASP 59 N -0.10 5.20 0.00 4.50 -1.08 -0.90 -4.27 116.67 120.01 3cgw s ASP 59 Ca 0.46 0.18 0.16 0.00 -0.52 0.00 0.00 52.55 52.83 3cgw s ASP 59 Cb -0.24 -2.53 0.93 0.00 -1.46 0.00 0.00 42.92 39.62 3cgw s ASP 59 CO 0.30 -2.48 1.35 0.54 0.52 0.00 0.00 175.17 175.40 3cgw n ARG 60 N 9.12 0.56 -0.03 4.34 1.74 -1.26 -0.59 116.66 130.53 3cgw n ARG 60 Ca 0.25 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 57.12 3cgw n ARG 60 Cb 0.51 -1.44 -0.13 0.00 -1.02 0.00 0.00 32.46 30.38 3cgw n ARG 60 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3cgw h LYS 61 N 0.00 0.16 -0.19 5.56 6.56 -1.95 -3.39 116.57 123.32 3cgw h LYS 61 Ca 0.00 -0.27 0.00 0.00 -1.06 0.00 0.00 60.65 59.32 3cgw h LYS 61 Cb 0.00 0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.76 3cgw h LYS 61 CO 0.00 1.13 0.00 0.54 -2.06 0.00 0.00 179.45 179.06 3cgw n ARG 62 N -4.07 2.41 -4.09 3.15 1.74 -1.15 -5.01 116.66 109.63 3cgw n ARG 62 Ca -0.27 -1.70 -0.31 0.00 -0.77 0.00 0.00 57.85 54.80 3cgw n ARG 62 Cb 0.82 -1.17 -0.08 0.00 -1.02 0.00 0.00 32.46 31.01 3cgw n ARG 62 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3cgw n TRP 63 N 0.22 -1.05 -3.64 -1.55 7.02 0.24 -4.89 117.44 113.78 3cgw n TRP 63 Ca 0.07 0.55 -0.08 0.00 -1.02 0.00 0.00 57.50 57.03 3cgw n TRP 63 Cb 0.33 -2.11 -0.07 0.00 -2.42 0.00 0.00 31.31 27.05 3cgw n TRP 63 CO 0.00 0.00 0.00 1.67 -2.02 0.00 0.00 177.69 177.34 3cgw s TRP 64 N -3.72 -0.36 0.00 -5.99 1.48 -1.24 -4.98 118.94 104.12 3cgw s TRP 64 Ca 0.27 0.87 0.00 0.00 -1.06 0.00 0.00 56.10 56.18 3cgw s TRP 64 Cb -0.16 0.40 0.00 0.00 -1.16 0.00 0.00 33.47 32.55 3cgw s TRP 64 CO 0.87 -0.19 0.00 0.41 -4.06 0.00 0.00 176.95 173.99 3cgw n GLY 65 N 1.94 -1.92 3.29 3.67 0.00 -1.26 -4.51 105.19 106.40 3cgw n GLY 65 Ca -0.12 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 3cgw n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgw s ILE 66 N 0.00 2.68 0.46 -0.61 1.01 -1.26 -2.13 121.20 121.35 3cgw s ILE 66 Ca 0.00 -0.78 -0.21 0.00 0.00 0.00 0.00 60.65 59.66 3cgw s ILE 66 Cb 0.00 -2.11 -0.12 0.00 0.01 0.00 0.00 42.46 40.24 3cgw s ILE 66 CO 0.00 0.52 0.51 1.21 0.00 0.00 0.00 174.94 177.18 3cgw n GLU 67 N 3.82 0.54 -1.28 2.79 2.13 -1.03 -1.27 120.64 126.33 3cgw n GLU 67 Ca -0.19 0.20 -0.09 0.00 0.66 0.00 0.00 57.16 57.74 3cgw n GLU 67 Cb 0.52 -1.53 -0.04 0.00 0.27 0.00 0.00 31.44 30.66 3cgw n GLU 67 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3cgw n ASN 68 N 1.17 -2.49 -4.69 4.31 3.02 -1.26 -4.91 115.26 110.41 3cgw n ASN 68 Ca 0.11 0.23 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 3cgw n ASN 68 Cb 0.42 -2.47 0.15 0.00 -0.61 0.00 0.00 39.78 37.27 3cgw n ASN 68 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3cgw s ASP 69 N -1.80 3.26 0.26 6.41 -1.08 -0.40 -5.05 116.67 118.27 3cgw s ASP 69 Ca 0.00 1.74 0.10 0.00 -0.52 0.00 0.00 52.55 53.86 3cgw s ASP 69 Cb 0.00 -2.36 -0.04 0.00 -1.46 0.00 0.00 42.92 39.05 3cgw s ASP 69 CO 0.00 -2.81 -0.03 -0.89 0.52 0.00 0.00 175.17 171.96 3cgw s THR 70 N -2.80 3.34 -0.23 1.71 2.01 -1.26 -4.98 115.64 113.43 3cgw s THR 70 Ca 0.64 -1.94 0.17 0.00 0.31 0.00 0.00 61.69 60.87 3cgw s THR 70 Cb -0.20 -2.77 0.47 0.00 0.01 0.00 0.00 72.50 70.01 3cgw s THR 70 CO 0.58 -0.36 1.16 0.49 -0.69 0.00 0.00 174.62 175.79 3cgw n PHE 71 N -0.80 1.41 -0.24 4.92 3.01 -1.26 0.04 117.46 124.52 3cgw n PHE 71 Ca -0.07 -1.86 0.10 0.00 1.01 0.00 0.00 57.45 56.64 3cgw n PHE 71 Cb 0.59 -0.25 0.37 0.00 -0.01 0.00 0.00 39.48 40.17 3cgw n PHE 71 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3cgw h GLY 72 N 2.07 1.12 1.79 1.37 0.00 -1.97 -0.71 103.07 106.74 3cgw h GLY 72 Ca 0.02 -0.30 -0.15 0.00 0.00 0.00 0.00 47.33 46.90 3cgw h GLY 72 CO 0.33 0.14 -0.64 -0.84 0.00 0.00 0.00 176.54 175.53 3cgw h THR 73 N 0.71 1.40 0.23 4.70 2.02 -1.90 -3.06 112.91 117.02 3cgw h THR 73 Ca 0.41 -2.07 -0.01 0.00 0.77 0.00 0.00 66.41 65.51 3cgw h THR 73 Cb 0.58 2.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 3cgw h THR 73 CO -0.17 0.61 -0.11 0.22 0.37 0.00 0.00 175.52 176.43 3cgw h TYR 74 N 0.15 -0.29 -1.43 3.16 3.20 -1.56 -3.24 116.97 116.96 3cgw h TYR 74 Ca -0.01 -0.01 0.46 0.00 3.14 0.00 0.00 58.73 62.31 3cgw h TYR 74 Cb 1.15 0.10 -0.12 0.00 1.54 0.00 0.00 36.73 39.40 3cgw h TYR 74 CO 0.02 -0.18 0.95 0.93 -1.64 0.00 0.00 178.16 178.24 3cgw h GLU 75 N -0.55 0.06 -0.07 1.82 5.08 -1.27 -2.33 114.58 117.32 3cgw h GLU 75 Ca -0.03 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3cgw h GLU 75 Cb 0.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3cgw h GLU 75 CO 0.05 0.04 0.00 -2.13 -1.00 0.00 0.00 179.01 175.97 3cgw n ARG 76 N -4.54 0.00 0.00 2.33 3.00 -1.16 -0.80 116.66 115.49 3cgw n ARG 76 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.23 3cgw n ARG 76 Cb 1.53 -0.90 0.00 0.00 0.00 0.00 0.00 32.46 33.09 3cgw n ARG 76 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 3cgw n LYS 78 N 0.41 0.00 -0.34 -0.14 4.81 -0.88 -1.55 118.16 120.46 3cgw n LYS 78 Ca 0.00 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.60 3cgw n LYS 78 Cb 0.00 0.00 0.32 0.00 0.02 0.00 0.00 35.03 35.37 3cgw n LYS 78 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3cgw n GLU 79 N 0.00 -0.08 0.00 1.64 1.02 0.02 0.44 120.64 123.68 3cgw n GLU 79 Ca 0.00 1.48 0.15 0.00 -0.02 0.00 0.00 57.16 58.77 3cgw n GLU 79 Cb 0.00 -2.38 0.85 0.00 -0.02 0.00 0.00 31.44 29.88 3cgw n GLU 79 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3cgw n LEU 80 N -5.48 0.00 -3.52 -4.62 4.77 -0.60 -4.89 117.00 102.66 3cgw n LEU 80 Ca 0.25 0.10 -0.23 0.00 -0.03 0.00 0.00 56.01 56.10 3cgw n LEU 80 Cb 0.82 -0.10 0.08 0.00 -2.33 0.00 0.00 43.42 41.88 3cgw n LEU 80 CO -0.07 -0.00 0.23 0.61 -1.33 0.00 0.00 177.39 176.83 3cgw n GLY 81 N 1.01 -0.50 3.13 -0.72 0.00 1.50 -4.96 105.19 104.65 3cgw n GLY 81 Ca 0.20 0.22 -0.37 0.00 0.00 0.00 0.00 46.02 46.07 3cgw n GLY 81 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgw s ILE 82 N -3.32 3.54 -0.51 -0.61 -1.09 -1.26 -4.97 121.20 112.99 3cgw s ILE 82 Ca 0.51 -2.28 -0.27 0.00 -2.23 0.00 0.00 60.65 56.38 3cgw s ILE 82 Cb -0.22 -3.38 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 3cgw s ILE 82 CO 0.72 -0.76 1.91 -0.70 -1.23 0.00 0.00 174.94 174.88 3cgw s GLU 83 N 0.82 2.79 0.43 2.79 -6.30 -1.26 -4.23 118.70 113.74 3cgw s GLU 83 Ca 0.10 0.97 0.09 0.00 -2.50 0.00 0.00 54.97 53.63 3cgw s GLU 83 Cb -0.22 -4.35 0.92 0.00 0.00 0.00 0.00 34.13 30.48 3cgw s GLU 83 CO -0.04 -2.52 2.07 1.49 0.02 0.00 0.00 175.26 176.29 3cgw h GLU 84 N 14.86 0.45 0.00 4.30 4.81 -1.96 -3.46 114.58 133.58 3cgw h GLU 84 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 3cgw h GLU 84 Cb 1.18 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3cgw h GLU 84 CO 1.15 0.30 0.00 0.41 -0.73 0.00 0.00 179.01 180.14 3cgw n GLY 85 N -1.47 1.03 3.62 1.92 0.00 -1.26 -4.96 105.19 104.07 3cgw n GLY 85 Ca 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 3cgw n GLY 85 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3cgw s LEU 86 N 0.00 -0.20 -1.04 0.99 0.20 -1.26 -5.08 118.68 112.29 3cgw s LEU 86 Ca 0.00 0.24 -0.14 0.00 0.69 0.00 0.00 54.13 54.92 3cgw s LEU 86 Cb 0.00 1.44 0.19 0.00 -0.43 0.00 0.00 46.19 47.39 3cgw s LEU 86 CO 0.00 -0.16 1.17 -0.75 -0.29 0.00 0.00 176.35 176.32 3cgw s LYS 87 N -0.88 3.88 0.05 1.98 2.20 -1.26 -5.02 119.74 120.70 3cgw s LYS 87 Ca 0.04 -2.43 -0.30 0.00 -0.36 0.00 0.00 55.97 52.92 3cgw s LYS 87 Cb -0.01 -4.82 -0.05 0.00 -1.51 0.00 0.00 37.83 31.44 3cgw s LYS 87 CO -0.05 -1.59 1.05 -0.51 -0.36 0.00 0.00 175.35 173.89 3cgw s LEU 88 N 1.15 4.40 0.26 5.43 1.43 -1.26 -5.03 118.68 125.05 3cgw s LEU 88 Ca 0.33 1.82 -0.28 0.00 -1.03 0.00 0.00 54.13 54.97 3cgw s LEU 88 Cb -0.06 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.49 3cgw s LEU 88 CO -0.06 -0.29 0.93 -0.83 0.23 0.00 0.00 176.35 176.33 3cgw s GLY 89 N 0.77 3.01 0.17 -3.19 0.00 -1.26 -4.60 107.32 102.22 3cgw s GLY 89 Ca 0.53 0.57 -0.15 0.00 0.00 0.00 0.00 44.72 45.67 3cgw s GLY 89 CO 0.29 1.10 1.68 -0.55 0.00 0.00 0.00 173.10 175.63 3cgw h ASP 90 N 3.87 -0.23 -0.08 1.64 3.32 -0.75 1.15 116.42 125.34 3cgw h ASP 90 Ca -0.46 0.11 -0.10 0.00 0.02 0.00 0.00 57.03 56.60 3cgw h ASP 90 Cb 1.20 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.94 