#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fgw s PRO 62 N 0.00 0.38 0.10 0.52 0.02 -1.26 -4.99 135.00 129.78 3fgw s PRO 62 Ca 0.00 -0.16 -0.24 0.00 0.02 0.00 0.00 61.00 60.62 3fgw s PRO 62 Cb 0.00 -1.79 -0.11 0.00 0.02 0.00 0.00 34.50 32.61 3fgw s PRO 62 CO 0.00 -2.63 1.70 0.28 -0.33 0.00 0.00 177.00 176.02 3fgw h VAL 63 N -1.80 0.76 -3.82 3.83 2.07 -1.91 -3.35 116.25 112.03 3fgw h VAL 63 Ca -0.46 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 66.82 3fgw h VAL 63 Cb 1.27 0.76 -0.27 0.00 -1.52 0.00 0.00 31.29 31.54 3fgw h VAL 63 CO 0.44 0.00 -0.73 -0.55 0.02 0.00 0.00 177.57 176.75 3fgw s SER 64 N -5.02 0.23 -0.04 0.57 0.15 -1.26 -0.69 113.70 107.64 3fgw s SER 64 Ca -0.14 -0.13 -0.02 0.00 0.70 0.00 0.00 55.95 56.36 3fgw s SER 64 Cb 0.07 0.00 0.02 0.00 -1.71 0.00 0.00 66.02 64.40 3fgw s SER 64 CO 0.66 -0.04 0.09 -0.60 1.20 0.00 0.00 173.24 174.55 3fgw s ARG 65 N -0.34 0.07 -0.07 5.44 3.52 -0.78 -5.02 118.95 121.77 3fgw s ARG 65 Ca -0.03 0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.82 3fgw s ARG 65 Cb -0.03 -0.09 0.01 0.00 -1.56 0.00 0.00 34.95 33.28 3fgw s ARG 65 CO -0.00 -0.09 -0.16 0.99 -0.81 0.00 0.00 175.30 175.23 3fgw s THR 66 N 0.63 1.39 0.11 4.11 2.01 -1.26 -1.73 115.64 120.90 3fgw s THR 66 Ca -0.05 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.38 3fgw s THR 66 Cb -0.07 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 3fgw s THR 66 CO -0.03 0.41 -0.15 -0.13 -0.69 0.00 0.00 174.62 174.03 3fgw s ARG 67 N 0.52 0.98 0.03 4.92 1.81 -0.72 -0.38 118.95 126.11 3fgw s ARG 67 Ca -0.15 -1.15 0.03 0.00 -1.72 0.00 0.00 55.73 52.74 3fgw s ARG 67 Cb -0.16 -0.95 -0.02 0.00 -0.45 0.00 0.00 34.95 33.37 3fgw s ARG 67 CO 0.05 0.20 -0.09 -1.12 -0.68 0.00 0.00 175.30 173.66 3fgw s SER 68 N -2.18 0.99 -0.22 0.23 0.01 -0.94 -1.55 113.70 110.03 3fgw s SER 68 Ca 0.05 -0.43 -0.01 0.00 1.31 0.00 0.00 55.95 56.88 3fgw s SER 68 Cb -0.07 -0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.16 3fgw s SER 68 CO 0.03 -0.09 -0.11 -0.22 0.41 0.00 0.00 173.24 173.26 3fgw s LEU 69 N -1.17 2.83 0.00 2.44 2.96 0.52 -0.98 118.68 125.29 3fgw s LEU 69 Ca -0.05 -0.77 0.02 0.00 -0.22 0.00 0.00 54.13 53.11 3fgw s LEU 69 Cb -0.08 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 3fgw s LEU 69 CO 0.01 -0.08 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.18 3fgw s LEU 70 N 1.32 3.39 -0.83 -0.68 1.02 -1.05 0.47 118.68 122.30 3fgw s LEU 70 Ca 0.02 -0.06 -0.22 0.00 0.02 0.00 0.00 54.13 53.89 3fgw s LEU 70 Cb -0.15 -1.94 0.08 0.00 0.02 0.00 0.00 46.19 44.20 3fgw s LEU 70 CO -0.07 0.28 1.15 -0.22 0.02 0.00 0.00 176.35 177.51 3fgw s LEU 71 N -1.52 4.33 -0.42 1.79 2.96 -1.26 -2.73 118.68 121.83 3fgw s LEU 71 Ca 0.19 -1.40 -0.29 0.00 -0.22 0.00 0.00 54.13 52.41 3fgw s LEU 71 Cb -0.11 -2.46 0.01 0.00 0.50 0.00 0.00 46.19 44.13 3fgw s LEU 71 CO 0.09 -1.36 1.41 -0.62 -1.32 0.00 0.00 176.35 174.56 3fgw s ASP 72 N 3.92 6.32 0.12 3.68 2.15 -0.21 -4.88 116.67 127.76 3fgw s ASP 72 Ca 0.32 0.79 0.22 0.00 0.43 0.00 0.00 52.55 54.31 3fgw s ASP 72 Cb -0.08 -2.54 0.88 0.00 -0.30 0.00 0.00 42.92 40.87 3fgw s ASP 72 CO -0.00 -1.46 1.68 0.00 -0.17 0.00 0.00 175.17 175.22 3fgw n ALA 73 N 8.89 1.88 0.72 3.66 0.00 -1.26 0.82 120.51 135.22 3fgw n ALA 73 Ca 0.16 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.69 3fgw n ALA 73 Cb 0.48 -1.36 0.43 0.00 0.00 0.00 0.00 19.45 19.00 3fgw n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fgw n ALA 74 N -1.63 1.92 -0.13 0.00 0.00 -1.26 -4.10 120.51 115.31 3fgw n ALA 74 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3fgw n ALA 74 Cb 0.26 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3fgw n ALA 74 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3fgw n SER 75 N -1.46 0.00 -0.73 0.00 3.41 -0.99 -5.02 113.62 108.83 3fgw n SER 75 Ca 0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.57 3fgw n SER 75 Cb 0.22 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 3fgw n SER 75 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fgw n GLY 76 N 0.00 0.97 3.80 5.00 0.00 0.24 -5.03 105.19 110.18 3fgw n GLY 76 Ca 0.00 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 3fgw n GLY 76 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fgw s GLN 77 N -2.94 2.51 -0.14 1.61 -1.52 -1.14 -4.90 119.66 113.14 3fgw s GLN 77 Ca 0.00 -1.49 -0.13 0.00 -1.95 0.00 0.00 55.36 51.79 3fgw s GLN 77 Cb 0.00 -2.30 -0.05 0.00 -0.22 0.00 0.00 33.01 30.45 3fgw s GLN 77 CO 0.00 0.02 0.27 -0.51 -0.25 0.00 0.00 175.29 174.82 3fgw s LEU 78 N -3.96 4.29 0.02 2.90 2.01 -1.26 -1.05 118.68 121.63 3fgw s LEU 78 Ca 0.41 0.53 -0.01 0.00 0.01 0.00 0.00 54.13 55.08 3fgw s LEU 78 Cb -0.03 -2.33 -0.02 0.00 0.01 0.00 0.00 46.19 43.83 3fgw s LEU 78 CO 0.25 0.19 -0.00 -0.60 1.01 0.00 0.00 176.35 177.19 3fgw s ARG 79 N 0.02 0.32 0.23 1.70 6.06 -1.10 -4.88 118.95 121.29 3fgw s ARG 79 Ca 0.16 -0.55 -0.18 0.00 -2.50 0.00 0.00 55.73 52.67 3fgw s ARG 79 Cb -0.13 0.12 -0.08 0.00 0.06 0.00 0.00 34.95 34.92 3fgw s ARG 79 CO 0.05 -0.06 0.69 -0.51 -2.50 0.00 0.00 175.30 172.97 3fgw s LEU 80 N -1.38 4.28 0.35 -0.88 1.43 -1.26 -2.55 118.68 118.68 3fgw s LEU 80 Ca -0.15 1.32 0.03 0.00 -1.03 0.00 0.00 54.13 54.30 3fgw s LEU 80 Cb -0.09 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.46 3fgw s LEU 80 CO -0.01 -0.00 0.09 -1.61 0.23 0.00 0.00 176.35 175.05 3fgw s GLU 81 N -2.18 1.73 -0.16 1.70 2.02 -0.15 -4.98 118.70 116.68 3fgw s GLU 81 Ca 0.44 -2.00 -0.02 0.00 0.02 0.00 0.00 54.97 53.41 3fgw s GLU 81 Cb -0.15 -0.71 -0.02 0.00 0.10 0.00 0.00 34.13 33.35 3fgw s GLU 81 CO 0.20 -0.31 -0.07 -0.51 0.02 0.00 0.00 175.26 174.59 3fgw s ASP 82 N -3.51 4.43 0.00 -0.19 -0.00 -1.26 -2.22 116.67 113.92 3fgw s ASP 82 Ca 0.32 -0.24 0.00 0.00 -0.00 0.00 0.00 52.55 52.62 3fgw s ASP 82 Cb 0.06 -1.71 0.00 0.00 -0.00 0.00 0.00 42.92 41.27 3fgw s ASP 82 CO 0.15 0.14 0.00 0.61 -0.00 0.00 0.00 175.17 176.06 3fgw n GLY 83 N 3.74 0.77 3.74 0.21 0.00 0.49 -4.91 105.19 109.22 3fgw n GLY 83 Ca -0.18 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 3fgw n GLY 83 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3fgw s PHE 84 N -1.76 3.37 -0.05 1.61 5.36 -1.26 -3.87 117.98 121.39 3fgw s PHE 84 Ca 0.00 1.40 -0.02 0.00 -0.96 0.00 0.00 56.93 57.35 3fgw s PHE 84 Cb 0.00 -3.48 0.03 0.00 -0.34 0.00 0.00 43.02 39.23 3fgw s PHE 84 CO 0.00 -1.36 0.04 -1.01 -1.46 0.00 0.00 175.22 171.43 3fgw s HIS 85 N -0.20 0.23 0.24 10.12 3.76 -1.26 -5.07 115.29 123.12 3fgw s HIS 85 Ca 0.53 0.13 -0.06 0.00 -0.15 0.00 0.00 55.06 55.50 3fgw s HIS 85 Cb -0.34 -0.54 0.25 0.00 1.11 0.00 0.00 32.58 33.06 3fgw s HIS 85 CO 0.39 -0.22 1.89 -1.00 -0.85 0.00 0.00 174.74 174.95 3fgw h PRO 86 N 8.26 1.26 -0.66 8.40 0.13 -2.01 -2.77 132.00 144.61 3fgw h PRO 86 Ca -0.18 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3fgw h PRO 86 Cb 1.12 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3fgw h PRO 86 CO 0.22 0.89 0.00 -0.25 -0.23 0.00 0.00 178.00 178.63 3fgw n ASP 87 N -4.35 4.20 -4.78 1.44 8.00 -1.26 -4.94 116.55 114.85 3fgw n ASP 87 Ca 0.10 -2.54 -0.34 0.00 0.71 0.00 0.00 54.79 52.72 3fgw n ASP 87 Cb 0.07 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 3fgw n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fgw s ALA 88 N -2.09 2.70 0.16 2.24 0.00 -1.05 -4.79 121.76 118.94 3fgw s ALA 88 Ca 0.40 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 3fgw s ALA 88 Cb 0.28 -3.30 0.05 0.00 0.00 0.00 0.00 23.12 20.16 3fgw s ALA 88 CO 0.15 -0.77 1.67 0.28 0.00 0.00 0.00 175.76 177.09 3fgw h VAL 89 N 0.90 1.25 -3.10 0.00 2.07 -0.33 -3.38 116.25 113.65 3fgw h VAL 89 Ca -0.49 -0.88 -0.07 0.00 0.82 0.00 0.00 66.70 66.08 3fgw h VAL 89 Cb 1.24 0.75 -0.16 0.00 -1.52 0.00 0.00 31.29 31.60 3fgw h VAL 89 CO 0.57 0.32 -0.10 0.00 0.02 0.00 0.00 177.57 178.38 3fgw s ALA 90 N -5.31 -0.98 -0.06 1.67 0.00 -1.19 0.12 121.76 116.00 3fgw s ALA 90 Ca -0.13 0.24 -0.08 0.00 0.00 0.00 0.00 51.96 51.99 3fgw s ALA 90 Cb 0.12 0.40 0.02 0.00 0.00 0.00 0.00 23.12 23.66 3fgw s ALA 90 CO 0.81 -0.49 0.21 1.67 0.00 0.00 0.00 175.76 177.96 3fgw s TRP 91 N -2.70 -0.18 0.11 0.00 -2.14 -0.30 -0.35 118.94 113.37 3fgw s TRP 91 Ca -0.04 0.43 0.06 0.00 2.66 0.00 0.00 56.10 59.21 3fgw s TRP 91 Cb -0.00 0.06 -0.04 0.00 -3.10 0.00 0.00 33.47 30.39 3fgw s TRP 91 CO -0.04 -0.16 -0.14 0.00 -2.66 0.00 0.00 176.95 173.95 3fgw s ALA 92 N -0.24 1.43 -0.18 2.67 0.00 -0.59 -1.46 121.76 123.39 3fgw s ALA 92 Ca -0.03 -1.23 -0.05 0.00 0.00 0.00 0.00 51.96 50.65 3fgw s ALA 92 Cb -0.03 -0.08 0.06 0.00 0.00 0.00 0.00 23.12 23.07 3fgw s ALA 92 CO 0.01 0.12 0.08 1.21 0.00 0.00 0.00 175.76 177.18 3fgw s ASN 93 N -2.28 2.46 -0.27 0.00 3.84 -0.57 -1.76 114.94 116.36 3fgw s ASN 93 Ca 0.06 -0.66 -0.09 0.00 0.21 0.00 0.00 52.86 52.38 3fgw s ASN 93 Cb -0.06 -0.30 -0.03 0.00 -0.55 0.00 0.00 41.25 40.32 3fgw s ASN 93 CO 0.03 -0.35 0.12 -0.22 -2.79 0.00 0.00 177.10 173.89 3fgw s LEU 94 N 2.10 3.76 -0.30 3.21 2.96 -0.70 -1.76 118.68 127.95 3fgw s LEU 94 Ca 0.02 -0.27 -0.09 0.00 -0.22 0.00 0.00 54.13 53.57 3fgw s LEU 94 Cb -0.16 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.53 3fgw s LEU 94 CO -0.10 -0.09 0.14 -0.89 -1.32 0.00 0.00 176.35 174.09 3fgw s THR 95 N 1.64 4.55 -0.21 3.68 2.01 0.95 -1.86 115.64 126.40 3fgw s THR 95 Ca 0.06 -0.39 -0.21 0.00 0.31 0.00 0.00 61.69 61.46 3fgw s THR 95 Cb -0.16 -3.30 -0.02 0.00 0.01 0.00 0.00 72.50 69.03 3fgw s THR 95 CO 0.06 0.10 0.63 0.21 -0.69 0.00 0.00 174.62 174.93 3fgw s ASN 96 N 1.61 6.65 -0.15 3.53 3.84 0.14 -0.00 114.94 130.56 3fgw s ASN 96 Ca 0.05 0.79 0.24 0.00 0.21 0.00 0.00 52.86 54.15 3fgw s ASN 96 Cb -0.17 -2.34 0.47 0.00 -0.55 0.00 0.00 41.25 38.66 3fgw s ASN 96 CO 0.06 -0.30 1.14 0.00 -2.79 0.00 0.00 177.10 175.21 3fgw n ALA 97 N 5.23 2.53 0.20 1.71 0.00 -0.89 -4.74 120.51 124.56 3fgw n ALA 97 Ca -0.01 -2.60 0.04 0.00 0.00 0.00 0.00 53.44 50.88 3fgw n ALA 97 Cb 0.49 -0.80 0.43 0.00 0.00 0.00 0.00 19.45 19.57 3fgw n ALA 97 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3fgw h ILE 98 N 6.12 1.14 -0.06 0.00 2.04 -1.82 0.19 117.51 125.12 3fgw h ILE 98 Ca -0.17 -1.08 -0.18 0.00 1.00 0.00 0.00 64.86 64.43 3fgw h ILE 98 Cb 1.55 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 3fgw h ILE 98 CO 0.15 0.30 -0.75 -0.09 0.00 0.00 0.00 178.15 177.76 3fgw h ARG 99 N 0.00 0.34 0.05 2.37 2.43 -1.90 -2.58 114.38 115.09 3fgw h ARG 99 Ca -0.00 -0.29 -0.38 0.00 -0.81 0.00 0.00 59.98 58.50 3fgw h ARG 99 Cb 0.57 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 3fgw h ARG 99 CO 0.04 0.94 -2.26 0.39 -1.51 0.00 0.00 179.97 177.58 3fgw n GLU 100 N -3.80 0.69 0.00 0.20 4.71 -1.03 -4.75 120.64 116.65 3fgw n GLU 100 Ca -0.04 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.32 3fgw n GLU 100 Cb 0.72 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 29.55 3fgw n GLU 100 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3fgw n THR 101 N -3.41 0.00 -0.58 2.62 -2.24 0.64 -4.89 114.28 106.42 3fgw n THR 101 Ca -0.40 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3fgw n THR 101 Cb 1.00 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 3fgw n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fgw n GLY 102 N 2.42 0.74 3.17 3.38 0.00 -0.96 -4.35 105.19 109.60 3fgw n GLY 102 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3fgw n GLY 102 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fgw s TRP 103 N -2.43 1.55 0.19 1.61 0.52 -1.23 -4.44 118.94 114.70 3fgw s TRP 103 Ca 0.00 -0.31 0.04 0.00 0.02 0.00 0.00 56.10 55.84 3fgw s TRP 103 Cb 0.00 -0.97 -0.03 0.00 -1.15 0.00 0.00 33.47 31.32 3fgw s TRP 103 CO 0.00 0.00 0.29 0.00 0.02 0.00 0.00 176.95 177.27 3fgw s ALA 104 N -0.53 3.91 -0.07 0.98 0.00 -0.07 -2.09 121.76 123.88 3fgw s ALA 104 Ca 0.06 -1.13 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3fgw s ALA 104 Cb -0.07 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.35 3fgw s ALA 104 CO 0.00 0.42 -0.11 0.71 0.00 0.00 0.00 175.76 176.79 3fgw s TYR 105 N -1.84 1.39 -0.12 0.00 2.02 1.00 -0.72 117.35 119.07 3fgw s TYR 105 Ca 0.34 -0.54 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 3fgw s TYR 105 Cb -0.10 -1.06 0.02 0.00 -0.40 0.00 0.00 41.96 40.42 3fgw s TYR 105 CO 0.28 -0.31 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.66 3fgw s LEU 106 N 0.87 1.54 -0.26 -1.29 2.96 -0.64 -0.03 118.68 121.84 3fgw s LEU 106 Ca -0.11 -0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 53.36 3fgw s LEU 106 Cb -0.15 -1.04 0.01 0.00 0.50 0.00 0.00 46.19 45.51 3fgw s LEU 106 CO 0.01 -0.05 -0.02 -0.62 -1.32 0.00 0.00 176.35 174.35 3fgw s ASP 107 N 1.40 4.54 -0.05 3.68 2.15 -0.72 -0.09 116.67 127.57 3fgw s ASP 107 Ca 0.01 -0.73 0.05 0.00 0.43 0.00 0.00 52.55 52.31 3fgw s ASP 107 Cb -0.13 -1.74 -0.01 0.00 -0.30 0.00 0.00 42.92 40.74 3fgw s ASP 107 CO -0.07 -0.12 -0.21 -0.22 -0.17 0.00 0.00 175.17 174.37 3fgw s LEU 108 N 1.40 1.99 0.02 -1.34 0.20 0.10 -1.51 118.68 119.54 3fgw s LEU 108 Ca 0.02 -0.44 0.01 0.00 0.69 0.00 0.00 54.13 54.41 3fgw s LEU 108 Cb -0.16 -1.19 -0.01 0.00 -0.43 0.00 0.00 46.19 44.40 3fgw s LEU 108 CO -0.02 0.20 -0.05 -0.55 -0.29 0.00 0.00 176.35 175.64 3fgw s SER 109 N -0.03 0.49 0.15 3.68 0.15 -0.53 -0.08 113.70 117.53 3fgw s SER 109 Ca -0.05 -0.29 0.10 0.00 0.70 0.00 0.00 55.95 56.41 3fgw s SER 109 Cb -0.13 0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.15 3fgw s SER 109 CO 0.03 -0.10 -0.20 0.42 1.20 0.00 0.00 173.24 174.59 3fgw s THR 110 N -0.74 2.63 -0.18 6.45 -4.23 -1.06 -1.15 115.64 117.36 3fgw s THR 110 Ca -0.05 -1.73 -0.23 0.00 -1.18 0.00 0.00 61.69 58.49 3fgw s THR 110 Cb -0.06 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.54 3fgw s THR 110 CO -0.00 0.00 0.73 0.21 -0.54 0.00 0.00 174.62 175.03 3fgw s ASN 111 N -2.38 6.83 -0.04 3.99 3.84 0.12 -4.55 114.94 122.75 3fgw s ASN 111 Ca 0.19 1.02 0.02 0.00 0.21 0.00 0.00 52.86 54.30 3fgw s ASN 111 Cb -0.09 -2.40 0.15 0.00 -0.55 0.00 0.00 41.25 38.35 3fgw s ASN 111 CO 0.10 -0.33 0.73 0.61 -2.79 0.00 0.00 177.10 175.42 3fgw n GLY 112 N 3.60 1.77 0.30 1.21 0.00 -1.26 -3.09 105.19 107.71 3fgw n GLY 112 Ca 0.02 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.94 3fgw n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fgw n ARG 113 N 0.11 1.86 -3.93 1.61 1.74 -1.26 -4.95 116.66 111.85 3fgw n ARG 113 Ca 0.05 -0.68 -0.21 0.00 -0.77 0.00 0.00 57.85 56.23 3fgw n ARG 113 Cb 0.42 -1.21 -0.03 0.00 -1.02 0.00 0.00 32.46 30.63 3fgw n ARG 113 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3fgw s TYR 114 N -1.77 3.14 0.65 -1.55 2.02 -1.18 -5.11 117.35 113.56 3fgw s TYR 114 Ca 0.11 -0.15 -0.15 0.00 -0.37 0.00 0.00 57.07 56.51 3fgw s TYR 114 Cb 0.11 -1.60 -0.00 0.00 -0.40 0.00 0.00 41.96 40.07 3fgw s TYR 114 CO 0.37 0.36 1.12 0.54 -1.57 0.00 0.00 175.55 176.37 3fgw s ASN 115 N -3.95 5.10 0.28 2.29 2.20 -1.26 -4.83 114.94 114.77 3fgw s ASN 115 Ca 0.36 2.05 0.01 0.00 -0.94 0.00 0.00 52.86 54.34 3fgw s ASN 115 Cb -0.08 -2.56 0.52 0.00 -2.00 0.00 0.00 41.25 37.14 3fgw s ASN 115 CO 0.27 -1.64 1.86 0.44 -2.94 0.00 0.00 177.10 175.09 3fgw h ASP 116 N 0.13 0.95 -0.43 3.54 5.19 -1.95 -0.88 116.42 122.97 3fgw h ASP 116 Ca -0.47 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 55.98 3fgw h ASP 116 Cb 1.25 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 40.57 3fgw h ASP 116 CO 0.54 0.55 0.27 0.28 -3.12 0.00 0.00 179.24 177.76 3fgw h SER 117 N 1.04 0.45 -0.22 6.45 0.02 -1.97 0.32 113.55 119.64 3fgw h SER 117 Ca 0.46 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 61.30 3fgw h SER 117 Cb 0.37 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3fgw h SER 117 CO -0.22 0.33 -0.27 0.25 -1.14 0.00 0.00 176.83 175.78 3fgw h LEU 118 N 0.55 0.63 -0.30 5.07 5.85 -1.83 -1.71 115.31 123.56 3fgw h LEU 118 Ca 0.16 -0.50 0.07 0.00 0.84 0.00 0.00 57.88 58.46 3fgw h LEU 118 Cb -0.03 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 40.75 3fgw h LEU 118 CO -0.05 1.00 -0.20 1.56 -0.34 0.00 0.00 178.44 180.40 3fgw h GLN 119 N 0.27 -0.17 0.17 1.25 4.20 -0.89 0.20 115.11 120.15 3fgw h GLN 119 Ca 0.03 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3fgw h GLN 119 Cb 0.84 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.66 3fgw h GLN 119 CO 0.06 -0.11 -0.08 0.00 -0.67 0.00 0.00 178.83 178.03 3fgw h ALA 120 