3cgw h ASP 90 CO 0.67 -0.08 -0.26 0.03 -1.72 0.00 0.00 179.24 177.88 3cgw h ARG 91 N 0.08 0.53 0.00 3.56 3.08 -1.93 -1.77 114.38 117.93 3cgw h ARG 91 Ca 0.22 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3cgw h ARG 91 Cb 0.32 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3cgw h ARG 91 CO -0.38 0.75 0.00 0.22 -1.07 0.00 0.00 179.97 179.48 3cgw h ASP 92 N 0.46 0.00 0.36 7.04 3.58 -1.37 -3.12 116.42 123.37 3cgw h ASP 92 Ca 0.07 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.19 3cgw h ASP 92 Cb 0.70 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.78 3cgw h ASP 92 CO 0.05 0.00 -1.46 -0.09 -2.88 0.00 0.00 179.24 174.86 3cgw h ARG 93 N 0.00 0.45 -1.00 0.28 2.43 0.22 -3.27 114.38 113.48 3cgw h ARG 93 Ca 0.00 -0.76 0.26 0.00 -0.81 0.00 0.00 59.98 58.67 3cgw h ARG 93 Cb 0.63 0.28 -0.13 0.00 -0.42 0.00 0.00 29.97 30.33 3cgw h ARG 93 CO 0.00 1.36 0.58 0.00 -1.51 0.00 0.00 179.97 180.40 3cgw h ALA 94 N 0.27 1.81 0.11 2.80 0.00 -1.42 0.86 119.26 123.69 3cgw h ALA 94 Ca -0.24 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3cgw h ALA 94 Cb 2.11 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.96 3cgw h ALA 94 CO 0.24 -0.35 -0.05 1.15 0.00 0.00 0.00 179.25 180.24 3cgw h THR 95 N 0.51 0.91 -0.95 0.00 2.02 -1.63 0.23 112.91 114.00 3cgw h THR 95 Ca 0.66 -0.06 0.06 0.00 0.77 0.00 0.00 66.41 67.85 3cgw h THR 95 Cb 1.33 0.95 -0.06 0.00 -1.74 0.00 0.00 68.15 68.63 3cgw h THR 95 CO -0.51 0.01 0.61 0.45 0.37 0.00 0.00 175.52 176.46 3cgw h HIS 96 N -0.17 1.11 -0.03 3.16 -0.00 0.48 -1.09 115.15 118.61 3cgw h HIS 96 Ca -0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 3cgw h HIS 96 Cb 0.13 -0.37 -0.00 0.00 -0.00 0.00 0.00 27.41 27.18 3cgw h HIS 96 CO -0.06 0.58 0.00 0.82 -0.00 0.00 0.00 177.93 179.27 3cgw h ILE 97 N 1.10 1.23 0.57 2.45 1.08 0.08 -2.11 117.51 121.91 3cgw h ILE 97 Ca 0.41 -0.70 -0.03 0.00 -0.39 0.00 0.00 64.86 64.15 3cgw h ILE 97 Cb 0.18 1.65 0.00 0.00 -3.07 0.00 0.00 36.82 35.58 3cgw h ILE 97 CO -0.15 0.19 -0.29 0.40 -0.69 0.00 0.00 178.15 177.60 3cgw h ILE 98 N -0.22 0.00 -0.55 -0.67 2.04 -0.03 -0.17 117.51 117.91 3cgw h ILE 98 Ca 0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.03 3cgw h ILE 98 Cb 0.30 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 3cgw h ILE 98 CO 0.00 0.00 0.47 0.08 0.00 0.00 0.00 178.15 178.70 3cgw h ARG 99 N -0.79 0.00 -0.03 2.37 0.11 -1.32 -0.58 114.38 114.14 3cgw h ARG 99 Ca -0.08 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.81 3cgw h ARG 99 Cb 0.61 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.71 3cgw h ARG 99 CO 0.12 0.00 -0.74 0.77 0.10 0.00 0.00 179.97 180.22 3cgw h SER 100 N 0.00 0.70 -0.72 0.08 0.02 -1.05 -2.78 113.55 109.80 3cgw h SER 100 Ca 0.26 -0.73 0.04 0.00 -0.84 0.00 0.00 61.79 60.52 3cgw h SER 100 Cb 1.21 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 63.49 3cgw h SER 100 CO -0.00 1.33 0.45 0.78 -1.14 0.00 0.00 176.83 178.24 3cgw h ASN 101 N 0.13 0.72 0.01 3.07 2.35 0.55 0.64 115.58 123.06 3cgw h ASN 101 Ca -0.09 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.69 3cgw h ASN 101 Cb 1.42 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.62 3cgw h ASN 101 CO 0.15 0.49 -0.13 0.40 -1.65 0.00 0.00 177.43 176.70 3cgw h ILE 102 N 0.86 0.69 -0.45 2.81 1.08 -1.43 -2.34 117.51 118.74 3cgw h ILE 102 Ca 0.30 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.74 3cgw h ILE 102 Cb 0.06 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.48 3cgw h ILE 102 CO -0.13 0.00 0.17 0.40 -0.69 0.00 0.00 178.15 177.91 3cgw h ILE 103 N -0.22 1.21 -0.02 -0.67 2.04 -1.05 -1.86 117.51 116.94 3cgw h ILE 103 Ca 0.04 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.26 3cgw h ILE 103 Cb 0.27 0.80 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3cgw h ILE 103 CO -0.12 0.24 0.04 0.03 0.00 0.00 0.00 178.15 178.34 3cgw h ARG 104 N 0.58 0.00 -1.99 2.37 3.08 0.35 -2.78 114.38 115.99 3cgw h ARG 104 Ca 0.15 0.00 -0.76 0.00 0.07 0.00 0.00 59.98 59.44 3cgw h ARG 104 Cb 0.21 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 29.99 3cgw h ARG 104 CO -0.01 0.00 1.04 -0.25 -1.07 0.00 0.00 179.97 179.68 3cgw n ASP 105 N -3.55 7.50 0.00 7.04 9.92 -0.72 -4.87 116.55 131.87 3cgw n ASP 105 Ca -0.02 -3.82 0.00 0.00 -0.53 0.00 0.00 54.79 50.42 3cgw n ASP 105 Cb 0.12 -1.08 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 3cgw n ASP 105 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3cgw n GLY 106 N -0.49 0.12 3.81 0.44 0.00 -1.05 -4.96 105.19 103.06 3cgw n GLY 106 Ca 0.54 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.26 3cgw n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cgw s ALA 107 N -1.24 1.61 0.35 4.61 0.00 -1.08 -5.02 121.76 121.00 3cgw s ALA 107 Ca 0.00 -1.14 0.08 0.00 0.00 0.00 0.00 51.96 50.91 3cgw s ALA 107 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 3cgw s ALA 107 CO 0.00 -2.90 0.14 0.45 0.00 0.00 0.00 175.76 173.44 3cgw s SER 108 N -4.54 4.62 0.11 0.00 0.15 -1.26 -4.56 113.70 108.21 3cgw s SER 108 Ca 0.73 -0.82 -0.20 0.00 0.70 0.00 0.00 55.95 56.37 3cgw s SER 108 Cb -0.06 -0.69 -0.08 0.00 -1.71 0.00 0.00 66.02 63.49 3cgw s SER 108 CO 0.54 -0.32 1.70 0.25 1.20 0.00 0.00 173.24 176.62 3cgw h LEU 109 N 1.55 0.24 -1.74 3.45 5.85 -1.91 -2.16 115.31 120.59 3cgw h LEU 109 Ca -0.43 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.23 3cgw h LEU 109 Cb 1.25 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 3cgw h LEU 109 CO 0.64 0.26 0.24 0.74 -0.34 0.00 0.00 178.44 179.97 3cgw h THR 110 N 0.20 1.00 0.72 1.05 2.02 -1.95 0.87 112.91 116.83 3cgw h THR 110 Ca 0.07 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 3cgw h THR 110 Cb 0.07 0.64 0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3cgw h THR 110 CO -0.01 0.06 -0.35 0.44 0.37 0.00 0.00 175.52 176.03 3cgw h ASP 111 N 0.34 -0.82 -0.98 4.18 3.45 -1.82 -2.94 116.42 117.83 3cgw h ASP 111 Ca 0.15 0.00 0.11 0.00 0.43 0.00 0.00 57.03 57.72 3cgw h ASP 111 Cb 0.17 0.21 -0.08 0.00 -0.56 0.00 0.00 39.33 39.07 3cgw h ASP 111 CO -0.03 -0.50 0.61 0.77 -1.57 0.00 0.00 179.24 178.52 3cgw h SER 112 N -1.12 0.91 -0.27 6.45 4.64 -0.86 -0.13 113.55 123.17 3cgw h SER 112 Ca -0.10 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.32 3cgw h SER 112 Cb 0.77 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 3cgw h SER 112 CO 0.16 0.49 0.18 0.74 -0.87 0.00 0.00 176.83 177.54 3cgw h THR 113 N 0.99 0.94 0.03 2.95 2.02 -0.78 -0.30 112.91 118.76 3cgw h THR 113 Ca 0.48 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.61 3cgw h THR 113 Cb 0.45 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3cgw h THR 113 CO -0.26 0.03 -0.02 0.58 0.37 0.00 0.00 175.52 176.22 3cgw h VAL 114 N 0.14 1.08 -0.82 3.16 2.07 -0.86 -2.54 116.25 118.47 3cgw h VAL 114 Ca 0.12 -1.68 0.16 0.00 0.82 0.00 0.00 66.70 66.12 3cgw h VAL 114 Cb 0.30 1.98 -0.10 0.00 -1.52 0.00 0.00 31.29 31.95 3cgw h VAL 114 CO -0.02 0.35 0.37 0.50 0.02 0.00 0.00 177.57 178.79 3cgw h LYS 115 N -0.96 0.47 0.05 1.57 1.63 -1.19 0.21 116.57 118.36 3cgw h LYS 115 Ca -0.00 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 3cgw h LYS 115 Cb 0.60 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 3cgw h LYS 115 CO 0.01 0.31 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.23 3cgw h LEU 116 N 0.49 -0.06 -1.95 5.20 3.38 -1.14 -1.47 115.31 119.76 3cgw h LEU 116 Ca 0.47 -0.03 0.23 0.00 0.09 0.00 0.00 57.88 58.64 3cgw h LEU 116 Cb 0.75 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 3cgw h LEU 116 CO -0.43 -0.00 0.64 0.28 0.09 0.00 0.00 178.44 179.03 3cgw h SER 117 N -0.11 0.00 0.03 -0.43 0.02 -0.21 0.13 113.55 112.98 3cgw h SER 117 Ca -0.01 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.80 3cgw h SER 117 Cb 0.09 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.64 3cgw h SER 117 CO 0.01 0.00 -0.57 0.28 -1.14 0.00 0.00 176.83 175.41 3cgw h SER 118 N 0.00 0.45 0.01 3.07 0.02 -0.13 0.51 113.55 117.49 3cgw h SER 118 Ca 0.38 -0.82 -0.05 0.00 -0.84 0.00 0.00 61.79 60.47 3cgw h SER 118 Cb 1.66 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 3cgw h SER 118 CO -0.00 1.21 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.71 3cgw h LEU 119 N -0.26 0.22 0.00 5.07 3.38 -0.22 -2.16 115.31 121.33 3cgw h LEU 119 Ca -0.08 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3cgw h LEU 119 Cb 1.33 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3cgw h LEU 119 CO 0.11 0.37 -0.52 -0.26 0.09 0.00 0.00 178.44 178.23 3cgw h PHE 120 N 0.22 0.00 -0.61 1.13 0.05 -0.82 -3.48 116.94 113.44 3cgw h PHE 120 Ca 0.05 0.00 -0.13 0.00 3.82 0.00 0.00 57.97 61.70 3cgw h PHE 120 Cb 0.36 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 38.27 3cgw h PHE 120 CO 0.01 0.00 -0.14 0.41 -0.18 0.00 0.00 178.31 178.40 3cgw n GLY 121 N 1.31 0.52 3.72 -1.45 0.00 0.41 -4.86 105.19 104.84 3cgw n GLY 121 Ca 0.03 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 3cgw n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgw s ILE 122 N -2.29 3.76 -1.51 -0.61 1.01 0.15 -4.89 121.20 116.82 3cgw s ILE 122 Ca 0.00 1.31 0.19 0.00 0.00 0.00 0.00 60.65 62.14 3cgw s ILE 122 Cb 0.00 -3.84 0.56 0.00 0.01 0.00 0.00 42.46 39.20 3cgw s ILE 122 CO 0.00 0.13 1.47 0.29 0.00 0.00 0.00 174.94 176.83 3cgw n LYS 123 N 3.58 2.92 -4.10 2.79 5.02 -1.26 -4.72 118.16 122.39 3cgw n LYS 123 Ca 0.08 -2.54 -0.23 0.00 -2.02 0.00 0.00 58.31 53.61 3cgw n LYS 123 Cb 0.45 -1.54 -0.04 0.00 -0.02 0.00 0.00 35.03 33.87 3cgw n LYS 123 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cgw s ALA 124 N -1.17 3.61 -0.73 7.82 0.00 -1.26 -3.66 121.76 126.37 3cgw s ALA 124 Ca 0.42 -1.36 -0.20 0.00 0.00 0.00 0.00 51.96 50.82 3cgw s ALA 124 Cb 0.23 -1.35 0.10 0.00 0.00 0.00 0.00 23.12 22.10 3cgw s ALA 124 CO 0.27 0.30 0.94 1.21 0.00 0.00 0.00 175.76 178.48 3cgw s ASN 125 N -3.71 6.33 -0.42 0.00 3.04 -0.09 -4.99 114.94 115.10 3cgw s ASN 125 Ca 0.33 -1.47 -0.12 0.00 0.04 0.00 0.00 52.86 51.63 3cgw s ASN 125 Cb -0.08 -2.38 0.05 0.00 -1.54 0.00 0.00 41.25 37.30 3cgw s ASN 125 CO 0.25 -1.22 0.28 -0.63 -3.04 0.00 0.00 177.10 172.74 3cgw s ILE 126 N 3.18 4.70 -0.03 -5.21 1.01 -1.26 -0.82 121.20 122.76 3cgw s ILE 126 Ca 0.22 -1.05 0.04 0.00 0.00 0.00 0.00 60.65 59.86 3cgw s ILE 126 Cb -0.15 -3.75 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 3cgw s ILE 126 CO 0.03 -0.41 -0.14 -0.76 0.00 0.00 0.00 174.94 173.66 3cgw s LEU 127 N 1.55 1.89 0.00 2.97 1.43 -0.65 -4.77 118.68 121.11 3cgw s LEU 127 Ca 0.03 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 3cgw s LEU 127 Cb -0.22 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.21 3cgw s LEU 127 CO 0.06 0.13 0.00 -0.81 0.23 0.00 0.00 176.35 175.96 3cgw n PRO 128 N 3.11 0.00 -0.55 1.29 -0.04 -1.26 -0.73 135.00 136.82 3cgw n PRO 128 Ca -0.17 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.99 3cgw n PRO 128 Cb 0.54 0.00 0.22 0.00 -0.04 0.00 0.00 33.50 34.22 3cgw n PRO 128 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3cgw n SER 130 N 0.00 -1.19 -0.01 3.54 2.88 -1.26 -4.66 113.62 112.93 3cgw n SER 130 Ca 0.00 0.03 0.10 0.00 -1.33 0.00 0.00 58.87 57.67 3cgw n SER 130 Cb 0.00 -1.30 -0.14 0.00 -0.75 0.00 0.00 64.21 62.02 3cgw n SER 130 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3cgw n ASP 131 N -4.44 0.56 -4.80 -3.46 10.43 -1.26 -4.79 116.55 108.79 3cgw n ASP 131 Ca 0.06 -0.47 -0.39 0.00 2.57 0.00 0.00 54.79 56.56 3cgw n ASP 131 Cb 0.54 1.50 -0.06 0.00 1.84 0.00 0.00 41.12 44.94 3cgw n ASP 131 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3cgw s ASP 132 N -3.71 7.20 0.48 -2.24 1.01 -1.26 -4.75 116.67 113.40 3cgw s ASP 132 Ca -0.00 1.43 -0.24 0.00 0.71 0.00 0.00 52.55 54.45 3cgw s ASP 132 Cb 0.14 -2.42 -0.07 0.00 1.01 0.00 0.00 42.92 41.59 3cgw s ASP 132 CO 0.86 0.25 1.35 -2.16 0.21 0.00 0.00 175.17 175.67 3cgw s PRO 133 N -1.12 3.55 -0.29 8.23 0.04 -1.26 -4.91 135.00 139.24 3cgw s PRO 133 Ca 0.32 2.22 -0.08 0.00 0.04 0.00 0.00 61.00 63.51 3cgw s PRO 133 Cb -0.21 -2.50 0.14 0.00 0.04 0.00 0.00 34.50 31.97 3cgw s PRO 133 CO 0.22 -0.86 0.60 0.08 0.04 0.00 0.00 177.00 177.08 3cgw s VAL 134 N -1.29 -0.94 -0.06 -0.36 1.01 -1.26 -4.59 120.40 112.91 3cgw s VAL 134 Ca 0.64 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.69 3cgw s VAL 134 Cb -0.40 -0.95 -0.00 0.00 0.00 0.00 0.00 36.38 35.03 3cgw s VAL 134 CO 0.49 0.01 -0.20 -0.94 0.00 0.00 0.00 175.10 174.46 3cgw s SER 135 N 2.84 2.51 -0.65 3.32 1.04 -0.99 -3.53 113.70 118.25 3cgw s SER 135 Ca 0.00 -0.43 -0.26 0.00 0.48 0.00 0.00 55.95 55.74 3cgw s SER 135 Cb -0.13 -0.85 0.04 0.00 0.10 0.00 0.00 66.02 65.18 3cgw s SER 135 CO -0.18 0.16 1.15 -0.89 0.98 0.00 0.00 173.24 174.45 3cgw s THR 136 N 0.14 4.02 0.09 2.02 2.01 -0.75 -2.74 115.64 120.43 3cgw s THR 136 Ca -0.08 0.42 0.01 0.00 0.31 0.00 0.00 61.69 62.34 3cgw s THR 136 Cb -0.14 -4.76 -0.04 0.00 0.01 0.00 0.00 72.50 67.57 3cgw s THR 136 CO 0.04 -1.51 0.23 -0.31 -0.69 0.00 0.00 174.62 172.38 3cgw s TYR 137 N 4.93 3.51 -0.18 4.92 2.02 -0.63 -2.20 117.35 129.72 3cgw s TYR 137 Ca 0.35 0.21 -0.01 0.00 -0.37 0.00 0.00 57.07 57.24 3cgw s TYR 137 Cb -0.10 -1.73 0.00 0.00 -0.40 0.00 0.00 41.96 39.73 3cgw s TYR 137 CO 0.18 0.57 -0.13 0.42 -1.57 0.00 0.00 175.55 175.02 3cgw s ILE 138 N -1.59 2.77 -0.22 2.71 -1.09 -1.26 -1.11 121.20 121.41 3cgw s ILE 138 Ca 0.35 -0.71 -0.15 0.00 -2.23 0.00 0.00 60.65 57.90 3cgw s ILE 138 Cb -0.12 -2.20 -0.04 0.00 -1.58 0.00 0.00 42.46 38.51 3cgw s ILE 138 CO 0.28 0.49 0.38 -1.61 -1.23 0.00 0.00 174.94 173.25 3cgw s GLU 139 N 1.11 4.13 0.13 2.79 2.02 -0.30 -4.33 118.70 124.24 3cgw s GLU 139 Ca 0.00 0.13 0.01 0.00 0.02 0.00 0.00 54.97 55.14 3cgw s GLU 139 Cb -0.14 -3.56 -0.00 0.00 0.10 0.00 0.00 34.13 30.52 3cgw s GLU 139 CO -0.04 -0.08 0.14 0.25 0.02 0.00 0.00 175.26 175.55 3cgw n THR 140 N 4.49 0.00 -0.00 3.63 -2.24 -1.21 -1.46 114.28 117.47 3cgw n THR 140 Ca -0.09 -0.79 -0.18 0.00 -2.27 0.00 0.00 64.05 60.73 3cgw n THR 140 Cb 0.51 0.43 -0.09 0.00 -2.10 0.00 0.00 70.33 69.08 3cgw n THR 140 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cgw h ALA 141 N 1.52 0.20 0.00 6.98 0.00 -1.87 -3.17 119.26 122.91 3cgw h ALA 141 Ca -0.09 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3cgw h ALA 141 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3cgw h ALA 141 CO 0.13 0.57 0.00 0.39 0.00 0.00 0.00 179.25 180.34 3cgw n GLU 142 N -4.02 0.70 0.00 0.00 1.02 -1.26 -4.94 120.64 112.14 3cgw n GLU 142 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 3cgw n GLU 142 Cb 0.74 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 3cgw n GLU 142 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cgw n GLY 143 N 0.15 0.72 3.93 0.62 0.00 -1.20 -5.15 105.19 104.26 3cgw n GLY 143 Ca 0.00 -1.88 -0.28 0.00 0.00 0.00 0.00 46.02 43.86 3cgw n GLY 143 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgw s ILE 144 N -2.13 5.24 0.50 -0.61 1.09 -1.26 -3.36 121.20 120.67 3cgw s ILE 144 Ca 0.00 -0.39 -0.22 0.00 -1.10 0.00 0.00 60.65 58.94 3cgw s ILE 144 Cb 0.00 -3.71 -0.06 0.00 -1.06 0.00 0.00 42.46 37.62 3cgw s ILE 144 CO 0.00 -0.10 1.17 -2.28 -0.10 0.00 0.00 174.94 173.63 3cgw s HIS 146 N -1.79 2.74 0.41 3.97 2.46 -1.26 -5.00 115.29 116.83 3cgw s HIS 146 Ca 0.38 1.52 0.08 0.00 0.47 0.00 0.00 55.06 57.51 3cgw s HIS 146 Cb -0.11 -3.39 0.89 0.00 -0.13 0.00 0.00 32.58 29.84 3cgw s HIS 146 CO 0.28 -1.68 2.04 0.35 -2.47 0.00 0.00 174.74 173.27 3cgw h PHE 147 N 1.69 0.50 -0.71 3.88 3.57 -1.79 -2.07 116.94 122.00 3cgw h PHE 147 Ca -0.50 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.10 3cgw h PHE 147 Cb 1.26 -0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.76 3cgw h PHE 147 CO 0.52 0.30 0.37 1.96 -2.23 0.00 0.00 178.31 179.23 3cgw h GLN 148 N 0.53 0.63 -0.24 1.11 1.08 -1.91 -2.46 115.11 113.85 3cgw h GLN 148 Ca 0.18 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.28 3cgw h GLN 148 Cb 0.06 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 3cgw h GLN 148 CO -0.04 0.42 -0.08 -0.44 -0.95 0.00 0.00 178.83 177.73 3cgw h ASP 149 N 0.65 0.48 -0.34 1.46 3.45 -1.57 0.22 116.42 120.76 3cgw h ASP 149 Ca 0.34 -0.38 0.06 0.00 0.43 0.00 0.00 57.03 57.48 3cgw h ASP 149 Cb 0.32 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 38.91 3cgw h ASP 149 CO -0.24 0.76 0.03 0.15 -1.57 0.00 0.00 179.24 178.36 3cgw h PHE 150 N 0.21 0.04 0.00 4.55 3.04 -1.17 -0.77 116.94 122.84 3cgw h PHE 150 Ca 0.06 0.02 -0.22 0.00 3.98 0.00 0.00 57.97 61.81 3cgw h PHE 150 Cb 0.56 0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.07 3cgw h PHE 150 CO 0.06 -0.03 -1.71 1.87 -2.02 0.00 0.00 178.31 176.48 3cgw n TRP 151 N -5.14 0.00 -1.57 0.41 -0.00 -0.97 -1.64 117.44 108.53 3cgw n TRP 151 Ca 0.01 0.00 -0.38 0.00 -0.00 0.00 0.00 57.50 57.14 3cgw n TRP 151 Cb 0.17 -0.72 -0.03 0.00 -0.00 0.00 0.00 31.31 30.73 3cgw n TRP 151 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 3cgw n ILE 152 N -4.34 4.58 0.00 5.87 5.41 0.06 -2.22 119.36 128.72 3cgw n ILE 152 Ca -0.33 -3.22 0.00 0.00 1.00 0.00 0.00 62.75 60.20 3cgw n ILE 152 Cb 0.68 -2.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.28 3cgw n ILE 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3cgw n GLY 153 N 2.69 -0.65 1.45 7.39 0.00 -1.09 -4.32 105.19 110.67 3cgw n GLY 153 Ca 0.70 0.10 0.01 0.00 0.00 0.00 0.00 46.02 46.83 3cgw n GLY 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cgw n LYS 154 N 0.00 3.25 -1.02 1.61 4.01 -0.31 -4.92 118.16 120.78 3cgw n LYS 154 Ca 0.00 -3.03 -0.07 0.00 -0.51 0.00 0.00 58.31 54.71 3cgw n LYS 154 Cb 0.00 -2.03 -0.03 0.00 -0.51 0.00 0.00 35.03 32.47 3cgw n LYS 154 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 3cgw n ARG 155 N -0.37 -1.51 -3.15 1.97 3.00 -0.94 -1.55 116.66 114.11 3cgw n ARG 155 Ca 0.31 0.49 -0.10 0.00 -0.00 0.00 0.00 57.85 58.56 3cgw n ARG 155 Cb 1.14 -4.44 0.04 0.00 0.00 0.00 0.00 32.46 29.20 3cgw n ARG 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3cgw n GLY 156 N 0.06 -1.16 0.03 5.14 0.00 -0.65 -4.95 105.19 103.65 3cgw n GLY 156 Ca -0.07 0.53 -0.04 0.00 0.00 0.00 0.00 46.02 46.45 3cgw n GLY 156 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cgw n GLU 157 N -2.70 0.68 -0.74 1.61 1.02 -0.59 -5.03 120.64 114.90 3cgw n GLU 157 Ca -0.04 0.03 -0.28 0.00 -0.02 0.00 0.00 57.16 56.84 3cgw n GLU 157 Cb 0.58 -1.11 0.11 0.00 -0.02 0.00 0.00 31.44 30.99 3cgw n GLU 157 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 3cgw n PRO 158 N -2.58 -1.14 0.00 3.49 -0.02 -1.26 -5.03 135.00 128.46 3cgw n PRO 158 Ca -0.10 -0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.05 3cgw n PRO 158 Cb 0.61 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 3cgw n PRO 158 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3cgw n ASP 159 N 0.44 0.00 -0.97 2.55 8.00 -1.26 -5.11 116.55 120.20 3cgw n ASP 159 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 3cgw n ASP 159 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3cgw n ASP 159 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3cgw n VAL 160 N 0.00 0.00 0.00 2.53 0.24 -1.26 -4.80 118.33 115.04 3cgw n VAL 160 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3cgw n VAL 160 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3cgw n VAL 160 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3cgw n ARG 161 N 0.00 0.00 0.00 7.34 0.63 -0.54 -4.08 116.66 120.01 3cgw n ARG 161 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3cgw n ARG 161 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 3cgw n ARG 161 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3cgw n GLY 162 N 0.00 4.71 3.71 5.14 0.00 -1.16 -4.93 105.19 112.66 3cgw n GLY 162 Ca 0.00 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 3cgw n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cgw s VAL 163 N -0.85 5.07 -0.37 1.61 0.11 -1.26 -1.15 120.40 123.55 3cgw s VAL 163 Ca 0.00 0.06 -0.03 0.00 -2.93 0.00 0.00 61.98 59.08 3cgw s VAL 163 Cb 0.00 -3.27 0.08 0.00 -1.53 0.00 0.00 36.38 31.66 3cgw s VAL 163 CO 0.00 0.49 0.14 -0.62 -3.33 0.00 0.00 175.10 171.78 3cgw s ASP 164 N 0.06 5.18 -1.55 3.54 2.15 -0.27 -4.97 116.67 120.80 3cgw s ASP 164 Ca 0.07 -1.67 -0.12 0.00 0.43 0.00 0.00 52.55 51.26 3cgw s ASP 164 Cb -0.12 -1.81 -0.03 0.00 -0.30 0.00 0.00 42.92 40.66 3cgw s ASP 164 CO 0.00 -0.44 2.64 0.00 -0.17 0.00 0.00 175.17 177.21 3cgw n ILE 165 N 4.65 3.97 -1.61 4.11 0.13 -1.26 -1.61 119.36 127.74 3cgw n ILE 165 Ca -0.07 -2.80 -0.45 0.00 -1.10 0.00 0.00 62.75 58.33 3cgw n ILE 165 Cb 0.42 -2.61 -0.02 0.00 -0.84 0.00 0.00 39.64 36.60 3cgw n ILE 165 CO 0.00 0.00 0.00 -1.14 2.80 0.00 0.00 176.55 178.21 3cgw n ARG 166 N 4.62 1.48 0.00 9.51 0.63 -1.11 -2.56 116.66 129.24 3cgw n ARG 166 Ca 0.67 0.52 0.00 0.00 -0.92 0.00 0.00 57.85 58.12 3cgw n ARG 166 Cb 0.30 -1.98 0.00 0.00 0.45 0.00 0.00 32.46 31.23 3cgw n ARG 166 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3cgw n GLY 167 N 1.48 2.98 0.33 5.14 0.00 -1.26 -2.35 105.19 111.50 3cgw n GLY 167 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.15 3cgw n GLY 167 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3cgw h VAL 168 N 0.00 1.14 -0.54 1.61 3.04 -1.74 -1.16 116.25 118.59 3cgw h VAL 168 Ca 0.00 -0.26 0.03 0.00 -1.01 0.00 0.00 66.70 65.46 3cgw h VAL 168 Cb 0.00 0.31 -0.04 0.00 -2.01 0.00 0.00 31.29 29.55 3cgw h VAL 168 CO 0.00 0.14 0.31 0.28 -1.01 0.00 0.00 177.57 177.29 3cgw h SER 169 N 0.76 0.48 0.90 3.17 0.02 -1.89 -2.52 113.55 114.47 3cgw h SER 169 Ca 0.21 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3cgw h SER 169 Cb -0.07 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.38 3cgw h SER 169 CO -0.05 0.34 -0.32 -0.62 -1.14 0.00 0.00 176.83 175.04 3cgw n GLU 170 N -4.81 0.13 -2.09 3.45 4.71 -0.93 -4.77 120.64 116.33 3cgw n GLU 170 Ca 0.05 0.06 -0.39 0.00 -0.01 0.00 0.00 57.16 56.86 3cgw n GLU 170 Cb 0.10 -1.60 -0.01 0.00 -1.01 0.00 0.00 31.44 28.92 3cgw n GLU 170 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3cgw s ALA 171 N -3.06 3.28 -0.15 0.62 0.00 -0.48 -5.03 121.76 116.93 3cgw s ALA 171 Ca 0.10 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3cgw s ALA 171 Cb 0.16 -3.47 -0.00 0.00 0.00 0.00 0.00 23.12 19.80 3cgw s ALA 171 CO 0.64 -0.77 -0.16 -1.12 0.00 0.00 0.00 175.76 174.36 3cgw s SER 172 N -0.74 3.65 -0.10 0.00 0.01 -1.26 -4.43 113.70 110.84 3cgw s SER 172 Ca 0.56 -0.47 -0.38 0.00 1.31 0.00 0.00 55.95 56.97 3cgw s SER 172 Cb -0.38 -1.56 -0.15 0.00 0.21 0.00 0.00 66.02 64.14 3cgw s SER 172 CO 0.48 0.09 1.60 -0.38 0.41 0.00 0.00 173.24 175.45 3cgw n ILE 173 N 4.00 0.21 -1.42 1.44 5.41 -1.26 -4.26 119.36 123.48 3cgw n ILE 173 Ca -0.19 -0.04 -0.49 0.00 1.00 0.00 0.00 62.75 63.03 3cgw n ILE 173 Cb 0.52 -1.18 -0.04 0.00 -0.71 0.00 0.00 39.64 38.24 3cgw n ILE 173 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3cgw n SER 174 N 4.36 -1.02 -0.26 4.38 2.88 -1.26 -4.77 113.62 117.92 3cgw n SER 174 Ca 0.22 1.13 -0.07 0.00 -1.33 0.00 0.00 58.87 58.83 3cgw n SER 174 Cb 0.18 -0.96 0.05 0.00 -0.75 0.00 0.00 64.21 62.74 3cgw n SER 174 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3cgw h PRO 175 N 1.29 1.15 0.00 -1.46 0.11 -1.96 -2.47 132.00 128.66 3cgw h PRO 175 Ca -0.31 -0.26 -0.04 0.00 0.11 0.00 0.00 66.00 65.50 3cgw h PRO 175 Cb 1.44 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 3cgw h PRO 175 CO 0.58 0.99 -0.19 0.87 -0.21 0.00 0.00 178.00 180.04 3cgw h LYS 176 N 1.09 0.00 -0.00 1.05 1.57 -1.97 0.50 116.57 118.81 3cgw h LYS 176 Ca 0.23 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3cgw h LYS 176 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3cgw h LYS 176 CO -0.00 0.19 -0.00 0.28 -0.57 0.00 0.00 179.45 179.34 3cgw h VAL 177 N 0.00 1.60 -0.72 0.50 2.07 -1.84 -2.64 116.25 115.22 3cgw h VAL 177 Ca -0.00 -1.76 0.04 0.00 0.82 0.00 0.00 66.70 65.80 3cgw h VAL 177 Cb 0.48 2.79 -0.05 0.00 -1.52 0.00 0.00 31.29 32.99 3cgw h VAL 177 CO 0.02 0.46 0.44 -0.07 0.02 0.00 0.00 177.57 178.44 3cgw h LEU 178 N -0.74 0.70 -0.28 2.57 3.38 -1.14 0.62 115.31 120.41 3cgw h LEU 178 Ca -0.00 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.04 3cgw h LEU 178 Cb 0.75 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 3cgw h LEU 178 CO 0.00 0.47 -0.07 -0.33 0.09 0.00 0.00 178.44 178.60 3cgw h GLU 179 N 0.83 0.00 0.00 1.13 5.08 -0.93 -1.76 114.58 118.94 3cgw h GLU 179 Ca 0.30 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.52 3cgw h GLU 179 Cb 0.09 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3cgw h GLU 179 CO -0.14 0.00 -0.67 0.00 -1.00 0.00 0.00 179.01 177.21 3cgw h ALA 180 N 1.28 0.82 0.00 3.43 0.00 -1.07 -3.13 119.26 120.59 3cgw h ALA 180 Ca 0.13 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3cgw h ALA 180 