N 0.98 -0.22 -0.80 3.87 0.00 -0.33 0.43 119.26 123.19 3fgw h ALA 120 Ca 0.16 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3fgw h ALA 120 Cb 0.42 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3fgw h ALA 120 CO -0.41 -0.60 0.53 -0.92 0.00 0.00 0.00 179.25 177.85 3fgw h TYR 121 N -0.27 0.92 -0.37 0.00 3.20 -1.16 -2.23 116.97 117.06 3fgw h TYR 121 Ca -0.02 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.74 3fgw h TYR 121 Cb 0.21 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 3fgw h TYR 121 CO -0.05 0.51 -0.27 0.00 -1.64 0.00 0.00 178.16 176.70 3fgw h ALA 122 N 1.55 0.52 -0.55 1.82 0.00 -0.62 -2.82 119.26 119.16 3fgw h ALA 122 Ca 0.33 -0.40 0.12 0.00 0.00 0.00 0.00 54.91 54.96 3fgw h ALA 122 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3fgw h ALA 122 CO -0.11 0.54 0.38 0.00 0.00 0.00 0.00 179.25 180.05 3fgw h ALA 123 N 0.77 2.20 -0.07 0.00 0.00 -0.30 0.29 119.26 122.15 3fgw h ALA 123 Ca 0.07 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.73 3fgw h ALA 123 Cb 0.84 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.61 3fgw h ALA 123 CO 0.07 -0.34 -0.89 0.78 0.00 0.00 0.00 179.25 178.88 3fgw h GLY 124 N 0.24 0.80 0.88 0.00 0.00 -1.42 -3.16 103.07 100.41 3fgw h GLY 124 Ca 0.26 -1.27 -0.02 0.00 0.00 0.00 0.00 47.33 46.30 3fgw h GLY 124 CO -0.05 1.13 -0.18 -2.08 0.00 0.00 0.00 176.54 175.36 3fgw h VAL 125 N 0.42 0.63 -0.65 4.60 2.07 -0.76 -2.42 116.25 120.15 3fgw h VAL 125 Ca -0.09 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3fgw h VAL 125 Cb 1.54 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 3fgw h VAL 125 CO 0.18 0.05 0.29 -0.37 0.02 0.00 0.00 177.57 177.74 3fgw h VAL 126 N -0.64 1.22 -0.11 2.57 -1.51 -1.25 -2.27 116.25 114.26 3fgw h VAL 126 Ca -0.05 -0.64 -0.00 0.00 -1.23 0.00 0.00 66.70 64.77 3fgw h VAL 126 Cb 0.46 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 30.02 3fgw h VAL 126 CO 0.09 0.26 0.06 -0.08 -1.23 0.00 0.00 177.57 176.67 3fgw h GLU 127 N 0.93 0.16 -0.74 5.19 4.81 -1.54 -2.57 114.58 120.81 3fgw h GLU 127 Ca 0.22 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 3fgw h GLU 127 Cb 0.13 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3fgw h GLU 127 CO -0.03 0.20 0.44 0.00 -0.73 0.00 0.00 179.01 178.90 3fgw h ALA 128 N 0.94 1.38 -0.42 2.92 0.00 -1.19 -2.21 119.26 120.69 3fgw h ALA 128 Ca 0.04 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 3fgw h ALA 128 Cb 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3fgw h ALA 128 CO -0.01 0.53 -0.32 0.77 0.00 0.00 0.00 179.25 180.23 3fgw h SER 129 N 1.02 0.99 1.48 0.00 0.02 -1.29 -1.53 113.55 114.25 3fgw h SER 129 Ca 0.27 -0.42 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 3fgw h SER 129 Cb -0.03 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.23 3fgw h SER 129 CO -0.05 1.21 -0.12 -0.37 -1.14 0.00 0.00 176.83 176.37 3fgw h VAL 130 N 0.79 0.23 0.00 2.27 -1.51 -1.32 -3.34 116.25 113.37 3fgw h VAL 130 Ca 0.08 -1.09 -0.01 0.00 -1.23 0.00 0.00 66.70 64.45 3fgw h VAL 130 Cb 0.90 1.90 -0.02 0.00 -2.13 0.00 0.00 31.29 31.94 3fgw h VAL 130 CO 0.08 0.12 -0.36 -1.54 -1.23 0.00 0.00 177.57 174.64 3fgw n SER 131 N -3.17 1.82 -0.16 4.19 3.41 -0.84 -4.76 113.62 114.12 3fgw n SER 131 Ca 0.02 -3.42 -0.12 0.00 -0.26 0.00 0.00 58.87 55.09 3fgw n SER 131 Cb 0.49 -0.47 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 3fgw n SER 131 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3fgw h GLU 132 N 0.60 -0.33 -0.58 4.33 5.08 -1.42 -1.50 114.58 120.77 3fgw h GLU 132 Ca -0.01 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3fgw h GLU 132 Cb 1.07 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 3fgw h GLU 132 CO 0.01 -0.22 0.22 0.93 -1.00 0.00 0.00 179.01 178.95 3fgw h GLU 133 N -0.34 0.88 -0.56 2.33 3.07 -1.90 -1.32 114.58 116.74 3fgw h GLU 133 Ca 0.11 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 58.79 3fgw h GLU 133 Cb 0.58 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 3fgw h GLU 133 CO -0.62 0.76 0.29 -0.07 -1.40 0.00 0.00 179.01 177.97 3fgw h LEU 134 N 0.81 0.72 -0.41 1.33 3.38 -1.89 0.91 115.31 120.16 3fgw h LEU 134 Ca 0.19 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.09 3fgw h LEU 134 Cb 0.22 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3fgw h LEU 134 CO -0.01 0.63 0.19 0.40 0.09 0.00 0.00 178.44 179.74 3fgw h ILE 135 N 0.76 0.96 -0.11 1.22 2.04 -0.99 0.16 117.51 121.55 3fgw h ILE 135 Ca 0.20 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.94 3fgw h ILE 135 Cb 0.08 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3fgw h ILE 135 CO -0.03 0.07 0.00 0.22 0.00 0.00 0.00 178.15 178.42 3fgw h TYR 136 N 0.40 0.00 -0.22 1.37 3.20 -0.72 -0.06 116.97 120.93 3fgw h TYR 136 Ca 0.18 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 3fgw h TYR 136 Cb 0.10 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 3fgw h TYR 136 CO -0.11 -0.01 0.07 0.52 -1.64 0.00 0.00 178.16 176.99 3fgw h MET 137 N 0.04 0.35 -0.65 1.82 2.86 -0.60 -0.72 114.93 118.04 3fgw h MET 137 Ca 0.05 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3fgw h MET 137 Cb 0.05 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 3fgw h MET 137 CO -0.08 0.44 0.39 1.25 1.06 0.00 0.00 176.91 179.96 3fgw h HIS 138 N 0.19 0.86 -0.57 -0.22 -0.00 -0.61 -0.17 115.15 114.63 3fgw h HIS 138 Ca 0.07 -0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.47 3fgw h HIS 138 Cb 0.23 -0.28 -0.04 0.00 -0.00 0.00 0.00 27.41 27.32 3fgw h HIS 138 CO 0.00 0.59 0.33 2.35 -0.00 0.00 0.00 177.93 181.20 3fgw h TRP 139 N 0.88 0.61 0.00 5.26 2.91 -0.90 -1.04 115.95 123.66 3fgw h TRP 139 Ca 0.23 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.23 3fgw h TRP 139 Cb -0.02 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.44 3fgw h TRP 139 CO -0.02 0.33 -0.19 0.52 -1.03 0.00 0.00 178.44 178.05 3fgw h MET 140 N 0.64 0.00 0.02 2.65 2.86 -0.34 -2.24 114.93 118.53 3fgw h MET 140 Ca 0.24 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.57 3fgw h MET 140 Cb 0.07 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.69 3fgw h MET 140 CO -0.13 0.19 -1.77 0.09 1.06 0.00 0.00 176.91 176.35 3fgw n ASN 141 N -3.47 1.10 -0.01 1.22 5.03 -0.15 -4.66 115.26 114.34 3fgw n ASN 141 Ca -0.01 0.37 -0.01 0.00 0.87 0.00 0.00 54.58 55.81 3fgw n ASN 141 Cb 0.36 -0.20 -0.00 0.00 -1.02 0.00 0.00 39.78 38.91 3fgw n ASN 141 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3fgw n THR 142 N -3.12 0.13 -2.08 3.41 -2.24 -0.42 -4.86 114.28 105.08 3fgw n THR 142 Ca -0.20 0.41 -0.18 0.00 -2.27 0.00 0.00 64.05 61.81 3fgw n THR 142 Cb 1.05 -1.50 0.04 0.00 -2.10 0.00 0.00 70.33 67.82 3fgw n THR 142 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3fgw n VAL 143 N -2.66 2.33 -0.05 2.28 0.24 -1.08 -4.80 118.33 114.58 3fgw n VAL 143 Ca -0.01 -3.95 -0.16 0.00 -2.04 0.00 0.00 64.34 58.18 3fgw n VAL 143 Cb 0.04 -0.76 -0.07 0.00 -1.47 0.00 0.00 33.84 31.58 3fgw n VAL 143 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 3fgw h VAL 144 N 2.52 1.31 -0.48 3.34 3.04 -1.68 -3.32 116.25 120.98 3fgw h VAL 144 Ca 0.27 -1.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.18 3fgw h VAL 144 Cb 1.47 1.91 0.00 0.00 -2.01 0.00 0.00 31.29 32.66 3fgw h VAL 144 CO 0.62 0.56 0.00 0.59 -1.01 0.00 0.00 177.57 178.33 3fgw n ASN 145 N -4.11 3.30 -4.65 3.17 4.13 -1.26 -4.84 115.26 111.00 3fgw n ASN 145 Ca -0.06 -1.99 -0.42 0.00 1.68 0.00 0.00 54.58 53.78 3fgw n ASN 145 Cb 0.63 -0.32 -0.03 0.00 -1.54 0.00 0.00 39.78 38.52 3fgw n ASN 145 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 3fgw s TYR 146 N -1.01 1.99 -1.31 3.10 5.04 -1.25 -2.63 117.35 121.28 3fgw s TYR 146 Ca 0.33 0.31 -0.13 0.00 -2.44 0.00 0.00 57.07 55.14 3fgw s TYR 146 Cb 0.17 -3.93 0.01 0.00 0.35 0.00 0.00 41.96 38.56 3fgw s TYR 146 CO 0.22 -3.60 0.52 0.00 -1.34 0.00 0.00 175.55 171.35 3fgw n GLY 148 N -2.00 -1.59 0.22 0.00 0.00 -1.08 -4.87 105.19 95.87 3fgw n GLY 148 Ca -0.21 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.18 3fgw n GLY 148 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3fgw n PRO 149 N -1.98 0.52 0.00 1.61 -0.02 -1.26 -2.89 135.00 130.98 3fgw n PRO 149 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 3fgw n PRO 149 Cb 0.16 -1.11 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 3fgw n PRO 149 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3fgw n PHE 150 N -0.18 0.00 -1.20 6.00 3.72 -1.26 -5.10 117.46 119.45 3fgw n PHE 150 Ca 0.00 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 56.93 3fgw n PHE 150 Cb 0.06 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.53 3fgw n PHE 150 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3fgw n GLU 151 N -0.49 0.00 -0.20 -1.08 4.07 -1.14 -4.82 120.64 116.98 3fgw n GLU 151 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 3fgw n GLU 151 Cb 0.00 -1.13 0.06 0.00 -0.06 0.00 0.00 31.44 30.31 3fgw n GLU 151 CO 0.00 0.00 0.00 -0.92 -0.06 0.00 0.00 177.13 176.15 3fgw h TYR 152 N 2.80 0.63 -0.92 4.31 3.20 -1.98 -3.27 116.97 121.75 3fgw h TYR 152 Ca -0.37 0.02 -0.73 0.00 3.14 0.00 0.00 58.73 60.80 3fgw h TYR 152 Cb 1.06 -0.20 -0.11 0.00 1.54 0.00 0.00 36.73 39.02 3fgw h TYR 152 CO 0.45 0.34 2.37 -1.91 -1.64 0.00 0.00 178.16 177.77 3fgw n GLU 153 N -4.78 3.28 0.29 1.82 2.13 -1.26 -4.74 120.64 117.37 3fgw n GLU 153 Ca 0.06 -3.20 0.18 0.00 0.66 0.00 0.00 57.16 54.85 3fgw n GLU 153 Cb 0.11 -3.13 0.80 0.00 0.27 0.00 0.00 31.44 29.49 3fgw n GLU 153 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 3fgw h VAL 154 N 4.11 0.04 -0.03 6.31 3.04 -1.94 -2.56 116.25 125.23 3fgw h VAL 154 Ca 0.46 -0.42 -0.01 0.00 -1.01 0.00 0.00 66.70 65.71 3fgw h VAL 154 Cb 0.68 1.40 -0.00 0.00 -2.01 0.00 0.00 31.29 31.36 3fgw h VAL 154 CO 1.66 0.01 -0.02 1.23 -1.01 0.00 0.00 177.57 179.44 3fgw h GLY 155 N 1.55 0.07 0.91 3.17 0.00 -1.93 -3.13 103.07 103.72 3fgw h GLY 155 Ca -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 3fgw h GLY 155 CO 0.00 0.06 0.06 -1.82 0.00 0.00 0.00 176.54 174.84 3fgw h TYR 156 N -0.37 0.16 -0.31 5.60 3.20 -1.77 -2.75 116.97 120.74 3fgw h TYR 156 Ca 0.01 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 3fgw h TYR 156 Cb 0.49 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3fgw h TYR 156 CO 0.08 0.21 0.02 0.00 -1.64 0.00 0.00 178.16 176.84 3fgw h GLU 158 N 0.44 0.51 -0.46 0.00 4.57 -1.54 -1.22 114.58 116.88 3fgw h GLU 158 Ca 0.10 -0.12 -0.05 0.00 -1.18 0.00 0.00 59.36 58.11 3fgw h GLU 158 Cb 0.26 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 3fgw h GLU 158 CO 0.00 0.57 0.08 0.87 -1.18 0.00 0.00 179.01 179.36 3fgw h LYS 159 N 0.35 0.71 -0.16 1.92 1.57 -0.96 -1.31 116.57 118.70 3fgw h LYS 159 Ca 0.10 -0.14 -0.20 0.00 -1.87 0.00 0.00 60.65 58.54 3fgw h LYS 159 Cb 0.29 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3fgw h LYS 159 CO 0.00 0.66 -0.70 1.25 -0.57 0.00 0.00 179.45 180.09 3fgw h LEU 160 N 0.68 0.79 -0.72 2.94 5.85 -0.80 -0.99 115.31 123.06 3fgw h LEU 160 Ca 0.15 -0.49 -0.05 0.00 0.84 0.00 0.00 57.88 58.33 3fgw h LEU 160 Cb 0.30 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3fgw h LEU 160 CO 0.00 1.26 0.27 0.50 -0.34 0.00 0.00 178.44 180.13 3fgw h LYS 161 N 0.48 1.09 -0.26 1.25 1.63 -0.97 -1.76 116.57 118.03 3fgw h LYS 161 Ca -0.03 -0.21 -0.08 0.00 -0.85 0.00 0.00 60.65 59.48 3fgw h LYS 161 Cb 1.30 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.76 3fgw h LYS 161 CO 0.14 0.91 -0.17 -0.91 -3.45 0.00 0.00 179.45 175.97 3fgw h ASN 162 N 1.04 0.60 -0.19 4.20 2.35 -1.22 -2.48 115.58 119.88 3fgw h ASN 162 Ca 0.24 -0.43 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 3fgw h ASN 162 Cb 0.24 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 3fgw h ASN 162 CO -0.02 0.90 0.09 0.15 -1.65 0.00 0.00 177.43 176.90 3fgw h PHE 163 N 0.29 0.16 -0.29 1.19 3.57 -1.07 -1.03 116.94 119.76 3fgw h PHE 163 Ca 0.05 0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.38 3fgw h PHE 163 Cb 0.70 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.39 3fgw h PHE 163 CO 0.07 0.09 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.64 3fgw h LEU 164 N 0.19 0.96 -0.52 0.59 3.38 -1.38 0.25 115.31 118.79 3fgw h LEU 164 Ca 0.08 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 3fgw h LEU 164 Cb 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3fgw h LEU 164 CO -0.06 1.31 0.22 -0.33 0.09 0.00 0.00 178.44 179.68 3fgw h GLU 165 N 0.65 0.77 -0.51 1.13 5.08 -1.43 0.11 114.58 120.38 3fgw h GLU 165 Ca 0.02 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.17 3fgw h GLU 165 Cb 1.13 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 3fgw h GLU 165 CO 0.12 0.66 -0.00 0.00 -1.00 0.00 0.00 179.01 178.79 3fgw h ALA 166 N 1.07 1.04 -0.04 3.43 0.00 -1.11 -1.82 119.26 121.83 3fgw h ALA 166 Ca 0.18 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3fgw h ALA 166 Cb 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3fgw h ALA 166 CO -0.02 0.60 -0.02 -0.97 0.00 0.00 0.00 179.25 178.84 3fgw h ASN 167 N 0.80 0.08 -0.87 0.00 -1.24 -0.69 -1.42 115.58 112.24 3fgw h ASN 167 Ca 0.15 -0.41 -0.02 0.00 0.71 0.00 0.00 56.30 56.74 3fgw h ASN 167 Cb 0.48 -0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.47 3fgw h ASN 167 CO 0.02 0.47 0.48 -0.07 -1.29 0.00 0.00 177.43 177.04 3fgw h LEU 168 N -0.31 1.09 -0.63 0.34 3.38 -0.78 -2.07 115.31 116.33 3fgw h LEU 168 Ca 0.01 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3fgw h LEU 168 Cb 0.44 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3fgw h LEU 168 CO 0.01 0.87 0.12 -0.08 0.09 0.00 0.00 178.44 179.45 3fgw h GLU 169 N 1.22 1.03 -0.85 1.13 4.81 -1.35 -1.94 114.58 118.62 3fgw h GLU 169 Ca 0.31 -0.26 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3fgw h GLU 169 Cb 0.03 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 3fgw h GLU 169 CO -0.05 0.95 0.55 2.35 -0.73 0.00 0.00 179.01 182.07 3fgw h TRP 170 N 0.94 1.02 -0.58 0.92 7.01 -0.81 -1.37 115.95 123.09 3fgw h TRP 170 Ca 0.19 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.19 3fgw h TRP 170 Cb 0.40 -0.34 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 3fgw h TRP 170 CO 0.03 0.59 0.24 0.52 -2.79 0.00 0.00 178.44 177.03 3fgw h MET 171 N 1.06 0.86 -0.81 2.65 2.86 -1.17 -2.24 114.93 118.15 3fgw h MET 171 Ca 0.34 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.85 3fgw h MET 171 Cb 0.01 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.49 3fgw h MET 171 CO -0.12 0.74 0.53 1.96 1.06 0.00 0.00 176.91 181.08 3fgw h GLN 172 N 0.80 1.03 -0.46 1.72 1.08 -0.72 -1.73 115.11 116.81 3fgw h GLN 172 Ca 0.19 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.28 3fgw h GLN 172 Cb 0.19 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.37 3fgw h GLN 172 CO -0.02 0.68 0.07 -0.09 -0.95 0.00 0.00 178.83 178.53 3fgw h ARG 173 N 1.06 0.76 -0.88 1.46 2.43 -1.15 -1.80 114.38 116.26 3fgw h ARG 173 Ca 0.31 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3fgw h ARG 173 Cb -0.07 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 3fgw h ARG 173 CO -0.08 0.78 0.58 0.93 -1.51 0.00 0.00 179.97 180.67 3fgw h GLU 174 N 0.63 1.15 -0.63 0.20 4.39 -1.02 0.70 114.58 120.00 3fgw h GLU 174 Ca 0.14 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 3fgw h GLU 174 Cb 0.39 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 3fgw h GLU 174 CO 0.01 0.76 0.32 0.52 -1.16 0.00 0.00 179.01 179.46 3fgw h MET 175 N 1.18 0.89 0.00 2.33 2.86 -1.22 -1.17 114.93 119.80 3fgw h MET 175 Ca 0.33 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.77 3fgw h MET 175 Cb -0.12 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.37 3fgw h MET 175 CO -0.08 0.70 -0.37 1.49 1.06 0.00 0.00 176.91 179.71 3fgw h GLU 176 N 0.86 0.00 -0.00 1.72 4.81 -0.40 -2.89 114.58 118.68 3fgw h GLU 176 Ca 0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3fgw h GLU 176 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 3fgw h GLU 176 CO -0.03 0.37 -0.68 1.28 -0.73 0.00 0.00 179.01 179.21 3fgw n LEU 177 N -3.89 0.86 -3.20 1.64 4.77 0.14 -4.58 117.00 112.75 3fgw n LEU 177 Ca -0.01 -0.28 -0.23 0.00 -0.03 0.00 0.00 56.01 55.46 3fgw n LEU 177 Cb 0.43 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.35 3fgw n LEU 177 CO 0.38 0.20 -0.18 0.59 -1.33 0.00 0.00 177.39 177.04 3fgw n ASN 178 N -1.32 1.29 0.14 -1.43 3.02 -0.46 -4.95 115.26 111.54 3fgw n ASN 178 Ca 0.06 -2.99 0.13 0.00 -0.03 0.00 0.00 54.58 51.74 3fgw n ASN 178 Cb 0.34 -0.63 0.49 0.00 -0.61 0.00 0.00 39.78 39.37 3fgw n ASN 178 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3fgw h PRO 179 N 3.60 0.00 -0.02 3.52 0.11 -1.80 -2.97 132.00 134.44 3fgw h PRO 179 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3fgw h PRO 179 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3fgw h PRO 179 CO 0.56 0.00 -0.16 -0.25 -0.21 0.00 0.00 178.00 177.93 3fgw n ASP 180 N -2.32 2.35 -4.68 -2.05 9.92 -1.26 -4.71 116.55 113.80 3fgw n ASP 180 Ca 0.03 -1.68 -0.41 0.00 -0.53 0.00 0.00 54.79 52.20 3fgw n ASP 180 Cb 0.28 0.19 -0.05 0.00 -0.64 0.00 0.00 41.12 40.90 3fgw n ASP 180 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 3fgw s SER 181 N -1.90 6.91 0.14 -2.24 1.04 -1.12 -4.72 113.70 111.80 3fgw s SER 181 Ca 0.21 1.11 -0.19 0.00 0.48 0.00 0.00 55.95 57.55 3fgw s SER 181 Cb 0.16 -2.42 -0.00 0.00 0.10 0.00 0.00 66.02 63.86 3fgw s SER 181 CO 0.35 -0.30 1.70 -0.65 0.98 0.00 0.00 173.24 175.31 3fgw h PRO 182 N 7.22 -0.00 -0.42 4.02 0.11 -1.91 -1.87 132.00 139.15 3fgw h PRO 182 Ca -0.33 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.85 3fgw h PRO 182 Cb 1.15 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 3fgw h PRO 182 CO 0.80 -0.00 0.10 -0.92 -0.21 0.00 0.00 178.00 177.77 3fgw h TYR 183 N -0.00 0.16 0.00 0.65 3.20 -1.94 0.30 116.97 119.35 3fgw h TYR 183 Ca 0.11 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 3fgw h TYR 183 Cb 0.18 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 3fgw h TYR 183 CO -0.25 0.03 -0.07 -1.49 -1.64 0.00 0.00 178.16 174.75 3fgw h TRP 184 N 0.24 0.00 -0.54 -3.82 4.06 -1.88 -2.39 115.95 111.61 3fgw h TRP 184 Ca 0.21 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.05 3fgw h TRP 184 Cb 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.38 3fgw h TRP 184 CO -0.20 0.07 -0.08 1.25 -3.56 0.00 0.00 178.44 175.91 3fgw h HIS 185 N 0.00 1.11 -0.25 0.49 -0.00 -0.43 -2.42 115.15 113.64 3fgw h HIS 185 Ca -0.00 -0.22 -0.11 0.00 -0.00 0.00 0.00 60.37 60.04 3fgw h HIS 185 Cb 0.89 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 28.01 3fgw h HIS 185 CO 0.00 1.02 -0.32 1.96 -0.00 0.00 0.00 177.93 180.59 3fgw h GLN 186 N 0.90 0.53 -0.35 5.26 1.08 -0.54 -2.39 115.11 119.60 3fgw h GLN 186 Ca 0.15 -0.23 -0.12 0.00 -1.45 0.00 0.00 58.65 56.99 3fgw h GLN 186 Cb 0.64 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 3fgw h GLN 186 CO 0.04 0.78 -0.27 0.28 -0.95 0.00 0.00 178.83 178.72 3fgw h VAL 187 N 0.45 1.29 -0.73 -0.54 2.07 -1.43 -2.88 116.25 114.48 3fgw h VAL 187 Ca 0.05 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.15 3fgw h VAL 187 Cb 0.77 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 3fgw h VAL 187 CO 0.06 0.47 0.44 -0.09 0.02 0.00 0.00 177.57 178.47 3fgw h ARG 188 N 0.57 0.99 -0.54 1.57 2.43 -1.30 0.12 114.38 118.22 3fgw h ARG 188 Ca 0.06 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3fgw h ARG 188 Cb 0.83 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 3fgw h ARG 188 CO 0.07 0.70 0.33 -0.07 -1.51 0.00 0.00 179.97 179.48 3fgw h LEU 189 N 0.99 0.53 -0.29 3.80 3.38 -1.44 0.33 115.31 122.61 3fgw h LEU 189 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3fgw h LEU 189 Cb -0.04 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3fgw h LEU 189 CO -0.05 0.37 0.19 0.74 0.09 0.00 0.00 178.44 179.78 3fgw h THR 190 N 0.65 1.09 -0.14 0.22 2.02 -1.21 -1.53 112.91 114.02 3fgw h THR 190 Ca 0.22 -0.20 -0.13 0.00 0.77 0.00 0.00 66.41 67.07 3fgw h THR 190 Cb 0.02 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3fgw h THR 190 CO -0.10 0.09 -0.48 -0.07 0.37 0.00 0.00 175.52 175.33 3fgw h LEU 191 N 0.38 0.38 -0.97 2.58 3.38 -0.63 -2.51 115.31 117.92 3fgw h LEU 191 Ca 0.11 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 3fgw h LEU 191 Cb -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3fgw h LEU 191 CO -0.02 0.81 0.01 -0.07 0.09 0.00 0.00 178.44 179.26 3fgw h LEU 192 N 0.28 0.72 -0.57 1.67 3.38 -0.21 -0.65 115.31 119.93 3fgw h LEU 192 Ca 0.01 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 3fgw h LEU 192 Cb 0.96 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 3fgw h LEU 192 CO 0.08 0.78 0.05 -0.61 0.09 0.00 0.00 178.44 178.83 3fgw h GLN 193 N 0.71 0.97 -0.57 1.13 4.15 -1.03 0.67 115.11 121.13 3fgw h GLN 193 Ca 0.14 -0.28 -0.06 0.00 0.77 0.00 0.00 58.65 59.22 3fgw h GLN 193 Cb 0.42 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 3fgw h GLN 193 CO 0.02 0.95 0.11 1.25 -1.93 0.00 0.00 178.83 179.22 3fgw h LEU 194 N 0.86 0.85 -0.31 -2.39 5.85 -1.25 -0.70 115.31 118.22 3fgw h LEU 194 Ca 0.17 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3fgw h LEU 194 Cb 0.48 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3fgw h LEU 194 CO 0.02 0.85 0.18 0.50 -0.34 0.00 0.00 178.44 179.65 3fgw h LYS 195 N 0.86 0.42 0.11 1.25 3.11 -0.70 -2.19 116.57 119.43 3fgw h LYS 195 Ca 0.18 -0.04 0.01 0.00 -2.81 0.00 0.00 60.65 57.99 3fgw h LYS 195 Cb 0.36 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.48 3fgw h LYS 195 CO 0.00 0.33 -0.13 0.78 -2.81 0.00 0.00 179.45 177.62 3fgw h GLY 196 N 0.39 -0.25 -0.18 5.01 0.00 -0.54 0.13 103.07 107.63 3fgw h GLY 196 Ca 0.11 0.15 0.10 0.00 0.00 0.00 0.00 47.33 47.70 3fgw h GLY 196 CO -0.02 -0.13 -0.22 -2.00 0.00 0.00 0.00 176.54 174.16 3fgw h LEU 197 N -0.28 -0.77 0.40 3.11 5.85 -1.06 -0.03 115.31 122.53 3fgw h LEU 197 Ca 0.01 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 3fgw h LEU 197 Cb 0.28 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3fgw h LEU 197 CO -0.06 -0.25 -0.19 -0.08 -0.34 0.00 0.00 178.44 177.52 3fgw h GLU 198 N -0.10 -0.52 -0.73 1.25 4.81 -1.13 -2.34 114.58 115.81 3fgw h GLU 198 Ca 0.24 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.58 3fgw h GLU 198 Cb 0.48 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.93 3fgw h GLU 198 CO -0.58 -0.22 0.48 -0.44 -0.73 0.00 0.00 179.01 177.52 3fgw h ASP 199 N -0.82 0.65 -0.21 1.04 3.32 -0.84 -0.68 116.42 118.88 3fgw h ASP 199 Ca -0.06 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 3fgw h ASP 199 Cb 0.54 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3fgw h ASP 199 CO 0.09 0.41 -0.10 -1.28 -1.72 0.00 0.00 179.24 176.64 3fgw h SER 200 N 0.73 0.45 -0.17 6.45 0.87 -0.99 -0.85 113.55 120.04 3fgw h SER 200 Ca 0.32 -0.41 -0.03 0.00 -1.23 0.00 0.00 61.79 60.44 3fgw h SER 200 Cb 0.32 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 3fgw h SER 200 CO -0.11 0.76 0.02 0.22 -0.53 0.00 0.00 176.83 177.19 3fgw h TYR 201 N 0.15 0.41 0.00 2.24 3.20 -0.98 -1.44 116.97 120.55 3fgw h TYR 201 Ca 0.05 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3fgw h TYR 201 Cb 0.59 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3fgw h TYR 201 CO 0.06 0.40 0.00 0.39 -1.64 0.00 0.00 178.16 177.38 3fgw n GLU 202 N -4.34 0.19 -1.21 1.82 1.02 -0.30 -4.95 120.64 112.88 3fgw n GLU 202 Ca 0.01 0.18 -0.04 0.00 -0.02 0.00 0.00 57.16 57.28 3fgw n GLU 202 Cb 0.20 -1.73 -0.02 0.00 -0.02 0.00 0.00 31.44 29.87 3fgw n GLU 202 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fgw n GLY 203 N 1.26 0.66 2.59 0.62 0.00 -0.39 -5.00 105.19 104.92 3fgw n GLY 203 Ca 0.06 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 3fgw n GLY 203 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fgw s ARG 204 N -2.52 0.62 0.33 1.61 0.52 -0.81 -5.03 118.95 113.66 3fgw s ARG 204 Ca 0.00 -1.18 -0.27 0.00 -0.52 0.00 0.00 55.73 53.76 3fgw s ARG 204 Cb 0.00 -1.59 -0.09 0.00 0.52 0.00 0.00 34.95 33.79 3fgw s ARG 204 CO 0.00 -1.10 1.08 -0.51 0.02 0.00 0.00 175.30 174.79 3fgw s LEU 205 N 1.34 4.38 -0.40 2.53 1.02 -1.26 -4.73 118.68 121.56 3fgw s LEU 205 Ca 0.14 2.19 0.03 0.00 0.02 0.00 0.00 54.13 56.51 3fgw s LEU 205 Cb -0.20 -3.85 0.18 0.00 0.02 0.00 0.00 46.19 42.34 3fgw s LEU 205 CO -0.15 -0.30 0.76 0.28 0.02 0.00 0.00 176.35 176.97 3fgw s THR 206 N -1.35 -0.78 -0.28 5.49 -1.32 -1.26 -4.97 115.64 111.17 3fgw s THR 206 Ca 0.50 -0.13 -0.29 0.00 -1.21 0.00 0.00 61.69 60.56 3fgw s THR 206 Cb -0.28 0.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.70 3fgw s THR 206 CO 0.36 0.00 1.47 0.12 -2.21 0.00 0.00 174.62 174.36 3fgw s PHE 207 N 1.71 2.37 0.01 9.09 5.36 -1.26 -4.99 117.98 130.28 3fgw s PHE 207 Ca 0.18 0.70 -0.30 0.00 -0.96 0.00 0.00 56.93 56.55 3fgw s PHE 207 Cb -0.01 -3.98 -0.04 0.00 -0.34 0.00 0.00 43.02 38.65 3fgw s PHE 207 CO -0.09 -2.32 1.11 -1.25 -1.46 0.00 0.00 175.22 171.21 3fgw s PRO 208 N 4.51 4.46 0.03 10.12 0.04 -1.26 -4.94 135.00 147.95 3fgw s PRO 208 Ca 0.64 1.61 0.08 0.00 0.04 0.00 0.00 61.00 63.37 3fgw s PRO 208 Cb -0.20 -3.44 -0.23 0.00 0.04 0.00 0.00 34.50 30.67 3fgw s PRO 208 CO 0.27 -0.23 0.93 1.15 0.04 0.00 0.00 177.00 179.16 3fgw h THR 209 N 4.74 1.23 0.00 1.26 2.02 -2.03 -3.48 112.91 116.66 3fgw h THR 209 Ca -0.39 -3.00 0.00 0.00 0.77 0.00 0.00 66.41 63.79 3fgw h THR 209 Cb 1.20 2.64 0.00 0.00 -1.74 0.00 0.00 68.15 70.25 3fgw h THR 209 CO 0.81 0.73 0.00 0.61 0.37 0.00 0.00 175.52 178.04 3fgw n GLY 210 N 1.49 2.15 3.79 2.16 0.00 -1.26 -5.12 105.19 108.40 3fgw n GLY 210 Ca -0.10 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 3fgw n GLY 210 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fgw s ARG 211 N 2.59 3.92 0.04 1.61 3.52 -1.26 -5.07 118.95 124.30 3fgw s ARG 211 Ca 0.00 1.48 -0.16 0.00 -0.13 0.00 0.00 55.73 56.92 3fgw s ARG 211 Cb 0.00 -2.30 0.03 0.00 -1.56 0.00 0.00 34.95 31.12 3fgw s ARG 211 CO 0.00 -0.35 0.35 -0.59 -0.81 0.00 0.00 175.30 173.90 3fgw s PHE 212 N -1.80 -0.18 -0.19 5.12 -0.12 -1.26 -4.97 117.98 114.58 3fgw s PHE 212 Ca 0.63 0.12 -0.06 0.00 -0.05 0.00 0.00 56.93 57.58 3fgw s PHE 212 Cb -0.20 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.30 3fgw s PHE 212 CO 0.25 -0.52 0.03 0.99 -0.05 0.00 0.00 175.22 175.92 3fgw s THR 213 N -2.36 4.31 -0.21 -4.49 2.01 -1.26 -5.02 115.64 108.62 3fgw s THR 213 Ca -0.06 -0.20 -0.09 0.00 0.31 0.00 0.00 61.69 61.65 3fgw s THR 213 Cb -0.01 -2.94 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 3fgw s THR 213 CO -0.02 0.44 0.11 -0.63 -0.69 0.00 0.00 174.62 173.83 3fgw s ILE 214 N 0.71 5.05 -0.03 1.82 1.01 -1.26 -5.07 121.20 123.44 3fgw s ILE 214 Ca 0.01 0.07 -0.30 0.00 0.00 0.00 0.00 60.65 60.43 3fgw s ILE 214 Cb -0.14 -3.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 3fgw s ILE 214 CO 0.02 0.40 1.51 -0.75 0.00 0.00 0.00 174.94 176.12 3fgw s LYS 215 N 0.74 4.23 0.24 2.79 2.20 -1.26 -4.93 119.74 123.74 3fgw s LYS 215 Ca 0.06 2.06 -0.06 0.00 -0.36 0.00 0.00 55.97 57.68 3fgw s LYS 215 Cb -0.13 -3.74 0.41 0.00 -1.51 0.00 0.00 37.83 32.87 3fgw s LYS 215 CO 0.02 -0.71 1.72 -1.35 -0.36 0.00 0.00 175.35 174.68 3fgw h PRO 216 N 8.53 0.39 -0.36 4.03 0.11 -1.95 -2.71 132.00 140.03 3fgw h PRO 216 Ca -0.38 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.54 3fgw h PRO 216 Cb 1.17 -0.09 -0.10 0.00 0.11 0.00 0.00 31.00 32.09 3fgw h PRO 216 CO 0.93 0.26 -0.04 1.28 -0.21 0.00 0.00 178.00 180.22 3fgw n LEU 217 N -5.03 4.19 0.00 2.35 4.32 -1.26 -4.39 117.00 117.18 3fgw n LEU 217 Ca 0.13 -3.67 0.00 0.00 -0.02 0.00 0.00 56.01 52.44 3fgw n LEU 217 Cb 0.39 -0.63 0.00 0.00 -1.62 0.00 0.00 43.42 41.56 3fgw n LEU 217 CO 0.18 1.18 0.00 0.61 -1.22 0.00 0.00 177.39 178.14 3fgw n GLY 218 N -1.05 0.85 0.00 -0.72 0.00 -1.02 -4.83 105.19 98.41 3fgw n GLY 218 Ca 0.33 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3fgw n GLY 218 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3fgw n PHE 219 N 0.00 0.00 -0.03 1.61 3.72 -1.26 -3.22 117.46 118.28 3fgw n PHE 219 Ca 0.00 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.23 3fgw n PHE 219 Cb 0.00 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 3fgw n PHE 219 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3fgw h LEU 220 N 0.00 0.89 0.00 4.37 5.85 -1.81 -3.22 115.31 121.39 3fgw h LEU 220 Ca 0.00 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 58.11 3fgw h LEU 220 Cb 0.00 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.77 3fgw h LEU 220 CO 0.00 1.35 0.00 0.00 -0.34 0.00 0.00 178.44 179.45 3fgw n LEU 221 N -4.02 0.00 0.07 2.25 -0.00 -1.20 -0.54 117.00 113.56 3fgw n LEU 221 Ca -0.07 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 55.91 3fgw n LEU 221 Cb 0.69 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 44.04 3fgw n LEU 221 CO 0.51 0.00 0.07 -0.07 -0.00 0.00 0.00 177.39 177.90 3fgw h LEU 222 N 0.00 0.00 0.07 1.47 3.38 -1.77 -3.29 115.31 115.16 3fgw h LEU 222 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 3fgw h LEU 222 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3fgw h LEU 222 CO 0.00 0.78 -1.92 0.00 0.09 0.00 0.00 178.44 177.39 3fgw n GLN 223 N -3.19 0.71 -0.16 1.13 1.13 0.28 -4.13 117.38 113.14 3fgw n GLN 223 Ca -0.04 0.26 0.07 0.00 -1.94 0.00 0.00 57.00 55.36 3fgw n GLN 223 Cb 0.88 -1.73 0.21 0.00 0.11 0.00 0.00 30.24 29.71 3fgw n GLN 223 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 3fgw n ILE 224 N -3.29 0.43 -0.28 5.09 -5.35 0.30 -4.36 119.36 111.90 3fgw n ILE 224 Ca -0.27 -0.46 0.10 0.00 -0.27 0.00 0.00 62.75 61.85 3fgw n ILE 224 Cb 1.05 0.28 0.24 0.00 -1.74 0.00 0.00 39.64 39.47 3fgw n ILE 224 CO 0.00 0.00 0.00 -1.28 -1.76 0.00 0.00 176.55 173.51 3fgw h SER 225 N 2.18 -0.05 -0.04 7.28 0.87 -1.72 0.33 113.55 122.40 3fgw h SER 225 Ca 0.00 0.18 -0.24 0.00 -1.23 0.00 0.00 61.79 60.51 3fgw h SER 225 Cb 0.49 0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.73 3fgw h SER 225 CO 0.00 -0.13 -0.87 1.23 -0.53 0.00 0.00 176.83 176.53 3fgw h GLY 226 N 0.21 0.79 2.00 5.77 0.00 -1.90 -3.22 103.07 106.72 3fgw h GLY 226 Ca 0.50 -1.22 -0.02 0.00 0.00 0.00 0.00 47.33 46.59 3fgw h GLY 226 CO -0.62 1.08 -0.10 -0.55 0.00 0.00 0.00 176.54 176.35 3fgw h ASP 227 N 0.46 0.00 0.74 0.19 3.32 -1.29 -3.01 116.42 116.83 3fgw h ASP 227 Ca -0.08 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 3fgw h ASP 227 Cb 1.51 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.05 3fgw h ASP 227 CO 0.17 0.10 -0.24 -0.07 -1.72 0.00 0.00 179.24 177.49 3fgw h LEU 228 N 0.00 0.00 -2.17 1.55 3.38 -0.45 -2.57 115.31 115.05 3fgw h LEU 228 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fgw h LEU 228 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3fgw h LEU 228 CO 0.01 0.24 0.00 -0.33 0.09 0.00 0.00 178.44 178.45 3fgw h GLU 229 N 0.00 0.00 0.00 1.13 5.08 -1.67 -2.49 114.58 116.63 3fgw h GLU 229 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 3fgw h GLU 229 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3fgw h GLU 229 CO 0.03 0.00 -1.61 -0.25 -1.00 0.00 0.00 179.01 176.18 3fgw n ASP 230 N -2.98 2.24 0.03 1.42 8.00 -1.06 -4.56 116.55 119.64 3fgw n ASP 230 Ca -0.01 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.37 3fgw n ASP 230 Cb 0.17 1.33 0.01 0.00 -0.02 0.00 0.00 41.12 42.60 3fgw n ASP 230 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3fgw h LEU 231 N 0.00 0.61 0.39 0.64 3.38 -1.22 -2.86 115.31 116.24 3fgw h LEU 231 Ca -0.09 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 3fgw h LEU 231 Cb 0.88 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3fgw h LEU 231 CO 0.00 1.14 -0.19 -0.33 0.09 0.00 0.00 178.44 179.16 3fgw h GLU 232 N 0.36 -0.50 -0.05 1.13 5.08 -1.70 0.04 114.58 118.93 3fgw h GLU 232 Ca -0.03 0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 3fgw h GLU 232 Cb 1.31 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 3fgw h GLU 232 CO 0.13 -0.29 -0.22 -1.35 -1.00 0.00 0.00 179.01 176.28 3fgw h PRO 233 N -0.59 0.08 -0.13 2.33 0.11 -1.80 0.11 132.00 132.10 3fgw h PRO 233 Ca -0.05 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.94 3fgw h PRO 233 Cb 0.44 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 3fgw h PRO 233 CO 0.09 0.30 -0.35 0.00 -0.21 0.00 0.00 178.00 177.83 3fgw h ALA 234 N 1.70 1.16 -0.61 -0.75 0.00 -1.29 -2.98 119.26 116.49 3fgw h ALA 234 Ca 0.01 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.39 3fgw h ALA 234 Cb 0.44 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 3fgw h ALA 234 CO 0.03 0.55 0.17 1.28 0.00 0.00 0.00 179.25 181.29 3fgw n LEU 235 N -4.07 5.52 -3.88 0.00 4.32 -0.02 -4.96 117.00 113.91 3fgw n LEU 235 Ca -0.01 -3.22 -0.29 0.00 -0.02 0.00 0.00 