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3cgw h ALA 180 CO -0.29 0.83 0.00 0.34 0.00 0.00 0.00 179.25 180.14 3cgw n PHE 181 N -3.63 0.00 -0.00 0.00 7.35 0.21 -3.44 117.46 117.95 3cgw n PHE 181 Ca -0.01 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 3cgw n PHE 181 Cb 0.68 -0.05 -0.00 0.00 0.35 0.00 0.00 39.48 40.46 3cgw n PHE 181 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3cgw n GLU 182 N 0.22 0.03 -0.24 -4.13 1.02 -1.18 -4.72 120.64 111.63 3cgw n GLU 182 Ca 0.00 0.01 0.19 0.00 -0.02 0.00 0.00 57.16 57.35 3cgw n GLU 182 Cb 0.12 -0.34 0.51 0.00 -0.02 0.00 0.00 31.44 31.72 3cgw n GLU 182 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3cgw h LYS 183 N -0.06 0.39 -7.45 3.49 1.57 -1.76 -3.42 116.57 109.34 3cgw h LYS 183 Ca 0.00 -0.02 -0.41 0.00 -1.87 0.00 0.00 60.65 58.35 3cgw h LYS 183 Cb 0.06 -0.09 0.19 0.00 0.08 0.00 0.00 32.23 32.47 3cgw h LYS 183 CO 0.00 0.26 0.15 -1.21 -0.57 0.00 0.00 179.45 178.08 3cgw s GLU 184 N -5.42 -1.30 0.00 3.15 0.41 -1.22 -5.01 118.70 109.31 3cgw s GLU 184 Ca -0.08 -0.19 0.00 0.00 -0.41 0.00 0.00 54.97 54.28 3cgw s GLU 184 Cb 0.23 -1.60 0.00 0.00 -1.78 0.00 0.00 34.13 30.98 3cgw s GLU 184 CO 0.78 -3.74 0.00 -0.85 -0.49 0.00 0.00 175.26 170.97 3cgw n GLU 185 N -4.75 0.00 -3.44 1.61 0.00 -1.26 -5.03 120.64 107.76 3cgw n GLU 185 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.87 3cgw n GLU 185 Cb 0.60 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.98 3cgw n GLU 185 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 3cgw s ASN 186 N 0.00 6.02 -0.13 -1.84 0.01 -1.26 -0.29 114.94 117.45 3cgw s ASN 186 Ca 0.00 -2.08 -0.11 0.00 -0.71 0.00 0.00 52.86 49.96 3cgw s ASN 186 Cb 0.00 -2.10 -0.05 0.00 0.41 0.00 0.00 41.25 39.51 3cgw s ASN 186 CO 0.00 -0.71 0.22 -0.63 -1.51 0.00 0.00 177.10 174.48 3cgw s ILE 187 N 1.12 5.36 -0.07 0.60 -1.09 -0.18 -1.63 121.20 125.30 3cgw s ILE 187 Ca 0.08 0.40 0.01 0.00 -2.23 0.00 0.00 60.65 58.91 3cgw s ILE 187 Cb -0.24 -3.53 0.02 0.00 -1.58 0.00 0.00 42.46 37.12 3cgw s ILE 187 CO -0.01 0.51 -0.10 -0.22 -1.23 0.00 0.00 174.94 173.89 3cgw s LEU 188 N -0.28 1.48 -0.33 2.97 2.96 -0.19 0.22 118.68 125.50 3cgw s LEU 188 Ca 0.15 -0.27 -0.11 0.00 -0.22 0.00 0.00 54.13 53.68 3cgw s LEU 188 Cb -0.13 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.80 3cgw s LEU 188 CO 0.04 -0.02 0.20 -0.63 -1.32 0.00 0.00 176.35 174.62 3cgw s ILE 189 N 0.96 4.86 1.03 6.68 1.01 0.02 -0.03 121.20 135.74 3cgw s ILE 189 Ca -0.09 -0.41 -0.12 0.00 0.00 0.00 0.00 60.65 60.02 3cgw s ILE 189 Cb -0.15 -3.53 0.19 0.00 0.01 0.00 0.00 42.46 38.98 3cgw s ILE 189 CO 0.00 -0.01 0.94 0.61 0.00 0.00 0.00 174.94 176.48 3cgw n GLY 190 N 5.03 -1.31 3.56 6.18 0.00 -0.82 -2.35 105.19 115.49 3cgw n GLY 190 Ca -0.13 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 3cgw n GLY 190 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cgw s PRO 191 N -4.36 3.91 0.15 1.61 0.04 -1.23 -4.59 135.00 130.52 3cgw s PRO 191 Ca 0.66 -1.88 -0.03 0.00 0.04 0.00 0.00 61.00 59.78 3cgw s PRO 191 Cb -0.23 -5.44 -0.03 0.00 0.04 0.00 0.00 34.50 28.84 3cgw s PRO 191 CO 0.62 -2.19 0.13 -1.54 0.04 0.00 0.00 177.00 174.06 3cgw s SER 192 N 4.22 0.22 -0.47 6.66 1.04 -1.26 -3.76 113.70 120.35 3cgw s SER 192 Ca 0.51 -1.13 -0.28 0.00 0.48 0.00 0.00 55.95 55.53 3cgw s SER 192 Cb 0.02 0.34 -0.14 0.00 0.10 0.00 0.00 66.02 66.35 3cgw s SER 192 CO 0.03 -0.79 1.63 0.59 0.98 0.00 0.00 173.24 175.69 3cgw n ASN 193 N -0.14 0.41 0.25 7.02 3.02 -1.26 -4.75 115.26 119.82 3cgw n ASN 193 Ca -0.05 0.36 0.12 0.00 -0.03 0.00 0.00 54.58 54.97 3cgw n ASN 193 Cb 0.64 -0.63 0.67 0.00 -0.61 0.00 0.00 39.78 39.84 3cgw n ASN 193 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3cgw h PRO 194 N 7.02 0.00 0.00 3.52 0.13 -1.96 -1.49 132.00 139.22 3cgw h PRO 194 Ca -0.06 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.98 3cgw h PRO 194 Cb 0.97 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 3cgw h PRO 194 CO 0.84 0.14 -0.64 -0.84 -0.23 0.00 0.00 178.00 177.27 3cgw h ILE 195 N 0.00 0.63 0.00 -3.56 -2.65 -1.92 -0.92 117.51 109.10 3cgw h ILE 195 Ca -0.00 -1.66 -0.15 0.00 1.03 0.00 0.00 64.86 64.07 3cgw h ILE 195 Cb 0.41 1.38 -0.02 0.00 -2.05 0.00 0.00 36.82 36.54 3cgw h ILE 195 CO 0.02 0.21 -1.06 0.71 0.03 0.00 0.00 178.15 178.06 3cgw h THR 196 N -1.00 0.74 0.00 0.16 1.35 -1.96 -3.20 112.91 109.01 3cgw h THR 196 Ca -0.13 -2.22 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 3cgw h THR 196 Cb 0.82 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 3cgw h THR 196 CO -0.08 0.42 -0.23 -1.20 -0.25 0.00 0.00 175.52 174.18 3cgw n SER 197 N -3.05 0.53 -0.01 5.36 7.64 -0.60 -4.57 113.62 118.91 3cgw n SER 197 Ca -0.05 0.19 -0.17 0.00 1.01 0.00 0.00 58.87 59.85 3cgw n SER 197 Cb 0.82 -0.58 -0.10 0.00 -1.01 0.00 0.00 64.21 63.34 3cgw n SER 197 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3cgw h ILE 198 N -0.28 1.39 -0.54 0.44 1.08 -1.64 -3.36 117.51 114.60 3cgw h ILE 198 Ca 0.00 -1.93 0.05 0.00 -0.39 0.00 0.00 64.86 62.59 3cgw h ILE 198 Cb 0.23 2.36 -0.06 0.00 -3.07 0.00 0.00 36.82 36.27 3cgw h ILE 198 CO 0.00 0.57 -0.32 0.61 -0.69 0.00 0.00 178.15 178.32 3cgw n GLY 199 N 0.85 -2.35 0.28 5.37 0.00 -0.35 -0.12 105.19 108.88 3cgw n GLY 199 Ca -0.09 0.82 0.07 0.00 0.00 0.00 0.00 46.02 46.82 3cgw n GLY 199 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3cgw h PRO 200 N 0.00 0.15 0.26 1.61 0.11 -1.70 0.90 132.00 133.32 3cgw h PRO 200 Ca 0.09 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.19 3cgw h PRO 200 Cb 0.22 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.27 3cgw h PRO 200 CO -0.51 0.10 -0.30 0.82 -0.21 0.00 0.00 178.00 177.90 3cgw h ILE 201 N 0.15 0.36 0.00 4.15 2.04 -0.67 -2.58 117.51 120.96 3cgw h ILE 201 Ca 0.45 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.29 3cgw h ILE 201 Cb 0.82 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 3cgw h ILE 201 CO -0.64 0.00 -0.08 0.16 0.00 0.00 0.00 178.15 177.59 3cgw h ILE 202 N -0.60 0.26 0.00 -0.67 -0.00 -0.70 -2.76 117.51 113.03 3cgw h ILE 202 Ca -0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 64.86 64.23 3cgw h ILE 202 Cb 0.57 1.49 0.00 0.00 -0.00 0.00 0.00 36.82 38.88 3cgw h ILE 202 CO -0.09 0.08 0.00 0.28 -0.00 0.00 0.00 178.15 178.42 3cgw h SER 203 N 0.00 0.00 -3.30 2.16 0.02 -0.45 -3.28 113.55 108.71 3cgw h SER 203 Ca -0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.38 3cgw h SER 203 Cb 0.48 0.00 0.10 0.00 0.14 0.00 0.00 62.40 63.13 3cgw h SER 203 CO 0.01 0.00 0.58 0.18 -1.14 0.00 0.00 176.83 176.46 3cgw n LEU 204 N -2.90 3.70 -4.70 5.07 4.77 -1.05 -4.86 117.00 117.04 3cgw n LEU 204 Ca 0.02 1.20 -0.43 0.00 -0.03 0.00 0.00 56.01 56.77 3cgw n LEU 204 Cb 0.36 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 39.92 3cgw n LEU 204 CO 0.28 -0.36 1.38 -0.81 -1.33 0.00 0.00 177.39 176.56 3cgw n PRO 205 N 0.87 2.65 -1.00 3.23 -0.04 -1.26 -4.12 135.00 135.32 3cgw n PRO 205 Ca 0.06 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.47 3cgw n PRO 205 Cb 0.36 -2.81 0.00 0.00 -0.04 0.00 0.00 33.50 31.01 3cgw n PRO 205 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3cgw n GLY 206 N 3.98 1.04 1.41 0.55 0.00 -1.26 -4.71 105.19 106.20 3cgw n GLY 206 Ca 0.17 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3cgw n GLY 206 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3cgw n ARG 208 N -0.33 0.00 -0.08 1.61 0.63 -1.24 -1.59 116.66 115.67 3cgw n ARG 208 Ca 0.00 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.92 3cgw n ARG 208 Cb 0.21 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.37 3cgw n ARG 208 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3cgw h GLU 209 N 0.00 0.70 -0.01 -0.14 4.57 -1.92 -3.09 114.58 114.69 3cgw h GLU 209 Ca 0.00 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.05 3cgw h GLU 209 Cb 0.00 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.48 3cgw h GLU 209 CO 0.00 0.63 0.00 1.25 -1.18 0.00 0.00 179.01 179.71 3cgw h LEU 210 N 0.68 0.02 -2.58 1.64 5.85 -1.73 -2.97 115.31 116.23 3cgw h LEU 210 Ca 0.16 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3cgw h LEU 210 Cb 0.24 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 3cgw h LEU 210 CO -0.00 0.27 0.01 -0.07 -0.34 0.00 0.00 178.44 178.31 3cgw h LEU 211 N -0.24 0.00 -0.06 2.25 3.38 -1.84 0.58 115.31 119.39 3cgw h LEU 211 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3cgw h LEU 211 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3cgw h LEU 211 CO 0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 3cgw n LYS 212 N -3.67 0.02 -0.38 1.13 5.02 -1.12 -2.28 118.16 116.88 3cgw n LYS 212 Ca -0.03 0.21 0.08 0.00 -2.02 0.00 0.00 58.31 56.55 3cgw n LYS 212 Cb 0.09 -1.54 0.23 0.00 -0.02 0.00 0.00 35.03 33.79 3cgw n LYS 212 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3cgw n LYS 213 N -1.58 3.02 -4.28 1.97 5.02 0.20 -5.00 118.16 117.50 3cgw n LYS 213 Ca 0.04 -2.59 -0.17 0.00 -2.02 0.00 0.00 58.31 53.57 3cgw n LYS 213 Cb 0.21 -1.67 -0.09 0.00 -0.02 0.00 0.00 35.03 33.46 3cgw n LYS 213 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3cgw s LYS 214 N -2.17 1.50 -0.58 1.97 -0.14 -0.97 -5.06 119.74 114.30 3cgw s LYS 214 Ca 0.37 -1.84 -0.19 0.00 -1.36 0.00 0.00 55.97 52.95 3cgw s LYS 214 Cb 0.27 0.10 0.10 0.00 -1.68 0.00 0.00 37.83 36.63 3cgw s LYS 214 CO 0.12 -0.47 0.68 0.21 -0.76 0.00 0.00 175.35 175.13 3cgw s LYS 215 N -3.85 3.04 -0.21 1.68 2.20 0.61 -4.95 119.74 118.27 3cgw s LYS 215 Ca 0.38 -1.34 -0.12 0.00 -0.36 0.00 0.00 55.97 54.53 3cgw s LYS 215 Cb 0.05 -4.26 -0.05 0.00 -1.51 0.00 0.00 37.83 32.06 3cgw s LYS 215 CO 0.18 -1.51 0.21 0.08 -0.36 0.00 0.00 175.35 173.95 3cgw s VAL 216 N 2.58 5.34 -0.09 4.02 1.01 -1.25 -1.01 120.40 131.00 3cgw s VAL 216 Ca 0.11 0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.45 3cgw s VAL 216 Cb -0.25 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.59 3cgw s VAL 216 CO 0.06 0.37 -0.23 -0.69 0.00 0.00 0.00 175.10 174.62 3cgw s VAL 217 N 0.77 1.93 0.09 2.92 1.01 0.13 -0.94 120.40 126.31 3cgw s VAL 217 Ca 0.11 -0.95 0.06 0.00 0.00 0.00 0.00 61.98 61.20 3cgw s VAL 217 Cb -0.13 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 3cgw s VAL 217 CO 0.03 0.53 -0.17 0.00 0.00 0.00 0.00 175.10 175.49 3cgw s ALA 218 N 0.28 1.47 -0.21 5.51 0.00 -0.76 -0.80 121.76 127.25 3cgw s ALA 218 Ca -0.15 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 50.63 3cgw s ALA 218 Cb -0.17 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.80 3cgw s ALA 218 CO 0.07 0.23 -0.08 0.08 0.00 0.00 0.00 175.76 176.06 3cgw s VAL 219 N -1.39 3.09 -0.04 0.00 1.01 -0.99 -0.53 120.40 121.56 3cgw s VAL 219 Ca 0.03 -0.59 -0.37 0.00 0.00 0.00 0.00 61.98 61.05 3cgw s VAL 219 Cb -0.09 -2.39 -0.16 0.00 0.00 0.00 0.00 36.38 33.74 3cgw s VAL 219 CO 0.03 0.45 1.53 -0.24 0.00 0.00 0.00 175.10 176.87 3cgw n SER 220 N 4.74 2.12 -0.57 3.32 2.88 0.72 -3.54 113.62 123.29 3cgw n SER 220 Ca -0.19 1.09 0.07 0.00 -1.33 0.00 0.00 58.87 58.51 3cgw n SER 220 Cb 0.51 -1.20 0.21 0.00 -0.75 0.00 0.00 64.21 62.98 3cgw n SER 220 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3cgw n PRO 221 N 3.79 1.73 -4.06 -1.46 -0.04 -1.26 -4.79 135.00 128.91 3cgw n PRO 221 Ca 0.21 -1.12 -0.17 0.00 -0.04 0.00 0.00 63.50 62.37 3cgw n PRO 221 Cb 0.18 -1.29 -0.16 0.00 -0.04 0.00 0.00 33.50 32.20 3cgw n PRO 221 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3cgw s ILE 222 N -1.63 0.34 0.40 0.52 1.01 -1.26 -4.86 121.20 115.71 3cgw s ILE 222 Ca 0.25 -0.06 0.08 0.00 0.00 0.00 0.00 60.65 60.92 3cgw s ILE 222 Cb 0.13 -0.37 -0.01 0.00 0.01 0.00 0.00 42.46 42.22 3cgw s ILE 222 CO 0.18 0.16 0.46 -0.63 0.00 0.00 0.00 174.94 175.11 3cgw s ILE 223 N 0.67 3.12 0.00 2.92 1.01 -1.26 -4.58 121.20 123.08 3cgw s ILE 223 Ca -0.08 -1.16 0.00 0.00 0.00 0.00 0.00 60.65 59.42 3cgw s ILE 223 Cb -0.11 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.28 3cgw s ILE 223 CO -0.01 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.50 3cgw n GLY 224 N -1.66 -1.21 7.00 6.18 0.00 -1.26 -4.83 105.19 109.41 3cgw n GLY 224 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3cgw n GLY 224 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3cgw n ASN 225 N 0.00 0.00 -4.30 1.61 4.13 -1.26 -4.74 115.26 110.70 3cgw n ASN 225 Ca 0.00 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.97 3cgw n ASN 225 Cb 0.00 0.00 0.19 0.00 -1.54 0.00 0.00 39.78 38.43 3cgw n ASN 225 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3cgw s ALA 226 N -1.87 1.22 0.67 5.41 0.00 -1.26 -4.97 121.76 120.95 3cgw s ALA 226 Ca 0.00 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 51.03 3cgw s ALA 226 Cb 0.00 -2.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.06 3cgw s ALA 226 CO 0.00 -2.93 0.07 -2.30 0.00 0.00 0.00 175.76 170.60 3cgw n PRO 227 N -4.24 0.16 -0.26 0.00 -0.02 -1.26 -4.85 135.00 124.54 3cgw n PRO 227 Ca 0.10 0.07 0.07 0.00 -2.02 0.00 0.00 63.50 61.72 3cgw n PRO 227 Cb 0.59 -1.37 0.19 0.00 -0.02 0.00 0.00 33.50 32.89 3cgw n PRO 227 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3cgw h VAL 228 N -0.27 0.39 -1.00 -1.45 -1.51 -1.89 -3.44 116.25 107.07 3cgw h VAL 228 Ca -0.44 -0.06 -0.41 0.00 -1.23 0.00 0.00 66.70 64.56 3cgw h VAL 228 Cb 1.38 0.20 -0.16 0.00 -2.13 0.00 0.00 31.29 30.58 3cgw h VAL 228 CO 0.40 0.03 -0.37 -0.24 -1.23 0.00 0.00 177.57 176.16 3cgw n SER 229 N -5.26 -5.40 -4.81 4.19 2.88 -1.26 -4.94 113.62 99.01 3cgw n SER 229 Ca 0.15 0.50 -0.25 0.00 -1.33 0.00 0.00 58.87 57.94 3cgw n SER 229 Cb 0.52 -4.74 -0.05 0.00 -0.75 0.00 0.00 64.21 59.19 3cgw n SER 229 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3cgw s GLY 230 N -2.72 2.36 0.04 0.46 0.00 -1.26 -5.01 107.32 101.19 3cgw s GLY 230 Ca 0.00 -1.70 0.12 0.00 0.00 0.00 0.00 44.72 43.14 3cgw s GLY 230 CO 0.00 -1.90 1.38 -1.55 0.00 0.00 0.00 173.10 171.03 3cgw n PRO 231 N -1.45 0.02 0.00 2.90 -0.04 -1.26 -1.62 135.00 133.56 3cgw n PRO 231 Ca -0.02 0.34 0.11 0.00 -0.04 0.00 0.00 63.50 63.90 3cgw n PRO 231 Cb 0.64 -1.55 0.03 0.00 -0.04 0.00 0.00 33.50 32.58 3cgw n PRO 231 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3cgw n ALA 232 N -1.54 3.60 0.22 0.55 0.00 -1.26 -4.32 120.51 117.77 3cgw n ALA 232 Ca 0.02 -0.61 -0.15 0.00 0.00 0.00 0.00 53.44 52.70 3cgw n ALA 232 Cb 0.13 -0.83 -0.07 0.00 0.00 0.00 0.00 19.45 18.67 3cgw n ALA 232 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3cgw h GLY 233 N 4.87 -0.70 1.42 0.00 0.00 -1.70 -2.78 103.07 104.18 3cgw h GLY 233 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3cgw h GLY 233 CO 0.00 -0.27 -0.13 0.58 0.00 0.00 0.00 176.54 176.73 3cgw n LYS 234 N -5.42 0.27 -1.73 4.80 0.00 -1.26 -4.29 118.16 110.53 3cgw n LYS 234 Ca -0.10 -0.07 -0.35 0.00 -0.00 0.00 0.00 58.31 57.79 3cgw n LYS 234 Cb 0.32 -1.50 0.02 0.00 -0.00 0.00 0.00 35.03 33.87 3cgw n LYS 234 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3cgw n LEU 235 N -1.30 7.23 0.00 -5.58 4.77 -1.05 -4.05 117.00 117.03 3cgw n LEU 235 Ca 0.10 -4.55 0.00 0.00 -0.03 0.00 0.00 56.01 51.53 3cgw n LEU 235 Cb 0.31 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 3cgw n LEU 235 CO 0.27 1.72 0.00 -0.81 -1.33 0.00 0.00 177.39 177.24 3cgw n PRO 237 N -0.16 0.00 0.16 3.23 -0.04 -1.10 -4.19 135.00 132.90 3cgw n PRO 237 Ca 0.53 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 64.12 3cgw n PRO 237 Cb 0.36 0.00 0.45 0.00 -0.04 0.00 0.00 33.50 34.27 3cgw n PRO 237 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3cgw h ALA 238 N 0.00 1.00 0.00 0.55 0.00 -1.87 -3.06 119.26 115.88 3cgw h ALA 238 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3cgw h ALA 238 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3cgw h ALA 238 CO 0.00 0.00 -2.06 0.00 0.00 0.00 0.00 179.25 177.19 3cgw n GLY 240 N 1.56 1.74 3.32 0.00 0.00 -1.16 -5.10 105.19 105.55 3cgw n GLY 240 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 3cgw n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgw s ILE 241 N -2.00 2.02 0.22 -0.61 -1.09 -1.26 -5.00 121.20 113.47 3cgw s ILE 241 Ca 0.00 -1.29 -0.30 0.00 -2.23 0.00 0.00 60.65 56.83 3cgw s ILE 241 Cb 0.00 -1.72 -0.08 0.00 -1.58 0.00 0.00 42.46 39.08 3cgw s ILE 241 CO 0.00 0.37 1.04 -1.83 -1.23 0.00 0.00 174.94 173.29 3cgw s GLU 242 N -1.10 4.70 -1.20 2.79 -1.05 -1.26 -2.70 118.70 118.88 3cgw s GLU 242 Ca 0.11 1.64 -0.22 0.00 -0.15 0.00 0.00 54.97 56.35 3cgw s GLU 242 Cb -0.10 -3.27 -0.07 0.00 -0.44 0.00 0.00 34.13 30.25 3cgw s GLU 242 CO 0.01 0.26 1.92 0.08 0.95 0.00 0.00 175.26 178.48 3cgw s VAL 243 N -0.75 3.59 0.08 1.83 1.01 -1.26 -4.00 120.40 120.91 3cgw s VAL 243 Ca 0.45 -1.