56.01 52.46 3fgw n LEU 235 Cb 0.44 -0.70 0.03 0.00 -1.62 0.00 0.00 43.42 41.57 3fgw n LEU 235 CO 0.41 0.82 0.09 0.59 -1.22 0.00 0.00 177.39 178.08 3fgw n ASN 236 N -0.25 -4.43 -4.71 -1.43 3.02 -0.92 -4.78 115.26 101.75 3fgw n ASN 236 Ca 0.36 -0.77 -0.42 0.00 -0.03 0.00 0.00 54.58 53.72 3fgw n ASN 236 Cb 1.26 -3.95 -0.03 0.00 -0.61 0.00 0.00 39.78 36.45 3fgw n ASN 236 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3fgw s LYS 237 N -6.53 4.48 -0.43 3.52 2.20 0.33 -4.92 119.74 118.39 3fgw s LYS 237 Ca 0.58 1.66 -0.21 0.00 -0.36 0.00 0.00 55.97 57.65 3fgw s LYS 237 Cb -0.29 -3.37 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 3fgw s LYS 237 CO 0.82 -0.17 0.63 0.99 -0.36 0.00 0.00 175.35 177.27 3fgw s THR 238 N 0.94 4.85 0.00 3.43 2.01 -1.26 -4.55 115.64 121.06 3fgw s THR 238 Ca 0.56 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.71 3fgw s THR 238 Cb -0.27 -4.18 0.00 0.00 0.01 0.00 0.00 72.50 68.06 3fgw s THR 238 CO 0.29 -0.56 0.00 0.59 -0.69 0.00 0.00 174.62 174.26 3fgw n ASN 239 N 6.21 0.00 0.00 3.53 3.02 -1.26 -5.11 115.26 121.65 3fgw n ASN 239 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 3fgw n ASN 239 Cb 0.48 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 3fgw n ASN 239 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fgw n GLY 245 N -0.02 0.83 0.00 7.41 0.00 -1.26 -4.91 105.19 107.25 3fgw n GLY 245 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3fgw n GLY 245 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fgw n SER 246 N 0.00 0.00 0.00 1.61 2.88 -1.26 -4.90 113.62 111.95 3fgw n SER 246 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3fgw n SER 246 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3fgw n SER 246 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fgw n GLY 247 N 0.00 2.15 3.43 0.46 0.00 -1.26 -4.85 105.19 105.11 3fgw n GLY 247 Ca 0.00 -0.35 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 3fgw n GLY 247 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fgw n SER 248 N 2.61 -6.00 0.00 1.61 2.88 -1.26 -4.25 113.62 109.21 3fgw n SER 248 Ca 0.00 -0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.28 3fgw n SER 248 Cb 0.00 -2.71 0.00 0.00 -0.75 0.00 0.00 64.21 60.75 3fgw n SER 248 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3fgw s SER 250 N -1.51 -0.06 0.03 0.00 1.04 -0.28 -4.40 113.70 108.52 3fgw s SER 250 Ca 0.00 0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.43 3fgw s SER 250 Cb 0.00 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.37 3fgw s SER 250 CO 0.00 -0.27 -0.02 0.00 0.98 0.00 0.00 173.24 173.94 3fgw s ALA 251 N -0.86 0.20 -0.06 5.32 0.00 -0.58 -0.35 121.76 125.44 3fgw s ALA 251 Ca -0.09 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.09 3fgw s ALA 251 Cb -0.05 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.30 3fgw s ALA 251 CO 0.01 -0.23 0.11 -1.17 0.00 0.00 0.00 175.76 174.48 3fgw s LEU 252 N -1.92 0.55 -0.32 0.00 0.20 -0.51 -0.21 118.68 116.47 3fgw s LEU 252 Ca -0.09 0.22 -0.05 0.00 0.69 0.00 0.00 54.13 54.90 3fgw s LEU 252 Cb -0.04 0.17 0.04 0.00 -0.43 0.00 0.00 46.19 45.93 3fgw s LEU 252 CO -0.04 -0.18 0.06 -0.63 -0.29 0.00 0.00 176.35 175.28 3fgw s ILE 253 N 1.53 3.51 -0.18 6.68 1.01 0.58 -0.72 121.20 133.62 3fgw s ILE 253 Ca -0.05 -1.18 -0.02 0.00 0.00 0.00 0.00 60.65 59.40 3fgw s ILE 253 Cb -0.12 -2.98 -0.01 0.00 0.01 0.00 0.00 42.46 39.35 3fgw s ILE 253 CO -0.05 -0.13 -0.08 -0.75 0.00 0.00 0.00 174.94 173.93 3fgw s LYS 254 N 1.36 3.40 -0.23 2.79 2.47 0.76 -0.21 119.74 130.08 3fgw s LYS 254 Ca -0.03 -0.64 -0.21 0.00 -1.56 0.00 0.00 55.97 53.53 3fgw s LYS 254 Cb -0.19 -2.83 -0.02 0.00 -1.46 0.00 0.00 37.83 33.32 3fgw s LYS 254 CO 0.01 0.01 0.65 -1.17 0.16 0.00 0.00 175.35 175.02 3fgw s LEU 255 N 0.90 4.10 0.53 5.43 2.96 -0.11 -0.81 118.68 131.68 3fgw s LEU 255 Ca -0.02 0.81 -0.18 0.00 -0.22 0.00 0.00 54.13 54.52 3fgw s LEU 255 Cb -0.15 -2.91 -0.07 0.00 0.50 0.00 0.00 46.19 43.56 3fgw s LEU 255 CO 0.00 -0.34 1.02 -0.76 -1.32 0.00 0.00 176.35 174.96 3fgw s LEU 256 N 2.26 3.66 0.29 -0.68 1.43 -0.59 -4.80 118.68 120.25 3fgw s LEU 256 Ca 0.28 1.77 -0.28 0.00 -1.03 0.00 0.00 54.13 54.87 3fgw s LEU 256 Cb -0.16 -4.53 -0.14 0.00 0.03 0.00 0.00 46.19 41.39 3fgw s LEU 256 CO 0.09 -0.84 0.96 -0.81 0.23 0.00 0.00 176.35 175.98 3fgw n PRO 257 N -1.51 1.22 -1.49 1.29 -0.04 -1.26 -1.02 135.00 132.19 3fgw n PRO 257 Ca 0.08 0.43 -0.17 0.00 -0.04 0.00 0.00 63.50 63.80 3fgw n PRO 257 Cb 0.53 -1.77 -0.07 0.00 -0.04 0.00 0.00 33.50 32.15 3fgw n PRO 257 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fgw n GLY 258 N 1.29 1.66 2.78 0.55 0.00 -1.26 -2.57 105.19 107.64 3fgw n GLY 258 Ca 0.10 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 3fgw n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fgw n GLY 259 N -0.59 -0.50 0.29 -0.02 0.00 -0.19 -4.25 105.19 99.92 3fgw n GLY 259 Ca -0.17 0.05 0.05 0.00 0.00 0.00 0.00 46.02 45.95 3fgw n GLY 259 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3fgw h HIS 260 N -0.53 0.35 -2.33 1.61 3.86 -1.50 0.39 115.15 117.00 3fgw h HIS 260 Ca -0.41 0.01 0.12 0.00 -1.16 0.00 0.00 60.37 58.92 3fgw h HIS 260 Cb 1.29 -0.12 -0.13 0.00 1.06 0.00 0.00 27.41 29.51 3fgw h HIS 260 CO 0.63 0.23 0.48 0.34 0.86 0.00 0.00 177.93 180.47 3fgw s ASP 261 N -6.81 -0.33 -0.22 2.45 3.68 -1.26 -4.40 116.67 109.78 3fgw s ASP 261 Ca -0.07 -0.09 0.02 0.00 2.13 0.00 0.00 52.55 54.53 3fgw s ASP 261 Cb 0.17 0.42 0.05 0.00 -1.45 0.00 0.00 42.92 42.11 3fgw s ASP 261 CO 0.71 -0.70 -0.11 -0.22 0.13 0.00 0.00 175.17 174.98 3fgw s LEU 262 N -2.60 2.73 -0.13 -1.34 2.96 -1.26 -1.53 118.68 117.50 3fgw s LEU 262 Ca 0.06 -1.08 -0.10 0.00 -0.22 0.00 0.00 54.13 52.80 3fgw s LEU 262 Cb -0.01 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.25 3fgw s LEU 262 CO -0.07 -0.15 0.20 -0.76 -1.32 0.00 0.00 176.35 174.25 3fgw s LEU 263 N 1.27 4.33 -0.08 -0.68 1.43 0.01 -3.57 118.68 121.39 3fgw s LEU 263 Ca -0.04 0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 3fgw s LEU 263 Cb -0.17 -2.20 0.02 0.00 0.03 0.00 0.00 46.19 43.86 3fgw s LEU 263 CO -0.07 0.29 -0.11 0.54 0.23 0.00 0.00 176.35 177.22 3fgw s VAL 264 N -0.42 1.15 0.07 -1.59 0.11 -0.75 -0.17 120.40 118.80 3fgw s VAL 264 Ca 0.15 -0.45 0.01 0.00 -2.93 0.00 0.00 61.98 58.76 3fgw s VAL 264 Cb -0.13 -1.07 -0.04 0.00 -1.53 0.00 0.00 36.38 33.62 3fgw s VAL 264 CO 0.04 0.37 -0.06 0.00 -3.33 0.00 0.00 175.10 172.11 3fgw s ALA 265 N 0.92 0.77 -0.04 1.54 0.00 0.11 -1.88 121.76 123.18 3fgw s ALA 265 Ca -0.09 -1.16 -0.05 0.00 0.00 0.00 0.00 51.96 50.66 3fgw s ALA 265 Cb -0.15 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.13 3fgw s ALA 265 CO 0.01 -0.20 0.13 -1.58 0.00 0.00 0.00 175.76 174.12 3fgw s HIS 266 N -3.04 -0.12 -0.17 0.00 2.46 -0.51 -1.43 115.29 112.48 3fgw s HIS 266 Ca 0.05 0.29 -0.01 0.00 0.47 0.00 0.00 55.06 55.86 3fgw s HIS 266 Cb 0.01 0.04 0.05 0.00 -0.13 0.00 0.00 32.58 32.55 3fgw s HIS 266 CO -0.04 -0.09 -0.03 1.21 -2.47 0.00 0.00 174.74 173.31 3fgw s ASN 267 N -0.10 2.90 0.10 9.88 3.04 0.53 -1.34 114.94 129.95 3fgw s ASN 267 Ca -0.02 -0.72 -0.30 0.00 0.04 0.00 0.00 52.86 51.86 3fgw s ASN 267 Cb -0.02 -0.86 -0.06 0.00 -1.54 0.00 0.00 41.25 38.77 3fgw s ASN 267 CO 0.00 -0.21 1.18 -0.89 -3.04 0.00 0.00 177.10 174.14 3fgw s THR 268 N 1.66 3.93 -0.21 -5.21 2.01 -1.21 -1.13 115.64 115.49 3fgw s THR 268 Ca -0.00 1.46 -0.09 0.00 0.31 0.00 0.00 61.69 63.36 3fgw s THR 268 Cb -0.16 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 3fgw s THR 268 CO -0.07 0.15 0.11 0.26 -0.69 0.00 0.00 174.62 174.38 3fgw s TRP 269 N 0.68 3.32 0.27 4.92 0.52 -1.26 0.13 118.94 127.52 3fgw s TRP 269 Ca 0.56 0.19 -0.21 0.00 0.02 0.00 0.00 56.10 56.67 3fgw s TRP 269 Cb -0.30 -2.16 0.02 0.00 -1.15 0.00 0.00 33.47 29.88 3fgw s TRP 269 CO 0.31 0.17 0.70 1.21 0.02 0.00 0.00 176.95 179.36 3fgw s ASN 270 N 0.57 -0.27 0.35 2.95 3.84 -0.07 -4.15 114.94 118.16 3fgw s ASN 270 Ca 0.06 -0.60 -0.28 0.00 0.21 0.00 0.00 52.86 52.26 3fgw s ASN 270 Cb -0.12 0.72 -0.10 0.00 -0.55 0.00 0.00 41.25 41.20 3fgw s ASN 270 CO 0.00 -1.32 1.26 -0.44 -2.79 0.00 0.00 177.10 173.81 3fgw s SER 271 N -2.92 6.71 0.15 -4.21 0.01 -1.26 -2.11 113.70 110.07 3fgw s SER 271 Ca 0.11 2.58 0.17 0.00 1.31 0.00 0.00 55.95 60.12 3fgw s SER 271 Cb -0.06 -2.64 0.75 0.00 0.21 0.00 0.00 66.02 64.28 3fgw s SER 271 CO 0.06 -0.56 1.51 -1.22 0.41 0.00 0.00 173.24 173.44 3fgw n TYR 272 N 0.62 0.42 0.21 2.43 0.53 0.63 -1.54 117.16 120.46 3fgw n TYR 272 Ca 0.01 0.18 0.09 0.00 -1.02 0.00 0.00 57.90 57.16 3fgw n TYR 272 Cb 0.43 -0.79 0.35 0.00 -1.03 0.00 0.00 39.34 38.29 3fgw n TYR 272 CO 0.00 0.00 0.00 1.96 -1.02 0.00 0.00 176.86 177.80 3fgw h GLN 273 N 0.00 0.00 -0.07 -0.72 4.20 -1.91 -3.08 115.11 113.53 3fgw h GLN 273 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3fgw h GLN 273 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 3fgw h GLN 273 CO 0.00 0.25 0.00 0.09 -0.67 0.00 0.00 178.83 178.50 3fgw n ASN 274 N -3.30 0.51 -1.77 1.46 4.13 -0.59 -4.54 115.26 111.15 3fgw n ASN 274 Ca 0.01 -1.75 -0.09 0.00 1.68 0.00 0.00 54.58 54.43 3fgw n ASN 274 Cb 0.50 -0.05 -0.01 0.00 -1.54 0.00 0.00 39.78 38.68 3fgw n ASN 274 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 3fgw n MET 275 N -0.34 1.50 -3.65 3.52 2.81 -1.16 -4.65 117.12 115.15 3fgw n MET 275 Ca 0.09 -0.85 -0.38 0.00 -1.81 0.00 0.00 57.70 54.75 3fgw n MET 275 Cb 0.11 -1.42 -0.12 0.00 -0.71 0.00 0.00 33.22 31.09 3fgw n MET 275 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3fgw s LEU 276 N -0.82 3.89 0.00 4.03 1.43 -1.26 -4.86 118.68 121.09 3fgw s LEU 276 Ca 0.23 -0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.21 3fgw s LEU 276 Cb 0.15 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 3fgw s LEU 276 CO -0.02 -0.09 -0.23 -0.13 0.23 0.00 0.00 176.35 176.12 3fgw s ARG 277 N 1.69 1.78 -0.09 1.70 1.81 -1.26 -4.28 118.95 120.29 3fgw s ARG 277 Ca 0.06 -0.88 -0.02 0.00 -1.72 0.00 0.00 55.73 53.17 3fgw s ARG 277 Cb -0.16 -1.78 0.03 0.00 -0.45 0.00 0.00 34.95 32.60 3fgw s ARG 277 CO 0.08 0.48 0.02 0.42 -0.68 0.00 0.00 175.30 175.62 3fgw s ILE 278 N -0.62 0.27 -0.30 1.52 1.01 -0.47 -0.90 121.20 121.72 3fgw s ILE 278 Ca 0.09 0.07 -0.27 0.00 0.00 0.00 0.00 60.65 60.54 3fgw s ILE 278 Cb -0.09 -0.53 0.01 0.00 0.01 0.00 0.00 42.46 41.86 3fgw s ILE 278 CO -0.00 0.14 0.97 -0.63 0.00 0.00 0.00 174.94 175.43 3fgw s ILE 279 N 2.01 4.63 -0.08 2.92 1.01 0.10 -1.02 121.20 130.77 3fgw s ILE 279 Ca 0.04 1.60 -0.00 0.00 0.00 0.00 0.00 60.65 62.29 3fgw s ILE 279 Cb -0.13 -4.31 -0.03 0.00 0.01 0.00 0.00 42.46 38.00 3fgw s ILE 279 CO -0.05 -0.36 -0.04 -0.54 0.00 0.00 0.00 174.94 173.95 3fgw s LYS 280 N 3.35 2.92 -0.29 2.79 1.02 0.04 -1.61 119.74 127.95 3fgw s LYS 280 Ca 0.41 -0.50 0.02 0.00 0.02 0.00 0.00 55.97 55.92 3fgw s LYS 280 Cb -0.13 -2.69 0.08 0.00 -0.52 0.00 0.00 37.83 34.57 3fgw s LYS 280 CO 0.13 0.63 0.01 0.21 -0.92 0.00 0.00 175.35 175.41 3fgw s LYS 281 N -0.71 1.49 -0.23 1.68 2.20 0.87 -1.05 119.74 123.99 3fgw s LYS 281 Ca 0.11 -1.41 -0.18 0.00 -0.36 0.00 0.00 55.97 54.14 3fgw s LYS 281 Cb -0.11 -2.77 -0.03 0.00 -1.51 0.00 0.00 37.83 33.41 3fgw s LYS 281 CO 0.02 -0.80 0.49 0.71 -0.36 0.00 0.00 175.35 175.41 3fgw s TYR 282 N 1.20 3.32 -0.58 4.03 4.12 -0.44 -0.72 117.35 128.27 3fgw s TYR 282 Ca 0.03 0.67 -0.02 0.00 0.02 0.00 0.00 57.07 57.77 3fgw s TYR 282 Cb -0.19 -2.67 0.15 0.00 -1.52 0.00 0.00 41.96 37.74 3fgw s TYR 282 CO -0.10 -0.18 0.39 1.03 0.02 0.00 0.00 175.55 176.71 3fgw s ARG 283 N 1.91 2.42 0.49 -0.62 0.52 0.88 -1.47 118.95 123.09 3fgw s ARG 283 Ca 0.21 -2.44 0.09 0.00 -0.52 0.00 0.00 55.73 53.07 3fgw s ARG 283 Cb -0.15 -3.66 0.04 0.00 0.52 0.00 0.00 34.95 31.70 3fgw s ARG 283 CO 0.09 -1.15 0.64 -0.51 0.02 0.00 0.00 175.30 174.39 3fgw s LEU 284 N 0.08 3.33 -0.33 2.53 1.43 0.24 -2.57 118.68 123.38 3fgw s LEU 284 Ca 0.16 -0.69 0.16 0.00 -1.03 0.00 0.00 54.13 52.73 3fgw s LEU 284 Cb -0.21 -2.06 0.46 0.00 0.03 0.00 0.00 46.19 44.41 3fgw s LEU 284 CO -0.03 -1.03 0.99 0.00 0.23 0.00 0.00 176.35 176.51 3fgw n GLN 285 N -1.99 1.58 -2.75 1.70 1.13 -1.26 -4.71 117.38 111.08 3fgw n GLN 285 Ca 0.10 -3.48 -0.31 0.00 -1.94 0.00 0.00 57.00 51.38 3fgw n GLN 285 Cb 0.61 -1.44 -0.03 0.00 0.11 0.00 0.00 30.24 29.48 3fgw n GLN 285 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3fgw s PHE 286 N -3.25 3.46 0.29 1.08 2.99 -1.26 -4.83 117.98 116.46 3fgw s PHE 286 Ca 0.31 1.17 0.08 0.00 0.00 0.00 0.00 56.93 58.49 3fgw s PHE 286 Cb 0.44 -2.54 -0.04 0.00 0.00 0.00 0.00 43.02 40.88 3fgw s PHE 286 CO -0.00 -0.16 0.11 1.03 -0.00 0.00 0.00 175.22 176.20 3fgw s ARG 287 N -3.85 2.49 0.32 0.44 0.52 -1.26 -1.39 118.95 116.23 3fgw s ARG 287 Ca 0.53 -1.37 0.04 0.00 -0.52 0.00 0.00 55.73 54.41 3fgw s ARG 287 Cb -0.10 -2.28 0.54 0.00 0.52 0.00 0.00 34.95 33.63 3fgw s ARG 287 CO 0.30 0.27 1.83 0.93 0.02 0.00 0.00 175.30 178.65 3fgw h GLU 288 N 1.64 0.52 0.00 3.54 5.08 -1.65 -3.43 114.58 120.29 3fgw h GLU 288 Ca -0.45 -0.13 -0.47 0.00 -1.00 0.00 0.00 59.36 57.31 3fgw h GLU 288 Cb 1.25 -0.06 -0.11 0.00 0.50 0.00 0.00 28.75 30.33 3fgw h GLU 288 CO 0.61 0.60 -0.40 0.41 -1.00 0.00 0.00 179.01 179.24 3fgw n GLY 289 N -0.73 3.33 0.21 -3.84 0.00 -1.26 -4.49 105.19 98.41 3fgw n GLY 289 Ca 0.01 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.86 3fgw n GLY 289 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fgw h PRO 290 N 0.00 0.58 -7.23 1.61 0.11 -1.84 -3.44 132.00 121.78 3fgw h PRO 290 Ca -0.26 -0.39 -0.51 0.00 0.11 0.00 0.00 66.00 64.94 3fgw h PRO 290 Cb 1.03 0.06 0.11 0.00 0.11 0.00 0.00 31.00 32.31 3fgw h PRO 290 CO 0.41 1.01 0.36 -0.65 -0.21 0.00 0.00 178.00 178.92 3fgw s GLN 291 N -3.91 2.68 0.00 1.05 1.11 -1.26 -4.97 119.66 114.36 3fgw s GLN 291 Ca -0.08 1.34 0.26 0.00 0.01 0.00 0.00 55.36 56.90 3fgw s GLN 291 Cb 0.11 -1.94 0.62 0.00 -1.01 0.00 0.00 33.01 30.79 3fgw s GLN 291 CO 0.85 -1.34 1.49 -1.91 0.01 0.00 0.00 175.29 174.39 3fgw n GLU 292 N -2.66 1.56 0.03 2.91 4.07 -1.26 -3.57 120.64 121.72 3fgw n GLU 292 Ca 0.10 -1.09 0.12 0.00 -0.06 0.00 0.00 57.16 56.23 3fgw n GLU 292 Cb 0.52 -1.48 0.48 0.00 -0.06 0.00 0.00 31.44 30.91 3fgw n GLU 292 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3fgw n GLU 293 N 0.23 0.07 -2.13 5.31 1.02 -1.26 -4.83 120.64 119.04 3fgw n GLU 293 Ca 0.15 0.16 -0.40 0.00 -0.02 0.00 0.00 57.16 57.04 3fgw n GLU 293 Cb 0.43 -1.59 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 3fgw n GLU 293 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3fgw s TYR 294 N -3.05 3.05 0.73 -0.32 1.51 -1.23 -5.03 117.35 113.00 3fgw s TYR 294 Ca 0.10 1.44 -0.12 0.00 -1.01 0.00 0.00 57.07 57.48 3fgw s TYR 294 Cb 0.14 -3.64 0.03 0.00 -0.11 0.00 0.00 41.96 38.38 3fgw s TYR 294 CO 0.45 -1.79 1.10 -1.25 -1.11 0.00 0.00 175.55 172.94 3fgw s PRO 295 N -1.86 2.49 0.35 -1.71 0.04 -1.26 -4.71 135.00 128.34 3fgw s PRO 295 Ca 0.50 1.24 -0.28 0.00 0.04 0.00 0.00 61.00 62.50 3fgw s PRO 295 Cb -0.39 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.13 3fgw s PRO 295 CO 0.51 -1.47 1.37 -0.51 0.04 0.00 0.00 177.00 176.94 3fgw s LEU 296 N -5.50 4.38 0.48 -3.56 1.43 -1.26 -1.85 118.68 112.81 3fgw s LEU 296 Ca 0.63 2.82 -0.23 0.00 -1.03 0.00 0.00 54.13 56.32 3fgw s LEU 296 Cb -0.18 -3.66 -0.08 0.00 0.03 0.00 0.00 46.19 42.29 3fgw s LEU 296 CO 0.50 -0.67 1.16 1.33 0.23 0.00 0.00 176.35 178.90 3fgw n VAL 297 N 0.65 3.00 0.20 -1.59 0.24 -0.48 -4.76 118.33 115.59 3fgw n VAL 297 Ca 0.00 -0.50 0.04 0.00 -2.04 0.00 0.00 64.34 61.84 3fgw n VAL 297 Cb 0.41 -1.39 0.41 0.00 -1.47 0.00 0.00 33.84 31.80 3fgw n VAL 297 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fgw h ALA 298 N 1.49 1.40 -0.96 2.33 0.00 -1.81 -3.21 119.26 118.50 3fgw h ALA 298 Ca -0.48 -0.29 -0.70 0.00 0.00 0.00 0.00 54.91 53.44 3fgw h ALA 298 Cb 1.32 -0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.79 3fgw h ALA 298 CO 0.57 0.40 0.93 0.41 0.00 0.00 0.00 179.25 181.56 3fgw n GLY 299 N -0.52 5.59 0.17 0.00 0.00 -0.69 -3.98 105.19 105.76 3fgw n GLY 299 Ca -0.02 -2.32 -0.03 0.00 0.00 0.00 0.00 46.02 43.65 3fgw n GLY 299 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fgw h ASN 300 N 2.48 0.19 -3.31 1.61 2.35 -1.81 -3.43 115.58 113.66 3fgw h ASN 300 Ca 0.57 -0.10 -0.63 0.00 -0.55 0.00 0.00 56.30 55.59 3fgw h ASN 300 Cb 0.45 -0.05 -0.20 0.00 0.05 0.00 0.00 38.32 38.56 3fgw h ASN 300 CO 1.47 0.71 -0.64 0.20 -1.65 0.00 0.00 177.43 177.51 3fgw s ASN 301 N -6.88 4.99 -0.22 5.81 -0.87 -1.26 -0.59 114.94 115.91 3fgw s ASN 301 Ca -0.03 -0.09 -0.13 0.00 -1.57 0.00 0.00 52.86 51.03 3fgw s ASN 301 Cb 0.13 -1.83 0.07 0.00 -0.02 0.00 0.00 41.25 39.59 3fgw s ASN 301 CO 0.78 0.16 0.54 -1.48 -2.57 0.00 0.00 177.10 174.53 3fgw s LEU 302 N 0.41 -0.41 -0.08 0.60 -0.00 -0.54 0.28 118.68 118.94 3fgw s LEU 302 Ca -0.02 1.16 0.00 0.00 -0.00 0.00 0.00 54.13 55.27 3fgw s LEU 302 Cb -0.14 1.82 -0.03 0.00 -0.00 0.00 0.00 46.19 47.85 3fgw s LEU 302 CO 0.02 -0.21 -0.07 -0.69 -0.00 0.00 0.00 176.35 175.40 3fgw s VAL 303 N 1.29 3.69 0.02 1.48 1.01 -0.36 -1.33 120.40 126.19 3fgw s VAL 303 Ca -0.08 -0.48 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 3fgw s VAL 303 Cb -0.06 -2.52 0.07 0.00 0.00 0.00 0.00 36.38 33.87 3fgw s VAL 303 CO -0.13 0.59 0.66 0.72 0.00 0.00 0.00 175.10 176.94 3fgw s PHE 304 N -0.68 -0.61 -0.08 5.22 -0.12 -0.22 -0.01 117.98 121.47 3fgw s PHE 304 Ca 0.10 0.85 -0.26 0.00 -0.05 0.00 0.00 56.93 57.57 3fgw s PHE 304 Cb -0.11 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 3fgw s PHE 304 CO 0.02 -0.69 0.81 -1.54 -0.05 0.00 0.00 175.22 173.77 3fgw s SER 305 N -1.73 7.07 0.00 1.98 1.04 -1.16 -0.78 113.70 120.12 3fgw s SER 305 Ca -0.07 1.30 0.00 0.00 0.48 0.00 0.00 55.95 57.66 3fgw s SER 305 Cb -0.00 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.65 3fgw s SER 305 CO 0.02 -0.24 0.00 -0.24 0.98 0.00 0.00 173.24 173.76 3fgw n SER 306 N 4.26 0.00 -4.24 7.02 2.88 -0.18 -4.41 113.62 118.94 3fgw n SER 306 Ca 0.02 -0.88 -0.13 0.00 -1.33 0.00 0.00 58.87 56.55 3fgw n SER 306 Cb 0.50 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.86 3fgw n SER 306 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3fgw s TYR 307 N -3.80 1.20 0.14 0.66 1.51 -1.26 -1.37 117.35 114.44 3fgw s TYR 307 Ca 0.00 -0.95 -0.31 0.00 -1.01 0.00 0.00 57.07 54.80 3fgw s TYR 307 Cb 0.00 -0.68 -0.10 0.00 -0.11 0.00 0.00 41.96 41.08 3fgw s TYR 307 CO 0.00 -0.13 1.60 -2.14 -1.11 0.00 0.00 175.55 173.77 3fgw s PRO 308 N -3.87 4.21 0.00 -1.71 0.02 -1.26 -3.23 135.00 129.16 3fgw s PRO 308 Ca 0.21 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.60 3fgw s PRO 308 Cb 0.05 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.30 3fgw s PRO 308 CO 0.02 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 3fgw n GLY 309 N 3.83 2.26 3.49 0.52 0.00 -1.26 -4.74 105.19 109.30 3fgw n GLY 309 Ca 0.15 -0.41 -0.44 0.00 0.00 0.00 0.00 46.02 45.31 3fgw n GLY 309 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3fgw n THR 310 N 0.00 0.07 1.58 2.61 -1.04 -1.20 -4.81 114.28 111.50 3fgw n THR 310 Ca 0.00 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.64 3fgw n THR 310 Cb 0.00 -1.77 0.01 0.00 -1.82 0.00 0.00 70.33 66.75 3fgw n THR 310 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 3fgw n ILE 311 N 7.52 0.04 -4.25 12.58 -5.35 -1.26 -4.44 119.36 124.20 3fgw n ILE 311 Ca 0.45 -0.03 -0.18 0.00 -0.27 0.00 0.00 62.75 62.72 3fgw n ILE 311 Cb 0.29 -0.17 -0.08 0.00 -1.74 0.00 0.00 39.64 37.94 3fgw n ILE 311 CO 0.00 0.00 0.00 0.72 -1.76 0.00 0.00 176.55 175.51 3fgw s PHE 312 N -1.64 1.59 0.02 4.28 -0.71 -1.26 -5.11 117.98 115.15 3fgw s PHE 312 Ca 0.01 -1.58 -0.13 0.00 -1.04 0.00 0.00 56.93 54.19 3fgw s PHE 312 Cb 0.01 -0.62 -0.07 0.00 -1.21 0.00 0.00 43.02 41.13 3fgw s PHE 312 CO 0.01 -0.87 1.20 1.03 -1.34 0.00 0.00 175.22 175.24 3fgw h SER 313 N 2.20 -0.41 0.00 1.98 0.87 -1.86 -3.42 113.55 112.92 3fgw h SER 313 Ca -0.27 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 3fgw h SER 313 Cb 1.24 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 3fgw h SER 313 CO 0.39 -0.28 0.00 0.61 -0.53 0.00 0.00 176.83 177.01 3fgw n GLY 314 N -1.23 1.89 0.29 5.77 0.00 -1.26 -4.30 105.19 106.35 3fgw n GLY 314 Ca -0.06 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3fgw n GLY 314 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3fgw h ASP 315 N 0.00 0.58 -2.52 1.61 3.04 -1.92 -3.49 116.42 113.72 3fgw h ASP 315 Ca 0.00 -0.08 0.00 0.00 -3.24 0.00 0.00 57.03 53.71 3fgw h ASP 315 Cb 0.00 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 38.14 3fgw h ASP 315 CO 0.00 0.56 0.00 0.47 -2.04 0.00 0.00 179.24 178.23 3fgw n ASP 316 N -4.34 -1.68 -3.64 4.15 10.43 -1.26 -4.66 116.55 115.55 3fgw n ASP 316 Ca 0.03 0.00 -0.18 0.00 2.57 0.00 0.00 54.79 57.20 3fgw n ASP 316 Cb 0.18 -0.84 -0.16 0.00 1.84 0.00 0.00 41.12 42.14 3fgw n ASP 316 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 3fgw s PHE 317 N -0.57 -0.11 -0.02 1.24 5.36 -1.26 -3.17 117.98 119.45 3fgw s PHE 317 Ca 0.00 0.41 0.05 0.00 -0.96 0.00 0.00 56.93 56.42 3fgw s PHE 317 Cb 0.00 -0.35 -0.01 0.00 -0.34 0.00 0.00 43.02 42.32 3fgw s PHE 317 CO 0.00 -0.33 -0.16 0.71 -1.46 0.00 0.00 175.22 173.99 3fgw s TYR 318 N 2.26 1.44 -0.28 10.12 1.51 0.16 -2.98 117.35 129.58 3fgw s TYR 318 Ca 0.04 -0.31 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 3fgw s TYR 318 Cb -0.13 -0.94 0.06 0.00 -0.11 0.00 0.00 41.96 40.84 3fgw s TYR 318 CO -0.06 -0.06 -0.07 0.42 -1.11 0.00 0.00 175.55 174.67 3fgw s ILE 319 N -0.25 2.32 0.03 2.71 1.01 0.98 -2.08 121.20 125.94 3fgw s ILE 319 Ca 0.03 -1.68 -0.05 0.00 0.00 0.00 0.00 60.65 58.95 3fgw s ILE 319 Cb -0.07 -2.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 3fgw s ILE 319 CO 0.00 -0.11 0.27 -0.76 0.00 0.00 0.00 174.94 174.34 3fgw s LEU 320 N 1.10 4.35 0.00 2.97 1.43 0.02 -1.23 118.68 127.33 3fgw s LEU 320 Ca -0.06 0.50 0.11 0.00 -1.03 0.00 0.00 54.13 53.65 3fgw s LEU 320 Cb -0.20 -2.81 0.66 0.00 0.03 0.00 0.00 46.19 43.88 3fgw s LEU 320 CO -0.05 0.21 1.09 0.61 0.23 0.00 0.00 176.35 178.45 3fgw n GLY 321 N 0.82 -0.37 0.93 -3.19 0.00 0.14 -2.11 105.19 101.41 3fgw n GLY 321 Ca -0.09 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 45.96 3fgw n GLY 321 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fgw n SER 322 N -0.97 2.75 0.00 1.61 3.41 -1.26 -4.91 113.62 114.26 3fgw n SER 322 Ca 0.08 -1.92 0.00 0.00 -0.26 0.00 0.00 58.87 56.77 3fgw n SER 322 Cb 0.04 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3fgw n SER 322 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fgw n GLY 323 N 1.35 0.45 3.55 5.00 0.00 -0.90 -4.83 105.19 109.81 3fgw n GLY 323 Ca 0.18 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 3fgw n GLY 323 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fgw s LEU 324 N 0.00 3.34 -0.19 0.99 1.43 -1.22 -0.05 118.68 122.97 3fgw s LEU 324 Ca 0.00 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 3fgw s LEU 324 Cb 0.00 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.44 3fgw s LEU 324 CO 0.00 0.24 -0.14 -0.69 0.23 0.00 0.00 176.35 175.99 3fgw s VAL 325 N -0.04 2.61 -0.04 -1.59 1.01 0.59 -0.80 120.40 122.14 3fgw s VAL 325 Ca 0.02 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3fgw s VAL 325 Cb -0.13 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 3fgw s VAL 325 CO 0.02 0.49 -0.22 0.42 0.00 0.00 0.00 175.10 175.82 3fgw s THR 326 N 1.31 2.35 0.14 3.92 -4.23 -0.88 -0.60 115.64 117.64 3fgw s THR 326 Ca 0.04 -0.98 -0.22 0.00 -1.18 0.00 0.00 61.69 59.35 3fgw s THR 326 Cb -0.14 -1.86 0.06 0.00 1.34 0.00 0.00 72.50 71.91 3fgw s THR 326 CO -0.08 0.58 0.57 -1.48 -0.54 0.00 0.00 174.62 173.67 3fgw s LEU 327 N -0.48 -0.41 0.19 4.79 2.34 -0.89 -0.67 118.68 123.55 3fgw s LEU 327 Ca 0.06 -0.01 -0.06 0.00 0.06 0.00 0.00 54.13 54.18 3fgw s LEU 327 Cb -0.11 2.47 -0.02 0.00 -0.56 0.00 0.00 46.19 47.96 3fgw s LEU 327 CO 0.01 -0.93 0.23 -1.83 -1.06 0.00 0.00 176.35 172.77 3fgw s GLU 328 N -3.59 1.20 -0.02 1.48 4.04 -1.19 -0.72 118.70 119.90 3fgw s GLU 328 Ca 0.01 -1.39 0.02 0.00 0.04 0.00 0.00 54.97 53.64 3fgw s GLU 328 Cb -0.01 0.33 0.01 0.00 0.02 0.00 0.00 34.13 34.48 3fgw s GLU 328 CO -0.11 -0.42 -0.07 0.95 -1.84 0.00 0.00 175.26 173.77 3fgw s THR 329 N -4.06 0.59 -0.35 1.83 -4.23 -1.06 -4.83 115.64 103.54 3fgw s THR 329 Ca 0.27 -0.25 -0.29 0.00 -1.18 0.00 0.00 61.69 60.24 3fgw s THR 329 Cb 0.05 -0.54 -0.00 0.00 1.34 0.00 0.00 72.50 73.34 3fgw s THR 329 CO 0.06 0.20 1.47 -0.89 -0.54 0.00 0.00 174.62 174.92 3fgw s THR 330 N 0.26 3.87 -0.17 3.99 2.01 -1.10 -1.25 115.64 123.25 3fgw s THR 330 Ca -0.03 0.92 0.18 0.00 0.31 0.00 0.00 61.69 63.06 3fgw s THR 330 Cb -0.08 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 3fgw s THR 330 CO 0.00 -0.59 1.07 0.16 -0.69 0.00 0.00 174.62 174.57 3fgw h ILE 331 N 6.37 0.46 -0.85 1.82 3.07 -0.78 -3.42 117.51 124.18 3fgw h ILE 331 Ca -0.29 -1.79 0.00 0.00 1.55 0.00 0.00 64.86 64.33 3fgw h ILE 331 Cb 1.12 2.02 0.00 0.00 -0.27 0.00 0.00 36.82 39.69 3fgw h ILE 331 CO 1.06 0.26 0.00 0.61 -1.05 0.00 0.00 178.15 179.03 3fgw n GLY 332 N 1.29 -0.32 3.51 0.16 0.00 -0.74 -4.82 105.19 104.27 3fgw n GLY 332 Ca -0.04 -1.04 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 3fgw n GLY 332 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fgw s ASN 333 N -4.00 -0.79 -0.15 1.61 3.04 -1.26 -4.84 114.94 108.54 3fgw s ASN 333 Ca 0.00 1.30 0.17 0.00 0.04 0.00 0.00 52.86 54.36 3fgw s ASN 333 Cb 0.00 1.24 0.33 0.00 -1.54 0.00 0.00 41.25 41.28 3fgw s ASN 333 CO 0.00 -0.22 1.17 1.17 -3.04 0.00 0.00 177.10 176.18 3fgw n LYS 334 N 4.40 1.38 -3.92 0.43 3.00 -0.83 -4.93 118.16 117.70 3fgw n LYS 334 Ca -0.20 -2.80 -0.34 0.00 -0.00 0.00 0.00 58.31 54.97 3fgw n LYS 334 Cb 0.57 -1.54 -0.14 0.00 0.00 0.00 0.00 35.03 33.92 3fgw n LYS 334 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 3fgw s ASN 335 N -2.98 4.89 0.47 3.14 2.47 -0.94 -4.78 114.94 117.21 3fgw s ASN 335 Ca 0.34 -1.50 0.27 0.00 0.42 0.00 0.00 52.86 52.38 3fgw s ASN 335 Cb 0.31 -1.70 0.96 0.00 -1.45 0.00 0.00 41.25 39.37 3fgw s ASN 335 CO 0.00 -0.31 1.84 1.55 -3.72 0.00 0.00 177.10 176.46 3fgw h PRO 336 N 7.94 0.00 0.00 0.43 0.13 -1.92 -2.70 132.00 135.88 3fgw h PRO 336 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 3fgw h PRO 336 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3fgw h PRO 336 CO 0.55 0.14 0.00 0.00 -0.23 0.00 0.00 178.00 178.46 3fgw n ALA 337 N -2.17 1.73 0.47 -0.56 0.00 -1.26 -1.95 120.51 116.77 3fgw n ALA 337 Ca 0.01 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.48 3fgw n ALA 337 Cb 0.41 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.66 3fgw n ALA 337 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3fgw n LEU 338 N -1.01 0.47 0.22 0.00 4.32 -1.02 -4.46 117.00 115.52 3fgw n LEU 338 Ca 0.05 -0.32 0.15 0.00 -0.02 0.00 0.00 56.01 55.87 3fgw n LEU 338 Cb 0.02 0.00 0.75 0.00 -1.62 0.00 0.00 43.42 42.57 3fgw n LEU 338 CO 0.04 0.12 0.95 -0.50 -1.22 0.00 0.00 177.39 176.78 3fgw h TRP 339 N 0.00 0.00 0.00 -1.77 -0.00 -1.57 -2.16 115.95 110.45 3fgw h TRP 339 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 3fgw h TRP 339 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.66 3fgw h TRP 339 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 178.44 180.01 3fgw h LYS 340 N 0.00 0.00 -0.01 0.49 2.10 -1.78 -1.34 116.57 116.03 3fgw h LYS 340 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3fgw h LYS 340 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 3fgw h LYS 340 CO 0.00 0.00 -0.14 0.66 -2.00 0.00 0.00 179.45 177.97 3fgw n TYR 341 N -2.90 0.00 -2.95 0.07 4.02 -0.81 -4.72 117.16 109.87 3fgw n TYR 341 Ca -0.01 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.44 3fgw n TYR 341 Cb 0.14 -0.10 -0.05 0.00 -0.02 0.00 0.00 39.34 39.31 3fgw n TYR 341 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3fgw s VAL 342 N -2.33 4.56 0.07 -0.72 1.01 -0.51 -4.71 120.40 117.77 3fgw s VAL 342 Ca 0.30 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.42 3fgw s VAL 342 Cb 0.20 -4.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 3fgw s VAL 342 CO 0.45 -0.96 -0.12 -1.10 0.00 0.00 0.00 175.10 173.37 3fgw s GLN 343 N 3.48 0.74 0.13 2.72 -1.52 -1.26 -5.06 119.66 118.89 3fgw s GLN 343 Ca 0.26 -0.92 -0.16 0.00 -1.95 0.00 0.00 55.36 52.59 3fgw s GLN 343 Cb -0.14 -0.66 -0.01 0.00 -0.22 0.00 0.00 33.01 31.98 3fgw s GLN 343 CO 0.18 0.14 1.71 -1.35 -0.25 0.00 0.00 175.29 175.72 3fgw h PRO 344 N 4.30 0.56 -6.03 2.91 0.11 -1.91 -3.37 132.00 128.56 3fgw h PRO 344 Ca -0.39 -0.08 -0.61 0.00 0.11 0.00 0.00 66.00 65.03 3fgw h PRO 344 Cb 1.19 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 3fgw h PRO 344 CO 0.41 0.49 -0.22 -0.65 -0.21 0.00 0.00 178.00 177.82 3fgw s GLN 345 N -5.70 3.86 0.00 1.05 1.11 -1.26 -4.12 119.66 114.60 3fgw s GLN 345 Ca -0.13 0.33 0.00 0.00 0.01 0.00 0.00 55.36 55.57 3fgw s GLN 345 Cb 0.10 -3.15 0.00 0.00 -1.01 0.00 0.00 33.01 28.95 3fgw s GLN 345 CO 0.74 0.66 0.00 0.41 0.01 0.00 0.00 175.29 177.11 3fgw n GLY 346 N 1.56 1.07 3.18 3.09 0.00 -1.26 -5.01 105.19 107.82 3fgw n GLY 346 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 3fgw n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fgw s VAL 348 N 0.36 3.67 0.38 0.00 1.01 -0.07 -4.93 120.40 120.82 3fgw s VAL 348 Ca -0.17 -0.43 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 3fgw s VAL 348 Cb -0.17 -2.60 -0.11 0.00 0.00 0.00 0.00 36.38 33.50 3fgw s VAL 348 CO 0.07 0.49 1.49 -0.76 0.00 0.00 0.00 175.10 176.39 3fgw s LEU 349 N 0.45 4.32 0.27 3.92 1.43 -1.26 -4.04 118.68 123.77 3fgw s LEU 349 Ca -0.05 3.05 -0.04 0.00 -1.03 0.00 0.00 54.13 56.06 3fgw s LEU 349 Cb -0.15 -3.67 0.55 0.00 0.03 0.00 0.00 46.19 42.95 3fgw s LEU 349 CO 0.03 -0.87 1.60 -0.08 0.23 0.00 0.00 176.35 177.26 3fgw h GLU 350 N 3.00 0.06 -0.95 1.70 4.22 -1.92 -2.05 114.58 118.63 3fgw h GLU 350 Ca -0.51 -0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.03 3fgw h GLU 350 Cb 1.24 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.40 3fgw h GLU 350 CO 0.64 0.04 0.61 0.11 -2.18 0.00 0.00 179.01 178.23 3fgw h TRP 351 N 0.06 1.04 0.03 0.92 5.08 -1.90 0.37 115.95 121.56 3fgw h TRP 351 Ca 0.48 0.03 -0.00 0.00 1.08 0.00 0.00 58.89 60.48 3fgw h TRP 351 Cb 0.89 -0.33 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 3fgw h TRP 351 CO -0.49 0.46 -0.02 0.82 -1.28 0.00 0.00 178.44 177.93 3fgw h ILE 352 N 0.94 1.26 -0.63 0.12 2.04 -1.74 -2.52 117.51 116.98 3fgw h ILE 352 Ca 0.45 -0.93 0.09 0.00 1.00 0.00 0.00 64.86 65.47 3fgw h ILE 352 Cb 0.44 1.88 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 3fgw h ILE 352 CO -0.21 0.24 0.26 0.03 0.00 0.00 0.00 178.15 178.47 3fgw h ARG 353 N -0.45 0.45 -0.56 2.37 3.08 -1.27 0.14 114.38 118.15 3fgw h ARG 353 Ca -0.00 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.13 3fgw h ARG 353 Cb 0.42 -0.10 -0.11 0.00 0.08 0.00 0.00 29.97 30.26 3fgw h ARG 353 CO 0.01 0.30 -0.21 -0.97 -1.07 0.00 0.00 179.97 178.03 3fgw h ASN 354 N 0.47 -0.74 0.30 7.04 -0.73 -0.31 -0.53 115.58 121.08 3fgw h ASN 354 Ca 0.31 0.19 -0.01 0.00 1.87 0.00 0.00 56.30 58.66 3fgw h ASN 354 Cb 0.36 0.43 0.00 0.00 0.27 0.00 0.00 38.32 39.37 3fgw h ASN 354 CO -0.28 -0.24 -0.14 0.58 -0.37 0.00 0.00 177.43 176.98 3fgw h VAL 355 N -0.07 0.68 -0.73 2.57 2.07 -0.70 -2.50 116.25 117.57 3fgw h VAL 355 Ca 0.26 -0.67 0.16 0.00 0.82 0.00 0.00 66.70 67.26 3fgw h VAL 355 Cb 0.48 1.01 -0.11 0.00 -1.52 0.00 0.00 31.29 31.15 3fgw h VAL 355 CO -0.61 0.12 0.20 0.58 0.02 0.00 0.00 177.57 177.88 3fgw h VAL 356 N -0.79 0.54 -0.24 2.57 2.07 -0.68 -1.10 116.25 118.62 3fgw h VAL 356 Ca -0.04 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3fgw h VAL 356 Cb 0.51 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3fgw h VAL 356 CO 0.07 0.05 0.10 0.00 0.02 0.00 0.00 177.57 177.81 3fgw h ALA 357 N 1.60 0.31 -0.48 1.67 0.00 -1.12 -2.31 119.26 118.92 3fgw h ALA 357 Ca 0.41 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.31 3fgw h ALA 357 Cb 0.69 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3fgw h ALA 357 CO -0.49 -0.10 0.33 -0.91 0.00 0.00 0.00 179.25 178.08 3fgw h ASN 358 N 0.24 0.23 0.53 0.00 -0.26 -0.84 -2.05 115.58 113.43 3fgw h ASN 358 Ca 0.08 0.00 -0.29 0.00 -0.56 0.00 0.00 56.30 55.53 3fgw h ASN 358 Cb 0.16 -0.04 0.01 0.00 -1.06 0.00 0.00 38.32 37.38 3fgw h ASN 358 CO -0.01 0.14 -1.36 -0.09 -1.06 0.00 0.00 177.43 175.06 3fgw h ARG 359 N 0.26 0.31 0.00 0.81 2.43 -0.85 -3.38 114.38 113.96 3fgw h ARG 359 Ca 0.22 -0.53 -0.21 0.00 -0.81 0.00 0.00 59.98 58.65 3fgw h ARG 359 Cb 0.53 0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.24 3fgw h ARG 359 CO -0.04 1.23 -1.91 1.28 -1.51 0.00 0.00 179.97 179.02 3fgw n LEU 360 N -3.54 0.36 -4.76 3.80 4.77 -0.90 -1.70 117.00 115.02 3fgw n LEU 360 Ca -0.12 0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.63 3fgw n LEU 360 Cb 1.04 0.22 0.01 0.00 -2.33 0.00 0.00 43.42 42.36 3fgw n LEU 360 CO 0.54 0.25 1.00 0.00 -1.33 0.00 0.00 177.39 177.86 3fgw s ALA 361 N -2.88 3.18 -0.00 -1.18 0.00 -0.78 -4.61 121.76 115.48 3fgw s ALA 361 Ca -0.07 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.22 3fgw s ALA 361 Cb 0.09 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 3fgw s ALA 361 CO 0.84 -1.04 -0.01 1.28 0.00 0.00 0.00 175.76 176.83 3fgw n LEU 362 N -0.19 0.16 -4.98 0.00 4.77 -1.26 -4.49 117.00 111.01 3fgw n LEU 362 Ca 0.05 0.01 -0.22 0.00 -0.03 0.00 0.00 56.01 55.82 3fgw n LEU 362 Cb 0.43 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.57 3fgw n LEU 362 CO 0.56 0.03 0.44 -1.81 -1.33 0.00 0.00 177.39 175.29 3fgw s ASP 363 N -5.00 4.91 0.22 -1.43 1.11 -1.26 -4.89 116.67 110.34 3fgw s ASP 363 Ca -0.01 -0.16 0.06 0.00 0.18 0.00 0.00 52.55 52.62 3fgw s ASP 363 Cb 0.00 -0.52 0.19 0.00 1.07 0.00 0.00 42.92 43.67 3fgw s ASP 363 CO 0.01 -1.43 1.52 1.23 1.18 0.00 0.00 175.17 177.67 3fgw h GLY 364 N -0.17 0.17 1.41 0.21 0.00 -1.90 -2.70 103.07 100.09 3fgw h GLY 364 Ca -0.40 -0.23 -0.15 0.00 0.00 0.00 0.00 47.33 46.55 3fgw h GLY 364 CO 0.48 0.21 -0.46 0.00 0.00 0.00 0.00 176.54 176.76 3fgw h ALA 365 N 1.18 0.74 -0.22 3.60 0.00 -1.95 -1.77 119.26 120.84 3fgw h ALA 365 Ca -0.02 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 3fgw h ALA 365 Cb 1.