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.17 3cgw s VAL 243 Cb -0.28 -4.63 0.08 0.00 0.00 0.00 0.00 36.38 31.55 3cgw s VAL 243 CO 0.35 -1.08 0.66 -0.55 0.00 0.00 0.00 175.10 174.49 3cgw s SER 244 N 6.30 -0.56 0.00 3.32 0.15 -1.26 -4.88 113.70 116.77 3cgw s SER 244 Ca 0.67 0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.50 3cgw s SER 244 Cb -0.00 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 3cgw s SER 244 CO 0.13 -0.83 0.01 -1.54 1.20 0.00 0.00 173.24 172.21 3cgw n SER 245 N -0.04 0.03 0.00 5.45 3.41 -1.26 -2.55 113.62 118.66 3cgw n SER 245 Ca -0.16 -0.81 0.00 0.00 -0.26 0.00 0.00 58.87 57.64 3cgw n SER 245 Cb 0.63 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 3cgw n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cgw n GLY 247 N 1.79 0.00 0.16 5.00 0.00 -1.26 -3.55 105.19 107.34 3cgw n GLY 247 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3cgw n GLY 247 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3cgw h VAL 248 N 0.00 0.66 -0.70 1.61 2.07 -1.74 -1.17 116.25 116.97 3cgw h VAL 248 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 3cgw h VAL 248 Cb 0.00 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 3cgw h VAL 248 CO 0.00 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.93 3cgw h ALA 249 N 1.13 1.27 0.00 1.67 0.00 -1.86 -1.78 119.26 119.68 3cgw h ALA 249 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3cgw h ALA 249 Cb 0.26 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3cgw h ALA 249 CO -0.28 0.57 0.00 -0.85 0.00 0.00 0.00 179.25 178.68 3cgw n GLU 250 N -4.33 0.21 0.09 0.00 0.28 -0.72 -1.88 120.64 114.30 3cgw n GLU 250 Ca 0.07 0.10 0.06 0.00 -0.16 0.00 0.00 57.16 57.22 3cgw n GLU 250 Cb 0.14 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.50 3cgw n GLU 250 CO 0.00 0.00 0.00 -0.92 -0.16 0.00 0.00 177.13 176.05 3cgw h TYR 251 N 0.00 0.00 -0.30 -1.84 3.20 -0.32 -3.27 116.97 114.43 3cgw h TYR 251 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3cgw h TYR 251 Cb 0.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3cgw h TYR 251 CO 0.00 0.31 0.00 0.66 -1.64 0.00 0.00 178.16 177.49 3cgw n TYR 252 N -2.90 0.70 0.39 -3.82 4.01 -0.90 -4.70 117.16 109.94 3cgw n TYR 252 Ca -0.03 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.03 3cgw n TYR 252 Cb 0.69 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 3cgw n TYR 252 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3cgw n GLN 253 N 0.02 0.39 0.00 -0.72 10.64 -0.79 -0.83 117.38 126.09 3cgw n GLN 253 Ca 0.16 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.33 3cgw n GLN 253 Cb 0.65 -1.25 0.00 0.00 -0.86 0.00 0.00 30.24 28.78 3cgw n GLN 253 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 3cgw n ASP 254 N 0.54 0.23 0.00 2.61 2.03 -1.26 -4.84 116.55 115.86 3cgw n ASP 254 Ca 0.00 -0.61 0.00 0.00 0.52 0.00 0.00 54.79 54.70 3cgw n ASP 254 Cb 0.14 0.74 0.00 0.00 -0.72 0.00 0.00 41.12 41.28 3cgw n ASP 254 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 3cgw n PHE 255 N -0.74 0.00 -1.99 -0.67 -1.74 -0.67 -4.74 117.46 106.90 3cgw n PHE 255 Ca 0.00 0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.47 3cgw n PHE 255 Cb 0.00 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 40.97 3cgw n PHE 255 CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 3cgw s LEU 256 N 0.00 4.34 -0.05 5.98 2.96 -0.01 -4.39 118.68 127.51 3cgw s LEU 256 Ca 0.00 2.33 -0.05 0.00 -0.22 0.00 0.00 54.13 56.20 3cgw s LEU 256 Cb 0.00 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 3cgw s LEU 256 CO 0.00 -0.89 -0.09 0.47 -1.32 0.00 0.00 176.35 174.52 3cgw n ASP 257 N 6.31 0.59 -4.43 3.68 10.43 -0.11 -4.80 116.55 128.22 3cgw n ASP 257 Ca 0.16 0.19 -0.35 0.00 2.57 0.00 0.00 54.79 57.37 3cgw n ASP 257 Cb 0.42 -0.59 -0.13 0.00 1.84 0.00 0.00 41.12 42.66 3cgw n ASP 257 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3cgw s VAL 258 N -1.52 3.81 -0.06 2.53 1.01 -0.90 -1.05 120.40 124.21 3cgw s VAL 258 Ca -0.08 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.54 3cgw s VAL 258 Cb 0.01 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 3cgw s VAL 258 CO 0.11 0.45 -0.05 0.12 0.00 0.00 0.00 175.10 175.73 3cgw s PHE 259 N 0.89 3.00 -0.07 5.22 5.36 -0.67 -1.84 117.98 129.87 3cgw s PHE 259 Ca 0.00 0.07 0.04 0.00 -0.96 0.00 0.00 56.93 56.08 3cgw s PHE 259 Cb -0.14 -1.72 -0.00 0.00 -0.34 0.00 0.00 43.02 40.82 3cgw s PHE 259 CO 0.02 0.38 -0.21 0.08 -1.46 0.00 0.00 175.22 174.03 3cgw s VAL 260 N -0.86 1.75 0.10 3.12 1.01 0.31 -2.03 120.40 123.79 3cgw s VAL 260 Ca 0.13 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.29 3cgw s VAL 260 Cb -0.11 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 3cgw s VAL 260 CO 0.03 0.49 -0.11 0.72 0.00 0.00 0.00 175.10 176.23 3cgw s PHE 261 N 0.24 1.12 0.50 5.22 -0.71 -1.05 -0.20 117.98 123.10 3cgw s PHE 261 Ca -0.12 -0.61 -0.23 0.00 -1.04 0.00 0.00 56.93 54.93 3cgw s PHE 261 Cb -0.15 -0.61 -0.07 0.00 -1.21 0.00 0.00 43.02 40.98 3cgw s PHE 261 CO 0.05 0.03 1.26 -3.47 -1.34 0.00 0.00 175.22 171.75 3cgw n ASP 262 N 0.67 2.33 0.30 1.98 4.64 -1.24 -2.67 116.55 122.56 3cgw n ASP 262 Ca -0.17 1.01 0.20 0.00 -1.38 0.00 0.00 54.79 54.45 3cgw n ASP 262 Cb 0.57 -1.51 0.98 0.00 -1.04 0.00 0.00 41.12 40.12 3cgw n ASP 262 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 3cgw h GLU 263 N 1.60 0.00 0.00 -0.67 5.08 -1.89 -3.32 114.58 115.37 3cgw h GLU 263 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 3cgw h GLU 263 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3cgw h GLU 263 CO 0.57 0.00 0.00 -2.13 -1.00 0.00 0.00 179.01 176.45 3cgw n ARG 264 N -2.97 0.00 -1.65 2.33 3.00 -1.26 -4.44 116.66 111.67 3cgw n ARG 264 Ca -0.02 0.06 -0.43 0.00 -0.00 0.00 0.00 57.85 57.47 3cgw n ARG 264 Cb 0.14 -0.68 -0.03 0.00 0.00 0.00 0.00 32.46 31.89 3cgw n ARG 264 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 3cgw s ASP 265 N -2.32 5.87 -0.50 6.15 3.84 -1.25 -4.83 116.67 123.62 3cgw s ASP 265 Ca 0.00 2.18 -0.01 0.00 -0.00 0.00 0.00 52.55 54.72 3cgw s ASP 265 Cb 0.00 -2.52 0.39 0.00 -1.38 0.00 0.00 42.92 39.41 3cgw s ASP 265 CO 0.00 -1.59 1.98 0.54 -0.00 0.00 0.00 175.17 176.10 3cgw n ARG 266 N 8.26 2.29 -0.83 2.11 1.74 -1.26 -4.88 116.66 124.08 3cgw n ARG 266 Ca 0.26 -2.59 -0.34 0.00 -0.77 0.00 0.00 57.85 54.41 3cgw n ARG 266 Cb 0.43 -2.02 0.10 0.00 -1.02 0.00 0.00 32.46 29.96 3cgw n ARG 266 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3cgw n ALA 267 N -0.51 -4.58 -1.71 7.54 0.00 -1.26 -4.64 120.51 115.34 3cgw n ALA 267 Ca 0.50 -1.31 -0.17 0.00 0.00 0.00 0.00 53.44 52.46 3cgw n ALA 267 Cb 0.78 -1.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.07 3cgw n ALA 267 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3cgw s ASP 268 N -1.41 4.16 0.60 0.00 3.68 -1.26 -4.76 116.67 117.68 3cgw s ASP 268 Ca 0.44 -0.37 0.29 0.00 2.13 0.00 0.00 52.55 55.04 3cgw s ASP 268 Cb 0.00 -2.56 1.60 0.00 -1.45 0.00 0.00 42.92 40.51 3cgw s ASP 268 CO 0.63 -3.72 2.00 1.05 0.13 0.00 0.00 175.17 175.25 3cgw h GLU 269 N 12.03 0.00 0.00 4.34 4.11 -1.98 0.57 114.58 133.65 3cgw h GLU 269 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 3cgw h GLU 269 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 3cgw h GLU 269 CO 1.07 0.00 0.00 0.34 0.07 0.00 0.00 179.01 180.49 3cgw n PHE 270 N -3.62 0.82 0.07 2.06 -0.00 -1.26 -1.74 117.46 113.79 3cgw n PHE 270 Ca 0.04 0.34 -0.20 0.00 -0.00 0.00 0.00 57.45 57.63 3cgw n PHE 270 Cb 0.46 -1.04 -0.11 0.00 -0.00 0.00 0.00 39.48 38.79 3cgw n PHE 270 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3cgw h ALA 271 N 2.21 0.11 0.00 3.13 0.00 -0.23 -3.07 119.26 121.41 3cgw h ALA 271 Ca 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 54.15 3cgw h ALA 271 Cb 0.30 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 3cgw h ALA 271 CO 0.00 0.73 -0.05 0.74 0.00 0.00 0.00 179.25 180.67 3cgw h PHE 272 N 0.29 0.00 -0.07 0.00 -1.00 -1.42 -1.90 116.94 112.85 3cgw h PHE 272 Ca -0.15 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.48 3cgw h PHE 272 Cb 1.79 