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3fgw h ALA 365 CO 0.10 0.67 -0.00 1.15 0.00 0.00 0.00 179.25 181.17 3fgw h THR 366 N 0.51 1.26 0.12 0.00 2.02 -1.95 -2.31 112.91 112.56 3fgw h THR 366 Ca 0.03 -0.89 0.02 0.00 0.77 0.00 0.00 66.41 66.34 3fgw h THR 366 Cb 0.99 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.78 3fgw h THR 366 CO 0.09 0.28 -0.29 -0.25 0.37 0.00 0.00 175.52 175.72 3fgw h TRP 367 N 0.15 -0.79 -0.53 3.16 7.01 -1.43 -2.70 115.95 120.82 3fgw h TRP 367 Ca 0.06 0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.19 3fgw h TRP 367 Cb 0.41 0.33 -0.10 0.00 -2.10 0.00 0.00 29.16 27.69 3fgw h TRP 367 CO 0.04 -0.40 -0.17 0.00 -2.79 0.00 0.00 178.44 175.12 3fgw h ALA 368 N 0.18 0.29 -0.37 2.65 0.00 -1.30 -2.02 119.26 118.69 3fgw h ALA 368 Ca 0.03 0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.22 3fgw h ALA 368 Cb 0.54 0.46 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 3fgw h ALA 368 CO -0.17 -0.47 -0.21 -0.44 0.00 0.00 0.00 179.25 177.96 3fgw h ASP 369 N -0.04 -0.70 -0.47 0.00 3.45 -1.12 -2.15 116.42 115.38 3fgw h ASP 369 Ca 0.25 0.15 -0.11 0.00 0.43 0.00 0.00 57.03 57.76 3fgw h ASP 369 Cb 0.43 0.37 -0.01 0.00 -0.56 0.00 0.00 39.33 39.55 3fgw h ASP 369 CO -0.57 -0.24 -0.12 0.58 -1.57 0.00 0.00 179.24 177.32 3fgw h VAL 370 N -0.15 1.27 -0.49 -1.35 2.07 -1.10 -2.99 116.25 113.50 3fgw h VAL 370 Ca 0.18 -1.25 -0.05 0.00 0.82 0.00 0.00 66.70 66.39 3fgw h VAL 370 Cb 0.43 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3fgw h VAL 370 CO -0.46 0.43 0.09 0.15 0.02 0.00 0.00 177.57 177.80 3fgw h PHE 371 N 0.76 0.80 -0.58 1.57 3.57 -1.20 -3.02 116.94 118.84 3fgw h PHE 371 Ca 0.12 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3fgw h PHE 371 Cb 0.67 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 3fgw h PHE 371 CO 0.05 0.69 0.38 0.87 -2.23 0.00 0.00 178.31 178.07 3fgw h LYS 372 N 0.74 0.76 -6.66 1.11 1.57 -1.24 -3.43 116.57 109.42 3fgw h LYS 372 Ca 0.16 -0.05 -0.55 0.00 -1.87 0.00 0.00 60.65 58.34 3fgw h LYS 372 Cb 0.32 -0.17 0.07 0.00 0.08 0.00 0.00 32.23 32.54 3fgw h LYS 372 CO 0.00 0.51 0.84 0.54 -0.57 0.00 0.00 179.45 180.77 3fgw n ARG 373 N -4.44 2.46 -3.92 3.15 1.74 -1.14 -2.38 116.66 112.12 3fgw n ARG 373 Ca 0.06 0.88 -0.27 0.00 -0.77 0.00 0.00 57.85 57.75 3fgw n ARG 373 Cb 0.05 -2.65 0.00 0.00 -1.02 0.00 0.00 32.46 28.84 3fgw n ARG 373 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3fgw n PHE 374 N 2.79 -1.85 -1.64 -1.55 3.01 -1.26 -4.79 117.46 112.17 3fgw n PHE 374 Ca 0.13 0.81 -0.48 0.00 1.01 0.00 0.00 57.45 58.91 3fgw n PHE 374 Cb 0.33 -3.85 -0.05 0.00 -0.01 0.00 0.00 39.48 35.91 3fgw n PHE 374 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3fgw n ASN 375 N -2.93 2.49 0.01 4.37 5.15 -1.00 -0.89 115.26 122.45 3fgw n ASN 375 Ca -0.19 1.10 0.10 0.00 -0.60 0.00 0.00 54.58 54.99 3fgw n ASN 375 Cb 0.63 -1.33 -0.14 0.00 -0.53 0.00 0.00 39.78 38.41 3fgw n ASN 375 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3fgw n SER 376 N 3.05 0.16 -0.02 1.20 3.41 -1.26 -4.68 113.62 115.49 3fgw n SER 376 Ca 0.18 0.06 -0.00 0.00 -0.26 0.00 0.00 58.87 58.85 3fgw n SER 376 Cb 0.25 1.65 -0.00 0.00 -0.26 0.00 0.00 64.21 65.84 3fgw n SER 376 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fgw n GLY 377 N 1.27 0.38 3.58 5.00 0.00 -1.26 -4.30 105.19 109.87 3fgw n GLY 377 Ca -0.05 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 3fgw n GLY 377 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fgw s THR 378 N -1.75 3.56 -0.63 2.61 -4.23 -1.26 -4.26 115.64 109.68 3fgw s THR 378 Ca 0.00 -0.80 -0.10 0.00 -1.18 0.00 0.00 61.69 59.61 3fgw s THR 378 Cb 0.00 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.31 3fgw s THR 378 CO 0.00 0.39 0.65 0.00 -0.54 0.00 0.00 174.62 175.12 3fgw n TYR 379 N 1.58 -2.90 -2.88 3.99 -0.00 -1.26 -4.30 117.16 111.38 3fgw n TYR 379 Ca -0.16 1.15 -0.42 0.00 -0.00 0.00 0.00 57.90 58.47 3fgw n TYR 379 Cb 0.52 -3.52 -0.04 0.00 -0.00 0.00 0.00 39.34 36.30 3fgw n TYR 379 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.86 176.06 3fgw s ASN 380 N -2.68 6.59 0.18 2.98 0.01 -1.26 -4.94 114.94 115.82 3fgw s ASN 380 Ca 0.12 0.40 0.05 0.00 -0.71 0.00 0.00 52.86 52.73 3fgw s ASN 380 Cb -0.03 -2.43 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 3fgw s ASN 380 CO 0.80 -0.82 -0.10 0.20 -1.51 0.00 0.00 177.10 175.67 3fgw s ASN 381 N 1.91 2.04 -0.30 -1.22 0.01 -1.25 -0.18 114.94 115.96 3fgw s ASN 381 Ca 0.34 -1.05 -0.15 0.00 -0.71 0.00 0.00 52.86 51.30 3fgw s ASN 381 Cb -0.12 -0.05 -0.03 0.00 0.41 0.00 0.00 41.25 41.46 3fgw s ASN 381 CO 0.19 -0.31 0.36 -1.58 -1.51 0.00 0.00 177.10 174.24 3fgw s GLN 382 N -3.74 3.85 -0.31 -0.60 0.74 -0.38 -2.17 119.66 117.06 3fgw s GLN 382 Ca 0.20 -0.15 -0.10 0.00 0.05 0.00 0.00 55.36 55.36 3fgw s GLN 382 Cb 0.02 -3.71 -0.02 0.00 1.10 0.00 0.00 33.01 30.40 3fgw s GLN 382 CO 0.04 -0.36 0.17 -1.58 -0.55 0.00 0.00 175.29 173.00 3fgw s TRP 383 N 2.04 3.18 -0.28 1.67 0.52 0.29 -2.57 118.94 123.79 3fgw s TRP 383 Ca 0.13 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.71 3fgw s TRP 383 Cb -0.16 -2.37 -0.03 0.00 -1.15 0.00 0.00 33.47 29.76 3fgw s TRP 383 CO 0.11 -0.38 0.40 -1.64 0.02 0.00 0.00 176.95 175.45 3fgw s MET 384 N 1.66 3.96 -0.30 4.98 -1.94 0.10 -1.33 119.30 126.42 3fgw s MET 384 Ca 0.05 0.02 -0.02 0.00 -1.71 0.00 0.00 55.69 54.03 3fgw s MET 384 Cb -0.17 -3.68 0.05 0.00 2.01 0.00 0.00 34.83 33.04 3fgw s MET 384 CO 0.07 -0.33 0.01 0.42 -0.01 0.00 0.00 175.02 175.19 3fgw s ILE 385 N 2.11 3.10 -0.24 2.53 1.09 -0.37 -2.10 121.20 127.32 3fgw s ILE 385 Ca 0.16 -1.34 -0.09 0.00 -1.10 0.00 0.00 60.65 58.28 3fgw s ILE 385 Cb -0.16 -2.78 -0.04 0.00 -1.06 0.00 0.00 42.46 38.43 3fgw s ILE 385 CO 0.10 -0.11 0.12 -0.69 -0.10 0.00 0.00 174.94 174.26 3fgw s VAL 386 N 1.28 4.88 -0.47 2.92 1.01 0.23 -1.89 120.40 128.35 3fgw s VAL 386 Ca -0.05 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 3fgw s VAL 386 Cb -0.20 -3.27 0.12 0.00 0.00 0.00 0.00 36.38 33.03 3fgw s VAL 386 CO -0.01 0.35 0.35 -0.62 0.00 0.00 0.00 175.10 175.17 3fgw s ASP 387 N 1.26 5.71 0.51 3.32 3.68 -0.29 -0.30 116.67 130.56 3fgw s ASP 387 Ca 0.06 -1.89 0.34 0.00 2.13 0.00 0.00 52.55 53.18 3fgw s ASP 387 Cb -0.14 -2.02 1.53 0.00 -1.45 0.00 0.00 42.92 40.84 3fgw s ASP 387 CO 0.05 -0.69 2.00 1.88 0.13 0.00 0.00 175.17 178.54 3fgw h TYR 388 N 8.46 0.00 -0.42 -5.34 0.99 -0.78 -1.74 116.97 118.14 3fgw h TYR 388 Ca -0.21 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.48 3fgw h TYR 388 Cb 1.07 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 38.78 3fgw h TYR 388 CO 0.64 0.00 0.11 0.87 -0.00 0.00 0.00 178.16 179.77 3fgw h LYS 389 N 0.00 0.63 0.00 4.88 1.57 -1.88 -2.47 116.57 119.30 3fgw h LYS 389 Ca 0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3fgw h LYS 389 Cb 0.33 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3fgw h LYS 389 CO 0.00 0.57 -0.11 0.00 -0.57 0.00 0.00 179.45 179.34 3fgw n ALA 390 N -2.47 2.46 -2.68 3.86 0.00 -0.66 -4.81 120.51 116.21 3fgw n ALA 390 Ca 0.03 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.96 3fgw n ALA 390 Cb 0.20 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.19 3fgw n ALA 390 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3fgw s PHE 391 N -3.07 3.44 -0.25 0.00 5.36 -0.93 -4.80 117.98 117.74 3fgw s PHE 391 Ca 0.11 1.20 -0.04 0.00 -0.96 0.00 0.00 56.93 57.24 3fgw s PHE 391 Cb 0.15 -2.94 0.00 0.00 -0.34 0.00 0.00 43.02 39.89 3fgw s PHE 391 CO 0.60 -0.17 -0.01 -1.17 -1.46 0.00 0.00 175.22 173.01 3fgw s LEU 392 N 1.86 3.23 0.22 6.12 2.96 -1.26 -4.99 118.68 126.82 3fgw s LEU 392 Ca 0.37 -0.56 -0.32 0.00 -0.22 0.00 0.00 54.13 53.40 3fgw s LEU 392 Cb -0.17 -1.77 -0.13 0.00 0.50 0.00 0.00 46.19 44.62 3fgw s LEU 392 CO 0.13 -0.09 1.54 -2.65 -1.32 0.00 0.00 176.35 173.97 3fgw n PRO 393 N 4.80 2.31 0.00 0.98 -0.02 -1.26 -2.28 135.00 139.52 3fgw n PRO 393 Ca -0.17 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 3fgw n PRO 393 Cb 0.49 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 3fgw n PRO 393 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3fgw n ASN 394 N 2.75 0.00 -4.12 2.55 3.02 0.14 -4.96 115.26 114.64 3fgw n ASN 394 Ca 0.13 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.38 3fgw n ASN 394 Cb 0.32 -0.85 0.20 0.00 -0.61 0.00 0.00 39.78 38.84 3fgw n ASN 394 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3fgw s GLY 395 N -1.81 1.66 0.34 7.41 0.00 -0.97 -4.75 107.32 109.20 3fgw s GLY 395 Ca 0.00 -0.97 -0.03 0.00 0.00 0.00 0.00 44.72 43.72 3fgw s GLY 395 CO 0.00 -0.19 0.46 -1.55 0.00 0.00 0.00 173.10 171.82 3fgw n PRO 396 N -4.19 -0.05 -2.04 2.90 -0.04 -1.26 -4.75 135.00 125.57 3fgw n PRO 396 Ca 0.13 -0.97 -0.42 0.00 -0.04 0.00 0.00 63.50 62.19 3fgw n PRO 396 Cb 0.59 -0.39 -0.03 0.00 -0.04 0.00 0.00 33.50 33.63 3fgw n PRO 396 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3fgw s SER 397 N -2.77 6.70 0.00 3.54 0.15 -1.26 -4.88 113.70 115.18 3fgw s SER 397 Ca 0.28 2.39 0.23 0.00 0.70 0.00 0.00 55.95 59.55 3fgw s SER 397 Cb -0.01 -2.57 1.25 0.00 -1.71 0.00 0.00 66.02 62.97 3fgw s SER 397 CO 0.19 -0.79 1.76 -2.65 1.20 0.00 0.00 173.24 172.95 3fgw n PRO 398 N 4.93 0.48 0.00 5.44 -0.02 -1.26 -4.90 135.00 139.67 3fgw n PRO 398 Ca 0.14 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3fgw n PRO 398 Cb 0.41 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3fgw n PRO 398 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fgw n GLY 399 N 0.59 2.70 3.54 -1.23 0.00 -1.26 -4.91 105.19 104.62 3fgw n GLY 399 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 3fgw n GLY 399 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fgw s SER 400 N -0.10 -0.46 0.00 1.61 1.04 -1.26 -4.32 113.70 110.21 3fgw s SER 400 Ca 0.00 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.23 3fgw s SER 400 Cb 0.00 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3fgw s SER 400 CO 0.00 -1.07 0.00 0.54 0.98 0.00 0.00 173.24 173.69 3fgw n ARG 401 N -0.40 0.00 0.09 4.02 1.74 -1.26 -4.89 116.66 115.97 3fgw n ARG 401 Ca -0.13 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.84 3fgw n ARG 401 Cb 0.63 -0.41 -0.07 0.00 -1.02 0.00 0.00 32.46 31.58 3fgw n ARG 401 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3fgw h VAL 402 N 0.00 0.75 -3.24 1.55 2.07 -1.87 -3.39 116.25 112.12 3fgw h VAL 402 Ca 0.00 -0.95 -0.66 0.00 0.82 0.00 0.00 66.70 65.91 3fgw h VAL 402 Cb 0.00 1.22 -0.34 0.00 -1.52 0.00 0.00 31.29 30.65 3fgw h VAL 402 CO 0.00 0.18 -0.86 -0.22 0.02 0.00 0.00 177.57 176.68 3fgw s LEU 403 N -9.13 2.03 -0.09 2.57 2.96 -1.26 -1.14 118.68 114.62 3fgw s LEU 403 Ca -0.13 -0.56 0.03 0.00 -0.22 0.00 0.00 54.13 53.26 3fgw s LEU 403 Cb 0.01 -1.36 0.00 0.00 0.50 0.00 0.00 46.19 45.34 3fgw s LEU 403 CO 0.48 0.08 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.50 3fgw s THR 404 N 0.76 1.76 -0.17 3.68 2.01 -0.79 -0.76 115.64 122.12 3fgw s THR 404 Ca -0.09 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.04 3fgw s THR 404 Cb -0.16 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 70.79 3fgw s THR 404 CO 0.00 0.49 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.72 3fgw s ILE 405 N 0.47 3.35 -0.04 1.82 1.09 -0.16 -1.24 121.20 126.48 3fgw s ILE 405 Ca -0.17 -0.53 0.07 0.00 -1.10 0.00 0.00 60.65 58.91 3fgw s ILE 405 Cb -0.17 -2.47 -0.01 0.00 -1.06 0.00 0.00 42.46 38.75 3fgw s ILE 405 CO 0.07 0.48 -0.25 -0.22 -0.10 0.00 0.00 174.94 174.91 3fgw s LEU 406 N 0.80 2.06 -0.03 2.97 0.20 -0.44 -1.47 118.68 122.76 3fgw s LEU 406 Ca -0.03 -0.50 0.04 0.00 0.69 0.00 0.00 54.13 54.33 3fgw s LEU 406 Cb -0.15 -1.36 -0.00 0.00 -0.43 0.00 0.00 46.19 44.25 3fgw s LEU 406 CO 0.01 0.27 -0.14 -1.61 -0.29 0.00 0.00 176.35 174.60 3fgw s GLU 407 N -0.33 1.36 -0.08 1.98 2.02 -0.32 0.10 118.70 123.44 3fgw s GLU 407 Ca 0.01 -0.48 0.04 0.00 0.02 0.00 0.00 54.97 54.56 3fgw s GLU 407 Cb -0.12 -1.23 -0.00 0.00 0.10 0.00 0.00 34.13 32.87 3fgw s GLU 407 CO 0.02 0.22 -0.21 -1.14 0.02 0.00 0.00 175.26 174.17 3fgw s GLN 408 N -0.00 2.52 0.17 1.61 0.74 -0.92 -1.61 119.66 122.16 3fgw s GLN 408 Ca -0.01 -0.76 0.01 0.00 0.05 0.00 0.00 55.36 54.65 3fgw s GLN 408 Cb -0.09 -2.00 -0.05 0.00 1.10 0.00 0.00 33.01 31.98 3fgw s GLN 408 CO 0.01 0.20 0.02 0.96 -0.55 0.00 0.00 175.29 175.93 3fgw s ILE 409 N 0.25 0.60 -0.27 -2.34 -4.36 -0.20 -3.79 121.20 111.10 3fgw s ILE 409 Ca -0.13 -1.97 -0.39 0.00 -0.26 0.00 0.00 60.65 57.90 3fgw s ILE 409 Cb -0.16 -2.15 -0.15 0.00 1.25 0.00 0.00 42.46 41.26 3fgw s ILE 409 CO 0.06 -0.44 1.84 -2.65 0.24 0.00 0.00 174.94 173.99 3fgw n PRO 410 N -0.24 1.28 -0.97 0.37 -0.02 -1.26 -1.15 135.00 133.00 3fgw n PRO 410 Ca -0.06 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3fgw n PRO 410 Cb 0.63 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3fgw n PRO 410 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fgw n GLY 411 N 4.63 0.64 2.95 -1.23 0.00 -1.26 -4.92 105.19 105.99 3fgw n GLY 411 Ca 0.29 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.17 3fgw n GLY 411 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3fgw s MET 412 N -0.19 0.11 -0.07 1.61 -2.45 -0.30 -5.13 119.30 112.87 3fgw s MET 412 Ca 0.00 0.45 -0.00 0.00 -1.25 0.00 0.00 55.69 54.88 3fgw s MET 412 Cb 0.00 -0.17 0.03 0.00 1.25 0.00 0.00 34.83 35.93 3fgw s MET 412 CO 0.00 -0.19 -0.03 0.08 1.05 0.00 0.00 175.02 175.93 3fgw s VAL 413 N 1.39 0.60 -0.12 10.11 1.01 -1.26 -1.03 120.40 131.09 3fgw s VAL 413 Ca -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.85 3fgw s VAL 413 Cb -0.11 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.57 3fgw s VAL 413 CO -0.07 0.28 -0.13 -0.69 0.00 0.00 0.00 175.10 174.49 3fgw s VAL 414 N 1.61 3.03 0.04 2.92 1.01 -0.63 -4.98 120.40 123.40 3fgw s VAL 414 Ca 0.00 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.40 3fgw s VAL 414 Cb -0.13 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 3fgw s VAL 414 CO -0.04 0.53 -0.24 -0.69 0.00 0.00 0.00 175.10 174.65 3fgw s VAL 415 N 0.25 1.97 -0.02 2.92 1.01 -1.26 -1.17 120.40 124.10 3fgw s VAL 415 Ca -0.09 -1.30 -0.22 0.00 0.00 0.00 0.00 61.98 60.37 3fgw s VAL 415 Cb -0.16 -1.69 0.04 0.00 0.00 0.00 0.00 36.38 34.58 3fgw s VAL 415 CO 0.05 0.33 0.47 0.00 0.00 0.00 0.00 175.10 175.95 3fgw s ALA 416 N -0.78 -1.20 -0.48 5.51 0.00 -0.54 -5.02 121.76 119.26 3fgw s ALA 416 Ca 0.10 0.72 -0.21 0.00 0.00 0.00 0.00 51.96 52.57 3fgw s ALA 416 Cb -0.10 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.13 3fgw s ALA 416 CO 0.02 -0.32 0.69 0.34 0.00 0.00 0.00 175.76 176.48 3fgw s ASP 417 N -1.33 6.30 -0.53 0.00 -1.08 -1.26 -0.99 116.67 117.77 3fgw s ASP 417 Ca -0.12 -0.50 0.01 0.00 -0.52 0.00 0.00 52.55 51.42 3fgw s ASP 417 Cb -0.03 -2.33 0.48 0.00 -1.46 0.00 0.00 42.92 39.58 3fgw s ASP 417 CO 0.06 -0.89 1.78 0.29 0.52 0.00 0.00 175.17 176.94 3fgw n LYS 418 N 6.43 2.82 0.06 4.34 4.76 0.06 -4.66 118.16 131.97 3fgw n LYS 418 Ca -0.02 -3.47 -0.13 0.00 -2.87 0.00 0.00 58.31 51.81 3fgw n LYS 418 Cb 0.47 -2.25 -0.08 0.00 -1.84 0.00 0.00 35.03 31.33 3fgw n LYS 418 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3fgw h THR 419 N 1.29 1.06 -0.63 -0.18 2.02 -1.84 -1.83 112.91 112.79 3fgw h THR 419 Ca 0.53 -0.57 0.11 0.00 0.77 0.00 0.00 66.41 67.25 3fgw h THR 419 Cb 1.22 1.43 -0.08 0.00 -1.74 0.00 0.00 68.15 68.98 3fgw h THR 419 CO 1.27 0.14 0.19 0.00 0.37 0.00 0.00 175.52 177.49 3fgw h ALA 420 N 0.49 0.80 -0.06 6.16 0.00 -1.83 -0.78 119.26 124.03 3fgw h ALA 420 Ca -0.01 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3fgw h ALA 420 Cb 0.33 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3fgw h ALA 420 CO 0.02 -0.26 -0.06 1.49 0.00 0.00 0.00 179.25 180.44 3fgw h GLU 421 N 0.33 -0.07 -0.70 0.00 4.57 -1.89 0.32 114.58 117.14 3fgw h GLU 421 Ca 0.33 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.62 3fgw h GLU 421 Cb 0.48 0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 29.01 3fgw h GLU 421 CO -0.38 -0.05 0.32 1.25 -1.18 0.00 0.00 179.01 178.97 3fgw h LEU 422 N -0.08 0.38 0.02 1.64 5.85 -0.49 -1.05 115.31 121.59 3fgw h LEU 422 Ca 0.05 0.07 -0.23 0.00 0.84 0.00 0.00 57.88 58.61 3fgw h LEU 422 Cb 0.14 0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.21 3fgw h LEU 422 CO -0.11 0.21 -0.91 1.88 -0.34 0.00 0.00 178.44 179.17 3fgw h TYR 423 N 0.53 0.88 -0.08 1.25 0.05 -0.86 0.35 116.97 119.11 3fgw h TYR 423 Ca 0.35 -0.49 -0.00 0.00 0.05 0.00 0.00 58.73 58.64 3fgw h TYR 423 Cb 0.42 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 3fgw h TYR 423 CO -0.13 1.33 0.05 -0.22 -1.05 0.00 0.00 178.16 178.13 3fgw h LYS 424 N 0.18 0.10 -0.01 4.88 3.64 -0.20 -3.17 116.57 122.00 3fgw h LYS 424 Ca -0.12 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3fgw h LYS 424 Cb 1.59 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.39 3fgw h LYS 424 CO 0.18 0.11 -0.58 0.25 -2.27 0.00 0.00 179.45 177.14 3fgw n THR 425 N -5.01 0.00 -0.92 1.00 -2.24 -0.41 -4.97 114.28 101.72 3fgw n THR 425 Ca -0.06 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3fgw n THR 425 Cb 0.05 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3fgw n THR 425 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3fgw n THR 426 N -0.97 0.00 -3.53 4.28 -2.24 0.12 -4.95 114.28 106.98 3fgw n THR 426 Ca 0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.74 3fgw n THR 426 Cb 0.37 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 3fgw n THR 426 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3fgw s TYR 427 N -1.49 -0.41 -0.10 4.78 1.13 -1.06 -0.94 117.35 119.27 3fgw s TYR 427 Ca 0.00 0.14 -0.02 0.00 -1.41 0.00 0.00 57.07 55.78 3fgw s TYR 427 Cb 0.00 0.51 0.04 0.00 -1.10 0.00 0.00 41.96 41.41 3fgw s TYR 427 CO 0.00 -0.87 0.01 -0.46 -2.51 0.00 0.00 175.55 171.72 3fgw s TRP 428 N -3.79 0.70 0.28 -3.49 -0.11 0.70 -4.56 118.94 108.68 3fgw s TRP 428 Ca 0.03 -0.30 0.03 0.00 1.22 0.00 0.00 56.10 57.08 3fgw s TRP 428 Cb -0.01 -0.83 -0.03 0.00 -1.50 0.00 0.00 33.47 31.10 3fgw s TRP 428 CO -0.10 -0.39 0.43 0.00 -4.62 0.00 0.00 176.95 172.28 3fgw s ALA 429 N 1.96 3.85 -0.10 5.86 0.00 -1.26 -0.31 121.76 131.77 3fgw s ALA 429 Ca 0.04 -1.12 -0.09 0.00 0.00 0.00 0.00 51.96 50.79 3fgw s ALA 429 Cb -0.13 -1.87 0.03 0.00 0.00 0.00 0.00 23.12 21.14 3fgw s ALA 429 CO -0.06 0.13 0.27 0.45 0.00 0.00 0.00 175.76 176.55 3fgw s SER 430 N -4.01 -0.27 0.00 0.00 0.15 0.70 -4.95 113.70 105.32 3fgw s SER 430 Ca 0.36 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.53 3fgw s SER 430 Cb -0.09 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 3fgw s SER 430 CO 0.32 -0.11 0.00 0.00 1.20 0.00 0.00 173.24 174.65 3fgw n TYR 431 N 2.85 0.00 1.93 3.44 4.11 -1.26 -1.53 117.16 126.70 3fgw n TYR 431 Ca -0.13 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.83 3fgw n TYR 431 Cb 0.58 0.00 0.37 0.00 -0.00 0.00 0.00 39.34 40.29 3fgw n TYR 431 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 3fgw n ASN 432 N 0.00 0.14 -4.22 9.48 6.94 -1.26 -4.62 115.26 121.72 3fgw n ASN 432 Ca 0.00 -1.62 -0.34 0.00 -0.02 0.00 0.00 54.58 52.61 3fgw n ASN 432 Cb 0.00 -0.01 -0.15 0.00 -2.36 0.00 0.00 39.78 37.26 3fgw n ASN 432 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3fgw s ILE 433 N -1.98 2.67 0.43 1.53 -1.09 -1.26 -4.42 121.20 117.08 3fgw s ILE 433 Ca 0.20 -0.74 -0.26 0.00 -2.23 0.00 0.00 60.65 57.62 3fgw s ILE 433 Cb 0.09 -2.16 -0.09 0.00 -1.58 0.00 0.00 42.46 38.72 3fgw s ILE 433 CO 0.15 0.49 1.44 -0.81 -1.23 0.00 0.00 174.94 174.99 3fgw n PRO 434 N 4.59 2.35 0.04 2.79 -0.04 -1.26 -4.98 135.00 138.49 3fgw n PRO 434 Ca -0.20 0.83 -0.07 0.00 -0.04 0.00 0.00 63.50 64.03 3fgw n PRO 434 Cb 0.51 -2.63 -0.04 0.00 -0.04 0.00 0.00 33.50 31.29 3fgw n PRO 434 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 3fgw h TYR 435 N 2.45 -0.20 -2.21 0.54 5.03 -1.99 -3.44 116.97 117.15 3fgw h TYR 435 Ca -0.51 -0.00 -0.58 0.00 2.58 0.00 0.00 58.73 60.22 3fgw h TYR 435 Cb 1.26 0.07 0.03 0.00 1.55 0.00 0.00 36.73 39.64 3fgw h TYR 435 CO 0.50 0.06 1.09 1.19 -1.32 0.00 0.00 178.16 179.69 3fgw n PHE 436 N -4.91 2.41 -0.35 -3.82 3.01 -1.26 -4.87 117.46 107.68 3fgw n PHE 436 Ca -0.05 -0.08 0.13 0.00 1.01 0.00 0.00 57.45 58.46 3fgw n PHE 436 Cb 0.18 -2.69 0.32 0.00 -0.01 0.00 0.00 39.48 37.28 3fgw n PHE 436 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3fgw h GLU 437 N 8.99 0.75 0.70 -1.08 4.57 -2.00 -1.89 114.58 124.62 3fgw h GLU 437 Ca -0.48 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 57.62 3fgw h GLU 437 Cb 1.25 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 29.68 3fgw h GLU 437 CO 0.94 0.49 -0.34 1.15 -1.18 0.00 0.00 179.01 180.08 3fgw h THR 438 N 0.77 0.29 -0.83 0.32 2.02 -1.99 -2.58 112.91 110.91 3fgw h THR 438 Ca 0.57 -0.07 0.11 0.00 0.77 0.00 0.00 66.41 67.80 3fgw h THR 438 Cb 0.89 0.31 -0.08 0.00 -1.74 0.00 0.00 68.15 67.53 3fgw h THR 438 CO -0.37 0.01 0.46 0.58 0.37 0.00 0.00 175.52 176.57 3fgw h VAL 439 N -0.99 0.84 -0.05 3.16 2.07 -1.80 0.17 116.25 119.66 3fgw h VAL 439 Ca -0.10 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.20 3fgw h VAL 439 Cb 0.73 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3fgw h VAL 439 CO 0.16 0.13 -0.12 0.15 0.02 0.00 0.00 177.57 177.91 3fgw h PHE 440 N 0.73 -0.31 -0.04 1.57 3.04 -1.33 0.16 116.94 120.76 3fgw h PHE 440 Ca 0.42 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.38 3fgw h PHE 440 Cb 0.47 0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.12 3fgw h PHE 440 CO -0.07 -0.18 0.01 -0.91 -2.02 0.00 0.00 178.31 175.13 3fgw h ASN 441 N -0.18 0.06 -0.82 0.41 4.21 -0.97 -2.63 115.58 115.65 3fgw h ASN 441 Ca 0.06 -0.24 0.00 0.00 1.21 0.00 0.00 56.30 57.33 3fgw h ASN 441 Cb 0.26 -0.02 -0.04 0.00 -1.12 0.00 0.00 38.32 37.41 3fgw h ASN 441 CO -0.15 0.28 0.53 0.00 -1.29 0.00 0.00 177.43 176.80 3fgw h ALA 442 N 0.78 1.39 0.00 -0.83 0.00 -0.55 -1.22 119.26 118.82 3fgw h ALA 442 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3fgw h ALA 442 Cb 0.25 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3fgw h ALA 442 CO 0.00 0.56 0.00 -1.13 0.00 0.00 0.00 179.25 178.68 3fgw n SER 443 N -4.40 0.00 -0.81 0.00 3.41 0.03 -4.79 113.62 107.07 3fgw n SER 443 Ca 0.09 -0.62 -0.02 0.00 -0.26 0.00 0.00 58.87 58.06 3fgw n SER 443 Cb 0.04 -0.10 0.01 0.00 -0.26 0.00 0.00 64.21 63.89 3fgw n SER 443 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fgw n GLY 444 N 0.89 0.80 0.04 5.00 0.00 -0.46 -1.97 105.19 109.49 3fgw n GLY 444 Ca 0.19 -0.59 0.12 0.00 0.00 0.00 0.00 46.02 45.74 3fgw n GLY 444 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fgw n LEU 445 N -0.95 0.63 -0.14 0.99 4.77 -1.00 -4.09 117.00 117.21 3fgw n LEU 445 Ca 0.00 0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 56.02 3fgw n LEU 445 Cb 0.51 -0.16 0.15 0.00 -2.33 0.00 0.00 43.42 41.59 3fgw n LEU 445 CO 0.07 0.02 0.92 1.56 -1.33 0.00 0.00 177.39 178.62 3fgw h GLN 446 N 0.00 0.86 -0.24 3.23 1.08 -1.85 -1.57 115.11 116.61 3fgw h GLN 446 Ca 0.00 -0.21 -0.08 0.00 -1.45 0.00 0.00 58.65 56.91 3fgw h GLN 446 Cb 0.69 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 3fgw h GLN 446 CO 0.00 0.82 -0.20 0.00 -0.95 0.00 0.00 178.83 178.49 3fgw h ALA 447 N 1.25 1.20 0.00 3.87 0.00 -1.97 -1.64 119.26 121.98 3fgw h ALA 447 Ca 0.17 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 3fgw h ALA 447 Cb 0.40 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3fgw h ALA 447 CO 0.01 0.51 -0.86 -0.07 0.00 0.00 0.00 179.25 178.85 3fgw h LEU 448 N 0.39 0.16 -0.21 0.00 3.38 -1.66 -1.56 115.31 115.82 3fgw h LEU 448 Ca 0.07 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3fgw h LEU 448 Cb 0.58 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3fgw h LEU 448 CO 0.04 0.94 0.00 0.58 0.09 0.00 0.00 178.44 180.10 3fgw h VAL 449 N 0.07 1.25 0.00 1.22 2.07 -1.16 0.12 116.25 119.83 3fgw h VAL 449 Ca -0.03 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 3fgw h VAL 449 Cb 1.49 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 3fgw h VAL 449 CO 0.12 0.27 -0.16 0.00 0.02 0.00 0.00 177.57 177.83 3fgw h ALA 450 N 0.79 1.38 0.02 1.67 0.00 -1.27 0.36 119.26 122.21 3fgw h ALA 450 Ca 0.06 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 3fgw h ALA 450 Cb 0.39 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3fgw h ALA 450 CO 0.01 0.20 -2.08 0.94 0.00 0.00 0.00 179.25 178.32 3fgw n GLN 451 N -3.82 0.67 0.00 0.00 7.27 -0.59 -4.64 117.38 116.27 3fgw n GLN 451 Ca -0.02 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.22 3fgw n GLN 451 Cb 0.26 -1.65 0.00 0.00 2.41 0.00 0.00 30.24 31.25 3fgw n GLN 451 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 3fgw n TYR 452 N -3.03 0.00 -4.12 3.69 4.02 0.41 -5.07 117.16 113.06 3fgw n TYR 452 Ca -0.28 -0.14 0.00 0.00 -0.01 0.00 0.00 57.90 57.47 3fgw n TYR 452 Cb 1.08 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.39 3fgw n TYR 452 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3fgw n GLY 453 N -0.14 -0.78 0.00 2.72 0.00 0.13 -4.26 105.19 102.85 3fgw n GLY 453 Ca 0.00 -1.17 0.09 0.00 0.00 0.00 0.00 46.02 44.94 3fgw n GLY 453 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fgw n ASP 454 N 0.05 0.00 0.25 1.61 10.43 -1.26 -2.78 116.55 124.86 3fgw n ASP 454 Ca 0.00 -0.58 0.12 0.00 2.57 0.00 0.00 54.79 56.90 3fgw n ASP 454 Cb 0.00 0.00 0.67 0.00 1.84 0.00 0.00 41.12 43.63 3fgw n ASP 454 CO 0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 177.20 175.88 3fgw h TRP 455 N 0.00 0.00 -0.00 1.24 7.01 -1.82 -1.63 115.95 120.74 3fgw h TRP 455 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3fgw h TRP 455 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.06 3fgw h TRP 455 CO 0.00 0.14 -0.60 1.19 -2.79 0.00 0.00 178.44 176.38 3fgw n PHE 456 N -3.59 0.00 -1.90 2.65 3.01 -1.12 -4.70 117.46 111.80 3fgw n PHE 456 Ca -0.01 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.08 3fgw n PHE 456 Cb 0.28 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.79 3fgw n PHE 456 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3fgw s SER 457 N -2.31 5.07 0.08 4.37 0.15 -1.02 -4.85 113.70 115.18 3fgw s SER 457 Ca 0.09 2.53 -0.14 0.00 0.70 0.00 0.00 55.95 59.12 3fgw s SER 457 Cb 0.13 -2.61 -0.18 0.00 -1.71 0.00 0.00 66.02 61.65 3fgw s SER 457 CO 0.57 -1.69 1.26 0.22 1.20 0.00 0.00 173.24 174.80 3fgw h TYR 458 N 0.94 0.98 -0.06 3.44 5.03 -1.91 -3.23 116.97 122.15 3fgw h TYR 458 Ca -0.51 -0.46 0.00 0.00 2.58 0.00 0.00 58.73 60.35 3fgw h TYR 458 Cb 1.31 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 39.45 3fgw h TYR 458 CO 0.45 1.28 0.00 0.25 -1.32 0.00 0.00 178.16 178.82 3fgw n THR 459 N -4.00 0.07 -0.29 1.81 -2.24 -1.26 -4.55 114.28 103.83 3fgw n THR 459 Ca -0.08 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 3fgw n THR 459 Cb 0.74 1.33 0.00 0.00 -2.10 0.00 0.00 70.33 70.30 3fgw n THR 459 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3fgw n LYS 460 N 1.06 -0.57 -2.09 -0.78 5.02 -1.26 -4.55 118.16 115.00 3fgw n LYS 460 Ca 0.12 -0.40 -0.34 0.00 -2.02 0.00 0.00 58.31 55.67 3fgw n LYS 460 Cb 0.47 -0.86 0.02 0.00 -0.02 0.00 0.00 35.03 34.64 3fgw n LYS 460 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3fgw s ASN 461 N -0.03 5.54 0.26 4.39 2.20 -0.64 -4.62 114.94 122.03 3fgw s ASN 461 Ca 0.00 2.10 -0.09 0.00 -0.94 0.00 0.00 52.86 53.93 3fgw s ASN 461 Cb 0.00 -2.57 0.41 0.00 -2.00 0.00 0.00 41.25 37.09 3fgw s ASN 461 CO 0.00 -1.34 1.47 -2.65 -2.94 0.00 0.00 177.10 171.64 3fgw n PRO 462 N -1.69 -0.10 -0.14 3.55 -0.02 -1.26 -1.49 135.00 133.85 3fgw n PRO 462 Ca 0.11 1.47 -0.12 0.00 -2.02 0.00 0.00 63.50 62.94 3fgw n PRO 462 Cb 0.51 -2.19 -0.01 0.00 -0.02 0.00 0.00 33.50 31.80 3fgw n PRO 462 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fgw h ARG 463 N 0.00 0.98 -0.92 -0.52 3.08 -1.89 -2.29 114.38 112.83 3fgw h ARG 463 Ca 0.44 -0.46 0.04 0.00 0.07 0.00 0.00 59.98 60.07 3fgw h ARG 463 Cb 0.67 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.65 3fgw h ARG 463 CO -0.97 1.13 0.60 0.00 -1.07 0.00 0.00 179.97 179.66 3fgw h ALA 464 N 0.83 1.22 -0.41 0.04 0.00 -1.57 -1.88 119.26 117.49 3fgw h ALA 464 Ca 0.09 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 3fgw h ALA 464 Cb 0.87 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3fgw h ALA 464 CO 0.08 0.45 -0.25 0.87 0.00 0.00 0.00 179.25 180.40 3fgw h LYS 465 N 1.15 0.89 -0.50 0.00 1.57 -1.30 -1.68 116.57 116.70 3fgw h LYS 465 Ca 0.37 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3fgw h LYS 465 Cb 0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3fgw h LYS 465 CO -0.12 1.07 0.23 0.82 -0.57 0.00 0.00 179.45 180.87 3fgw h ILE 466 N 0.71 1.20 -0.15 1.86 2.04 -1.08 -2.30 117.51 119.79 3fgw h ILE 466 Ca 0.08 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3fgw h ILE 466 Cb 0.83 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3fgw h ILE 466 CO 0.07 0.22 0.09 -0.26 0.00 0.00 0.00 178.15 178.27 3fgw h PHE 467 N 0.66 0.17 -1.01 1.37 -1.00 -1.37 -1.55 116.94 114.21 3fgw h PHE 467 Ca 0.17 0.00 0.25 0.00 2.81 0.00 0.00 57.97 61.20 3fgw h PHE 467 Cb 0.14 -0.06 -0.09 0.00 3.61 0.00 0.00 35.95 39.55 3fgw h PHE 467 CO -0.00 0.10 0.65 1.96 -1.61 0.00 0.00 178.31 179.41 3fgw h GLN 468 N 0.19 0.42 -0.01 1.51 4.20 -0.83 -0.04 115.11 120.55 3fgw h GLN 468 Ca 0.06 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3fgw h GLN 468 Cb -0.01 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.67 3fgw h GLN 468 CO -0.02 0.28 -0.34 2.89 -0.67 0.00 0.00 178.83 180.97 3fgw n ARG 469 N -4.62 1.93 0.00 1.46 -4.01 -0.91 -4.66 116.66 105.84 3fgw n ARG 469 Ca 0.24 -0.63 0.00 0.00 -1.04 0.00 0.00 57.85 56.42 3fgw n ARG 469 Cb 0.82 -1.20 0.00 0.00 -3.04 0.00 0.00 32.46 29.04 3fgw n ARG 469 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 3fgw n ASP 470 N -0.33 1.24 0.25 2.89 8.00 -0.59 -4.80 116.55 123.20 3fgw n ASP 470 Ca 0.05 -0.30 0.11 0.00 0.71 0.00 0.00 54.79 55.36 3fgw n ASP 470 Cb 0.28 0.85 0.64 0.00 -0.02 0.00 0.00 41.12 42.87 3fgw n ASP 470 CO 0.00 0.00 0.00 0.06 -0.39 0.00 0.00 177.20 176.87 3fgw h GLN 471 N 0.00 0.00 0.00 -1.24 -0.00 -1.21 -2.63 115.11 110.03 3fgw h GLN 471 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3fgw h GLN 471 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.48 3fgw h GLN 471 CO 0.00 0.16 -0.02 0.66 -0.00 0.00 0.00 178.83 179.63 3fgw h SER 472 N 0.00 0.00 0.88 0.06 4.64 -1.87 -3.10 113.55 114.16 3fgw h SER 472 Ca -0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 3fgw h SER 472 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 3fgw h SER 472 CO 0.02 0.02 -0.49 -0.07 -0.87 0.00 0.00 176.83 175.44 3fgw h LEU 473 N 0.00 0.00 -8.74 5.97 3.38 -1.83 -3.42 115.31 110.67 3fgw h LEU 473 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3fgw h LEU 473 Cb 0.52 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 3fgw h LEU 473 CO 0.00 0.49 1.34 0.54 0.09 0.00 0.00 178.44 180.90 3fgw s VAL 474 N -3.47 3.38 -0.07 1.22 0.11 -1.17 -4.73 120.40 