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 41.34 3cgw h PHE 272 CO 0.10 0.05 -0.64 0.93 -1.61 0.00 0.00 178.31 177.14 3cgw h GLU 273 N 0.00 0.25 0.00 1.51 4.39 -1.43 -2.90 114.58 116.40 3cgw h GLU 273 Ca -0.00 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.52 3cgw h GLU 273 Cb 0.51 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 3cgw h GLU 273 CO 0.01 0.80 0.00 0.54 -1.16 0.00 0.00 179.01 179.20 3cgw n ARG 274 N -3.85 0.12 -0.08 2.33 1.74 -0.71 -0.37 116.66 115.84 3cgw n ARG 274 Ca -0.03 0.03 0.04 0.00 -0.77 0.00 0.00 57.85 57.12 3cgw n ARG 274 Cb 0.64 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.66 3cgw n ARG 274 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3cgw n LEU 275 N -1.03 2.26 -3.52 0.55 4.77 -1.09 -5.02 117.00 113.92 3cgw n LEU 275 Ca 0.03 -1.61 -0.23 0.00 -0.03 0.00 0.00 56.01 54.17 3cgw n LEU 275 Cb 0.02 -0.10 0.04 0.00 -2.33 0.00 0.00 43.42 41.04 3cgw n LEU 275 CO 0.02 0.53 -0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3cgw n GLY 276 N 0.31 -1.10 3.38 -0.72 0.00 0.50 -4.99 105.19 102.57 3cgw n GLY 276 Ca 0.07 0.50 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 3cgw n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cgw s HIS 278 N -0.85 1.80 -0.08 0.00 3.76 -0.22 -4.66 115.29 115.04 3cgw s HIS 278 Ca -0.09 1.69 -0.05 0.00 -0.15 0.00 0.00 55.06 56.46 3cgw s HIS 278 Cb -0.03 -3.45 0.03 0.00 1.11 0.00 0.00 32.58 30.25 3cgw s HIS 278 CO 0.05 -2.81 0.20 0.00 -0.85 0.00 0.00 174.74 171.34 3cgw s ALA 279 N -2.26 -0.46 0.17 -1.40 0.00 -1.26 -1.67 121.76 114.89 3cgw s ALA 279 Ca 0.72 0.74 0.00 0.00 0.00 0.00 0.00 51.96 53.42 3cgw s ALA 279 Cb -0.27 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 3cgw s ALA 279 CO 0.52 -0.14 0.05 -1.54 0.00 0.00 0.00 175.76 174.64 3cgw s SER 280 N 0.77 0.80 -0.04 0.00 1.04 -0.86 -4.98 113.70 110.42 3cgw s SER 280 Ca -0.05 -1.24 0.02 0.00 0.48 0.00 0.00 55.95 55.16 3cgw s SER 280 Cb -0.07 0.21 -0.03 0.00 0.10 0.00 0.00 66.02 66.23 3cgw s SER 280 CO -0.04 -0.67 -0.07 -0.13 0.98 0.00 0.00 173.24 173.30 3cgw s ARG 281 N -4.00 2.65 -0.20 4.02 1.81 -1.26 -2.52 118.95 119.45 3cgw s ARG 281 Ca 0.28 -0.63 -0.29 0.00 -1.72 0.00 0.00 55.73 53.37 3cgw s ARG 281 Cb 0.07 -2.54 0.13 0.00 -0.45 0.00 0.00 34.95 32.16 3cgw s ARG 281 CO 0.05 0.64 1.03 0.00 -0.68 0.00 0.00 175.30 176.34 3cgw s ALA 282 N -0.89 -1.96 -0.48 2.13 0.00 -1.09 -4.94 121.76 114.54 3cgw s ALA 282 Ca 0.14 1.68 -0.29 0.00 0.00 0.00 0.00 51.96 53.50 3cgw s ALA 282 Cb -0.11 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.06 3cgw s ALA 282 CO 0.04 -0.28 1.32 0.34 0.00 0.00 0.00 175.76 177.18 3cgw s ASP 283 N -0.69 6.38 0.00 0.00 -1.08 -1.26 -2.92 116.67 117.09 3cgw s ASP 283 Ca 0.00 0.53 0.17 0.00 -0.52 0.00 0.00 52.55 52.73 3cgw s ASP 283 Cb -0.02 -2.55 0.51 0.00 -1.46 0.00 0.00 42.92 39.41 3cgw s ASP 283 CO -0.01 -1.46 1.41 0.35 0.52 0.00 0.00 175.17 175.98 3cgw n THR 284 N 6.93 0.45 -2.27 1.71 -2.24 -1.26 -4.69 114.28 112.92 3cgw n THR 284 Ca 0.14 -0.52 -0.26 0.00 -2.27 0.00 0.00 64.05 61.13 3cgw n THR 284 Cb 0.49 0.40 0.09 0.00 -2.10 0.00 0.00 70.33 69.21 3cgw n THR 284 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3cgw s LEU 285 N -1.25 2.86 0.00 3.22 2.96 -1.26 -5.10 118.68 120.12 3cgw s LEU 285 Ca 0.31 0.22 0.00 0.00 -0.22 0.00 0.00 54.13 54.45 3cgw s LEU 285 Cb 0.17 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 44.13 3cgw s LEU 285 CO 0.23 -1.81 0.00 0.35 -1.32 0.00 0.00 176.35 173.81 3cgw n THR 287 N -3.00 0.00 -3.56 3.68 -2.24 -1.26 -4.92 114.28 102.98 3cgw n THR 287 Ca 0.11 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.81 3cgw n THR 287 Cb 0.60 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 3cgw n THR 287 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3cgw s SER 288 N 0.00 -0.29 0.50 3.42 0.15 -1.26 -4.97 113.70 111.25 3cgw s SER 288 Ca 0.00 0.16 0.16 0.00 0.70 0.00 0.00 55.95 56.97 3cgw s SER 288 Cb 0.00 0.27 1.22 0.00 -1.71 0.00 0.00 66.02 65.80 3cgw s SER 288 CO 0.00 -0.39 2.09 0.74 1.20 0.00 0.00 173.24 176.89 3cgw h THR 289 N 2.22 0.95 0.37 6.45 2.02 -1.94 0.15 112.91 123.14 3cgw h THR 289 Ca -0.17 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 3cgw h THR 289 Cb 1.19 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 3cgw h THR 289 CO 0.29 0.02 -0.18 -0.33 0.37 0.00 0.00 175.52 175.69 3cgw h GLU 290 N 0.11 -0.48 -0.98 6.66 4.39 -1.96 -1.48 114.58 120.84 3cgw h GLU 290 Ca 0.09 0.03 0.19 0.00 0.34 0.00 0.00 59.36 60.02 3cgw h GLU 290 Cb 0.24 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 28.90 3cgw h GLU 290 CO -0.01 -0.22 0.61 -0.22 -1.16 0.00 0.00 179.01 178.01 3cgw h LYS 291 N -1.06 0.66 -0.35 2.33 1.63 -1.86 -0.06 116.57 117.87 3cgw h LYS 291 Ca -0.05 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.61 3cgw h LYS 291 Cb 0.48 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.95 3cgw h LYS 291 CO 0.08 0.44 -0.18 1.03 -3.45 0.00 0.00 179.45 177.37 3cgw h SER 292 N 0.68 0.76 -0.05 4.20 0.87 -0.71 -2.64 113.55 116.65 3cgw h SER 292 Ca 0.55 -0.41 0.02 0.00 -1.23 0.00 0.00 61.79 60.71 3cgw h SER 292 Cb 0.96 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 3cgw h SER 292 CO -0.32 1.01 0.05 0.50 -0.53 0.00 0.00 176.83 177.53 3cgw h LYS 293 N 0.52 0.00 -0.21 2.24 3.64 0.08 -1.36 116.57 121.48 3cgw h LYS 293 Ca 0.08 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 3cgw h LYS 293 Cb 0.72 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 3cgw h LYS 293 CO 0.05 0.00 0.07 1.49 -2.27 0.00 0.00 179.45 178.80 3cgw h GLU 294 N 0.00 0.33 -0.13 1.90 4.81 -1.00 -1.78 114.58 118.70 3cgw h GLU 294 Ca 0.03 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 3cgw h GLU 294 Cb 0.12 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3cgw h GLU 294 CO -0.00 0.40 -0.42 1.25 -0.73 0.00 0.00 179.01 179.52 3cgw h LEU 295 N 0.18 0.31 0.23 1.64 5.85 -1.22 -3.16 115.31 119.15 3cgw h LEU 295 Ca 0.07 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 3cgw h LEU 295 Cb 0.21 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3cgw h LEU 295 CO -0.00 0.70 -0.17 0.00 -0.34 0.00 0.00 178.44 178.63 3cgw h ALA 296 N 1.32 -0.38 -0.54 1.25 0.00 -0.97 -2.24 119.26 117.69 3cgw h ALA 296 Ca 0.02 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.95 3cgw h ALA 296 Cb 0.84 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 3cgw h ALA 296 CO 0.07 -0.73 0.37 0.93 0.00 0.00 0.00 179.25 179.88 3cgw h GLU 297 N -0.40 0.38 -0.38 0.00 5.08 -1.33 -1.51 114.58 116.42 3cgw h GLU 297 Ca -0.02 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.20 3cgw h GLU 297 Cb 0.35 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3cgw h GLU 297 CO 0.00 0.25 -0.25 0.82 -1.00 0.00 0.00 179.01 178.83 3cgw h ILE 298 N 0.39 1.27 -0.14 3.13 2.04 -1.42 0.13 117.51 122.92 3cgw h ILE 298 Ca 0.25 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 3cgw h ILE 298 Cb 0.45 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 3cgw h ILE 298 CO -0.06 0.46 0.01 0.58 0.00 0.00 0.00 178.15 179.13 3cgw h VAL 299 N 0.67 1.24 0.11 1.67 2.07 -0.78 0.44 116.25 121.67 3cgw h VAL 299 Ca 0.09 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.85 3cgw h VAL 299 Cb 0.77 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 3cgw h VAL 299 CO 0.06 0.23 -0.19 0.58 0.02 0.00 0.00 177.57 178.27 3cgw h VAL 300 N -0.01 0.57 0.00 2.57 2.07 -1.13 0.31 116.25 120.62 3cgw h VAL 300 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3cgw h VAL 300 Cb 0.34 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3cgw h VAL 300 CO 0.01 0.00 0.00 -0.61 0.02 0.00 0.00 177.57 176.99 3cgw h GLN 301 N -0.37 0.00 0.00 1.57 5.75 -0.64 -1.86 115.11 119.56 3cgw h GLN 301 Ca 0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 3cgw h GLN 301 Cb 0.39 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.94 3cgw h GLN 301 CO -0.10 0.00 0.00 0.00 -2.65 0.00 0.00 178.83 176.08 3cgw n ALA 302 N -2.00 2.10 1.21 3.38 0.00 0.15 -5.05 120.51 120.30 3cgw n ALA 302 Ca -0.01 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.50 3cgw n ALA 302 Cb 0.16 -1.41 0.28 0.00 0.00 0.00 0.00 19.45 18.49 3cgw n ALA 302 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69