115.66 3fgw s VAL 474 Ca 0.00 0.34 0.05 0.00 -2.93 0.00 0.00 61.98 59.44 3fgw s VAL 474 Cb 0.11 -3.65 -0.06 0.00 -1.53 0.00 0.00 36.38 31.25 3fgw s VAL 474 CO 0.72 -0.50 0.13 -1.84 -3.33 0.00 0.00 175.10 170.28 3fgw n GLU 475 N 8.71 1.91 -2.33 1.54 0.28 -1.26 -4.90 120.64 124.60 3fgw n GLU 475 Ca 0.24 -0.03 -0.05 0.00 -0.16 0.00 0.00 57.16 57.16 3fgw n GLU 475 Cb 0.49 -0.98 -0.00 0.00 1.43 0.00 0.00 31.44 32.38 3fgw n GLU 475 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 3fgw n ASP 476 N -1.48 -0.69 0.06 -1.84 5.68 -1.26 -4.97 116.55 112.05 3fgw n ASP 476 Ca -0.00 -1.69 -0.12 0.00 -0.50 0.00 0.00 54.79 52.48 3fgw n ASP 476 Cb 0.10 1.21 -0.06 0.00 -1.14 0.00 0.00 41.12 41.23 3fgw n ASP 476 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 3fgw h MET 477 N 0.00 -0.10 -0.82 0.11 2.86 -1.99 -1.76 114.93 113.23 3fgw h MET 477 Ca -0.12 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 3fgw h MET 477 Cb 0.47 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 3fgw h MET 477 CO 0.15 -0.06 0.36 -0.44 1.06 0.00 0.00 176.91 177.98 3fgw h ASP 478 N -0.10 1.10 -0.42 1.22 3.45 -1.99 -1.16 116.42 118.52 3fgw h ASP 478 Ca 0.01 -0.15 -0.02 0.00 0.43 0.00 0.00 57.03 57.29 3fgw h ASP 478 Cb 0.11 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.57 3fgw h ASP 478 CO -0.03 0.95 0.20 0.00 -1.57 0.00 0.00 179.24 178.79 3fgw h ALA 479 N 1.19 1.48 -0.13 3.45 0.00 -1.89 -1.48 119.26 121.89 3fgw h ALA 479 Ca 0.28 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 3fgw h ALA 479 Cb 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3fgw h ALA 479 CO -0.03 0.40 -0.06 1.98 0.00 0.00 0.00 179.25 181.54 3fgw h MET 480 N 0.65 0.28 -0.26 0.00 1.85 -0.46 -2.76 114.93 114.23 3fgw h MET 480 Ca 0.16 -0.12 0.04 0.00 -0.61 0.00 0.00 59.70 59.17 3fgw h MET 480 Cb 0.11 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.09 3fgw h MET 480 CO -0.02 0.61 0.04 0.28 -0.40 0.00 0.00 176.91 177.42 3fgw h VAL 481 N -0.06 0.86 -0.91 -5.77 2.07 -1.00 -0.45 116.25 110.99 3fgw h VAL 481 Ca 0.03 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.59 3fgw h VAL 481 Cb 0.52 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 3fgw h VAL 481 CO 0.02 0.02 0.59 -0.09 0.02 0.00 0.00 177.57 178.13 3fgw h ARG 482 N 0.13 0.92 -0.04 1.57 2.43 -1.28 0.15 114.38 118.26 3fgw h ARG 482 Ca 0.12 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 3fgw h ARG 482 Cb 0.13 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3fgw h ARG 482 CO -0.17 0.61 -0.14 1.25 -1.51 0.00 0.00 179.97 180.01 3fgw h LEU 483 N 0.95 0.19 -1.94 3.80 5.85 -1.16 -2.13 115.31 120.87 3fgw h LEU 483 Ca 0.41 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 3fgw h LEU 483 Cb 0.33 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 3fgw h LEU 483 CO -0.17 0.79 -0.04 0.24 -0.34 0.00 0.00 178.44 178.92 3fgw h MET 484 N -0.41 0.00 -0.01 1.25 2.86 -0.63 -0.74 114.93 117.26 3fgw h MET 484 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3fgw h MET 484 Cb 0.78 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.44 3fgw h MET 484 CO 0.03 0.04 -0.56 0.54 1.06 0.00 0.00 176.91 178.03 3fgw n ARG 485 N -3.23 0.55 -1.78 1.72 5.12 0.50 -4.08 116.66 115.45 3fgw n ARG 485 Ca -0.01 -0.40 -0.42 0.00 -1.93 0.00 0.00 57.85 55.09 3fgw n ARG 485 Cb 0.24 -1.49 -0.03 0.00 -1.16 0.00 0.00 32.46 30.02 3fgw n ARG 485 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3fgw s TYR 486 N -2.73 2.88 -0.30 -1.55 5.04 -0.28 -4.60 117.35 115.81 3fgw s TYR 486 Ca 0.16 0.39 -0.02 0.00 -2.44 0.00 0.00 57.07 55.16 3fgw s TYR 486 Cb 0.18 -4.08 0.19 0.00 0.35 0.00 0.00 41.96 38.59 3fgw s TYR 486 CO 0.66 -4.12 0.65 1.21 -1.34 0.00 0.00 175.55 172.61 3fgw s ASN 487 N 1.30 -1.31 -0.38 4.32 3.84 -1.26 -2.33 114.94 119.12 3fgw s ASN 487 Ca 0.74 0.74 0.13 0.00 0.21 0.00 0.00 52.86 54.67 3fgw s ASN 487 Cb -0.48 2.06 0.38 0.00 -0.55 0.00 0.00 41.25 42.66 3fgw s ASN 487 CO 0.32 -0.24 0.81 -0.67 -2.79 0.00 0.00 177.10 174.53 3fgw n ASP 488 N 5.43 1.39 0.24 -4.21 2.03 -1.26 -4.10 116.55 116.07 3fgw n ASP 488 Ca -0.01 -3.02 0.08 0.00 0.52 0.00 0.00 54.79 52.36 3fgw n ASP 488 Cb 0.52 -0.59 0.61 0.00 -0.72 0.00 0.00 41.12 40.94 3fgw n ASP 488 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 3fgw h PHE 489 N 2.99 0.00 0.00 -0.67 -0.00 -1.89 -0.55 116.94 116.82 3fgw h PHE 489 Ca 0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 57.97 57.94 3fgw h PHE 489 Cb 0.98 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.91 3fgw h PHE 489 CO 0.51 0.12 -0.45 -0.07 -0.00 0.00 0.00 178.31 178.43 3fgw h LEU 490 N 0.00 0.00 -0.38 2.10 3.38 -1.93 -3.36 115.31 115.11 3fgw h LEU 490 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fgw h LEU 490 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3fgw h LEU 490 CO 0.02 0.45 0.00 1.41 0.09 0.00 0.00 178.44 180.40 3fgw n HIS 491 N -3.85 0.00 -3.40 1.13 8.25 -0.84 -4.97 115.22 111.54 3fgw n HIS 491 Ca -0.01 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.05 3fgw n HIS 491 Cb 0.49 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.51 3fgw n HIS 491 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3fgw s ASP 492 N -0.55 6.20 0.64 0.41 -1.08 -0.27 -4.97 116.67 117.05 3fgw s ASP 492 Ca 0.00 -0.01 0.31 0.00 -0.52 0.00 0.00 52.55 52.33 3fgw s ASP 492 Cb 0.00 -2.20 1.70 0.00 -1.46 0.00 0.00 42.92 40.96 3fgw s ASP 492 CO 0.00 -0.27 1.99 1.55 0.52 0.00 0.00 175.17 178.96 3fgw h PRO 493 N 8.35 0.00 -0.01 4.34 0.13 -1.90 -1.54 132.00 141.38 3fgw h PRO 493 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3fgw h PRO 493 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3fgw h PRO 493 CO 0.67 0.00 -0.03 1.28 -0.23 0.00 0.00 178.00 179.69 3fgw n LEU 494 N -3.16 0.75 -1.06 1.56 4.77 -1.26 -3.24 117.00 115.36 3fgw n LEU 494 Ca -0.00 -0.21 0.11 0.00 -0.03 0.00 0.00 56.01 55.88 3fgw n LEU 494 Cb 0.38 -0.04 0.19 0.00 -2.33 0.00 0.00 43.42 41.62 3fgw n LEU 494 CO 0.18 0.13 0.67 -1.20 -1.33 0.00 0.00 177.39 175.84 3fgw n SER 495 N -0.50 3.31 -4.69 -1.43 7.64 -0.58 -4.67 113.62 112.70 3fgw n SER 495 Ca 0.19 -1.96 -0.42 0.00 1.01 0.00 0.00 58.87 57.69 3fgw n SER 495 Cb 0.25 -0.22 -0.03 0.00 -1.01 0.00 0.00 64.21 63.21 3fgw n SER 495 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3fgw s LEU 496 N -1.44 4.26 -0.30 -3.43 1.43 -1.20 -1.10 118.68 116.90 3fgw s LEU 496 Ca 0.35 1.63 -0.08 0.00 -1.03 0.00 0.00 54.13 55.00 3fgw s LEU 496 Cb 0.21 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.87 3fgw s LEU 496 CO 0.29 -0.48 0.11 0.00 0.23 0.00 0.00 176.35 176.50 3fgw h GLU 498 N 8.28 0.08 -0.03 0.00 4.39 -1.95 -2.79 114.58 122.56 3fgw h GLU 498 Ca -0.32 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.29 3fgw h GLU 498 Cb 1.14 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 3fgw h GLU 498 CO 0.61 0.85 0.00 0.00 -1.16 0.00 0.00 179.01 179.31 3fgw n ALA 499 N -2.42 2.59 -2.17 3.43 0.00 -1.26 -4.89 120.51 115.79 3fgw n ALA 499 Ca -0.02 -0.19 -0.20 0.00 0.00 0.00 0.00 53.44 53.03 3fgw n ALA 499 Cb 0.78 -1.25 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 3fgw n ALA 499 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fgw s ASN 501 N -4.19 -1.10 0.84 0.00 2.47 -0.89 -4.15 114.94 107.92 3fgw s ASN 501 Ca 0.50 -0.04 -0.11 0.00 0.42 0.00 0.00 52.86 53.63 3fgw s ASN 501 Cb -0.05 1.79 0.09 0.00 -1.45 0.00 0.00 41.25 41.63 3fgw s ASN 501 CO 0.29 -0.30 1.09 -2.16 -3.72 0.00 0.00 177.10 172.30 3fgw s PRO 502 N 2.67 1.74 0.06 0.43 0.04 -1.26 -1.60 135.00 137.08 3fgw s PRO 502 Ca 0.10 1.06 -0.20 0.00 0.04 0.00 0.00 61.00 62.00 3fgw s PRO 502 Cb -0.10 -1.85 -0.12 0.00 0.04 0.00 0.00 34.50 32.47 3fgw s PRO 502 CO -0.25 -1.97 1.45 0.87 0.04 0.00 0.00 177.00 177.13 3fgw h LYS 503 N -1.36 0.33 -6.82 4.56 1.57 -1.74 -3.44 116.57 109.66 3fgw h LYS 503 Ca -0.46 -0.13 -0.52 0.00 -1.87 0.00 0.00 60.65 57.67 3fgw h LYS 503 Cb 1.25 -0.02 0.06 0.00 0.08 0.00 0.00 32.23 33.60 3fgw h LYS 503 CO 0.52 0.60 0.67 -2.14 -0.57 0.00 0.00 179.45 178.53 3fgw s PRO 504 N -4.75 4.34 -0.03 3.15 0.02 -1.26 0.20 135.00 136.68 3fgw s PRO 504 Ca -0.14 2.21 0.02 0.00 0.02 0.00 0.00 61.00 63.11 3fgw s PRO 504 Cb 0.06 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.49 3fgw s PRO 504 CO 0.73 -0.25 -0.09 1.21 -0.33 0.00 0.00 177.00 178.28 3fgw s ASN 505 N -0.17 1.20 0.02 2.53 3.84 -0.26 -4.84 114.94 117.27 3fgw s ASN 505 Ca 0.52 -0.19 0.21 0.00 0.21 0.00 0.00 52.86 53.62 3fgw s ASN 505 Cb -0.40 -0.35 0.89 0.00 -0.55 0.00 0.00 41.25 40.84 3fgw s ASN 505 CO 0.48 0.05 1.67 0.00 -2.79 0.00 0.00 177.10 176.52 3fgw n ALA 506 N 3.36 1.94 0.09 1.71 0.00 -1.26 -2.35 120.51 124.01 3fgw n ALA 506 Ca -0.19 -0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.12 3fgw n ALA 506 Cb 0.54 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.65 3fgw n ALA 506 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3fgw h GLU 507 N 0.00 0.12 -2.88 0.00 4.57 -1.90 -1.85 114.58 112.65 3fgw h GLU 507 Ca 0.00 -0.14 -0.62 0.00 -1.18 0.00 0.00 59.36 57.42 3fgw h GLU 507 Cb 0.37 0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.01 3fgw h GLU 507 CO 0.00 0.90 3.37 0.09 -1.18 0.00 0.00 179.01 182.18 3fgw n ASN 508 N -3.63 8.39 -4.10 1.04 3.02 -0.99 -4.71 115.26 114.28 3fgw n ASN 508 Ca -0.02 -2.59 -0.11 0.00 -0.03 0.00 0.00 54.58 51.83 3fgw n ASN 508 Cb 0.79 -1.54 -0.08 0.00 -0.61 0.00 0.00 39.78 38.34 3fgw n ASN 508 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fgw s ALA 509 N 1.90 0.69 0.11 5.41 0.00 -1.26 -4.30 121.76 124.31 3fgw s ALA 509 Ca 0.69 -1.42 -0.13 0.00 0.00 0.00 0.00 51.96 51.10 3fgw s ALA 509 Cb 0.20 1.28 -0.11 0.00 0.00 0.00 0.00 23.12 24.48 3fgw s ALA 509 CO -0.06 -0.69 1.37 0.82 0.00 0.00 0.00 175.76 177.20 3fgw h ILE 510 N 2.48 1.28 -3.51 0.00 2.04 -1.85 -3.37 117.51 114.57 3fgw h ILE 510 Ca -0.32 -1.78 -0.69 0.00 1.00 0.00 0.00 64.86 63.07 3fgw h ILE 510 Cb 1.25 1.76 -0.36 0.00 -0.74 0.00 0.00 36.82 38.73 3fgw h ILE 510 CO 0.46 0.57 -0.34 -0.55 0.00 0.00 0.00 178.15 178.29 3fgw s SER 511 N -6.94 5.28 0.71 1.72 0.15 -0.99 -4.71 113.70 108.93 3fgw s SER 511 Ca -0.11 -3.00 -0.16 0.00 0.70 0.00 0.00 55.95 53.38 3fgw s SER 511 Cb 0.09 -1.85 -0.02 0.00 -1.71 0.00 0.00 66.02 62.53 3fgw s SER 511 CO 0.89 -0.33 0.72 0.00 1.20 0.00 0.00 173.24 175.71 3fgw n ALA 512 N 3.29 -0.95 -2.99 5.45 0.00 -1.26 -4.55 120.51 119.50 3fgw n ALA 512 Ca 0.10 -0.21 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 3fgw n ALA 512 Cb 0.37 -1.96 0.01 0.00 0.00 0.00 0.00 19.45 17.87 3fgw n ALA 512 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3fgw n ARG 513 N -1.19 1.02 -0.04 0.00 3.00 -0.69 -0.80 116.66 117.96 3fgw n ARG 513 Ca 0.11 -2.96 0.21 0.00 -0.00 0.00 0.00 57.85 55.21 3fgw n ARG 513 Cb 0.50 -1.41 0.67 0.00 0.00 0.00 0.00 32.46 32.22 3fgw n ARG 513 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 3fgw h SER 514 N 2.95 0.04 0.24 6.15 0.02 -1.63 -1.85 113.55 119.47 3fgw h SER 514 Ca 0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3fgw h SER 514 Cb 1.04 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.58 3fgw h SER 514 CO 0.39 0.02 -0.04 -2.24 -1.14 0.00 0.00 176.83 173.82 3fgw h ASP 515 N 0.05 0.00 -0.24 3.07 2.03 -1.43 -2.33 116.42 117.55 3fgw h ASP 515 Ca 0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.58 3fgw h ASP 515 Cb 1.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 3fgw h ASP 515 CO -0.02 0.04 0.00 0.18 -1.03 0.00 0.00 179.24 178.41 3fgw n LEU 516 N -3.42 1.37 -4.80 0.15 4.77 -0.70 -4.80 117.00 109.57 3fgw n LEU 516 Ca -0.02 -0.67 -0.39 0.00 -0.03 0.00 0.00 56.01 54.90 3fgw n LEU 516 Cb 0.15 -0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 3fgw n LEU 516 CO 0.26 0.34 0.28 0.20 -1.33 0.00 0.00 177.39 177.13 3fgw s ASN 517 N -1.06 7.04 0.25 -1.43 0.01 -0.88 -4.89 114.94 113.97 3fgw s ASN 517 Ca 0.19 1.23 -0.30 0.00 -0.71 0.00 0.00 52.86 53.27 3fgw s ASN 517 Cb 0.10 -2.36 -0.11 0.00 0.41 0.00 0.00 41.25 39.29 3fgw s ASN 517 CO 0.13 0.23 1.56 -2.16 -1.51 0.00 0.00 177.10 175.35 3fgw s PRO 518 N -0.86 4.18 0.01 -0.60 0.04 -1.26 -4.56 135.00 131.95 3fgw s PRO 518 Ca 0.29 2.47 0.07 0.00 0.04 0.00 0.00 61.00 63.88 3fgw s PRO 518 Cb -0.19 -3.07 0.32 0.00 0.04 0.00 0.00 34.50 31.60 3fgw s PRO 518 CO 0.18 -0.58 1.24 0.00 0.04 0.00 0.00 177.00 177.88 3fgw n ALA 519 N 2.71 1.31 -1.50 8.56 0.00 -1.26 -2.42 120.51 127.90 3fgw n ALA 519 Ca 0.10 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.58 3fgw n ALA 519 Cb 0.38 -1.12 0.20 0.00 0.00 0.00 0.00 19.45 18.91 3fgw n ALA 519 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3fgw n ASN 520 N -1.54 1.89 -4.93 0.00 6.94 -1.26 -4.95 115.26 111.41 3fgw n ASN 520 Ca 0.02 -3.76 -0.26 0.00 -0.02 0.00 0.00 54.58 50.56 3fgw n ASN 520 Cb 0.08 -0.52 0.06 0.00 -2.36 0.00 0.00 39.78 37.04 3fgw n ASN 520 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3fgw s GLY 521 N -3.12 1.67 -0.40 4.83 0.00 -1.02 -5.02 107.32 104.27 3fgw s GLY 521 Ca 0.38 -0.88 -0.11 0.00 0.00 0.00 0.00 44.72 44.11 3fgw s GLY 521 CO -0.05 -0.50 0.25 -0.45 0.00 0.00 0.00 173.10 172.35 3fgw s SER 522 N -4.46 5.78 0.00 1.64 0.15 -0.63 -4.98 113.70 111.20 3fgw s SER 522 Ca 0.59 -1.17 0.08 0.00 0.70 0.00 0.00 55.95 56.14 3fgw s SER 522 Cb -0.11 -2.04 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 3fgw s SER 522 CO 0.45 -0.46 -0.24 -0.31 1.20 0.00 0.00 173.24 173.88 3fgw s TYR 523 N 1.54 2.10 0.22 3.44 2.02 -1.26 -2.09 117.35 123.31 3fgw s TYR 523 Ca 0.03 -0.40 0.17 0.00 -0.37 0.00 0.00 57.07 56.50 3fgw s TYR 523 Cb -0.21 -1.32 0.69 0.00 -0.40 0.00 0.00 41.96 40.72 3fgw s TYR 523 CO 0.06 0.02 1.75 -1.35 -1.57 0.00 0.00 175.55 174.45 3fgw h PRO 524 N 5.30 0.00 -3.19 -1.71 0.11 -1.98 -3.46 132.00 127.07 3fgw h PRO 524 Ca -0.42 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.63 3fgw h PRO 524 Cb 1.14 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.10 3fgw h PRO 524 CO 0.46 0.39 -0.06 -0.59 -0.21 0.00 0.00 178.00 177.99 3fgw s PHE 525 N -3.70 -0.26 0.30 0.65 -0.71 -1.26 -5.08 117.98 107.92 3fgw s PHE 525 Ca -0.01 0.08 0.06 0.00 -1.04 0.00 0.00 56.93 56.03 3fgw s PHE 525 Cb 0.12 0.27 0.81 0.00 -1.21 0.00 0.00 43.02 43.01 3fgw s PHE 525 CO 0.69 -0.66 1.69 1.96 -1.34 0.00 0.00 175.22 177.56 3fgw h GLN 526 N 2.60 0.37 -0.02 1.99 1.08 -1.99 -1.86 115.11 117.28 3fgw h GLN 526 Ca -0.33 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 56.86 3fgw h GLN 526 Cb 1.24 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.58 3fgw h GLN 526 CO 0.45 0.25 0.35 0.00 -0.95 0.00 0.00 178.83 178.92 3fgw h ALA 527 N 1.75 1.39 -0.01 3.87 0.00 -1.98 -0.45 119.26 123.83 3fgw h ALA 527 Ca 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.51 3fgw h ALA 527 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3fgw h ALA 527 CO -0.55 -0.36 -0.62 1.28 0.00 0.00 0.00 179.25 178.99 3fgw n LEU 528 N -2.93 1.26 -4.65 0.00 4.77 -0.70 -4.82 117.00 109.93 3fgw n LEU 528 Ca -0.01 -0.62 -0.29 0.00 -0.03 0.00 0.00 56.01 55.05 3fgw n LEU 528 Cb 0.40 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.67 3fgw n LEU 528 CO 0.14 0.27 0.63 -1.00 -1.33 0.00 0.00 177.39 176.10 3fgw s HIS 529 N -2.40 1.95 0.06 -1.77 3.76 -0.18 -4.93 115.29 111.78 3fgw s HIS 529 Ca 0.11 1.30 -0.31 0.00 -0.15 0.00 0.00 55.06 56.01 3fgw s HIS 529 Cb 0.14 -3.18 -0.06 0.00 1.11 0.00 0.00 32.58 30.59 3fgw s HIS 529 CO 0.60 -2.87 1.22 1.14 -0.85 0.00 0.00 174.74 173.98 3fgw s GLN 530 N -4.78 4.42 0.00 1.40 -2.07 -1.26 -4.88 119.66 112.49 3fgw s GLN 530 Ca 0.65 1.79 -0.08 0.00 -1.82 0.00 0.00 55.36 55.90 3fgw s GLN 530 Cb -0.20 -3.35 0.00 0.00 -1.09 0.00 0.00 33.01 28.37 3fgw s GLN 530 CO 0.59 -0.29 0.16 1.03 -1.32 0.00 0.00 175.29 175.46 3fgw s ARG 531 N 1.15 0.51 -0.58 9.60 0.52 -1.20 -4.95 118.95 124.00 3fgw s ARG 531 Ca 0.59 -0.38 -0.07 0.00 -0.52 0.00 0.00 55.73 55.35 3fgw s ARG 531 Cb -0.30 0.21 -0.17 0.00 0.52 0.00 0.00 34.95 35.22 3fgw s ARG 531 CO 0.29 -0.12 2.96 0.00 0.02 0.00 0.00 175.30 178.44 3fgw n ALA 532 N 1.41 6.00 -2.29 2.13 0.00 -1.26 -1.59 120.51 124.92 3fgw n ALA 532 Ca -0.23 -2.16 -0.08 0.00 0.00 0.00 0.00 53.44 50.98 3fgw n ALA 532 Cb 0.56 -2.70 -0.09 0.00 0.00 0.00 0.00 19.45 17.21 3fgw n ALA 532 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3fgw s HIS 533 N 1.84 0.41 -5.00 0.00 5.04 -1.26 -0.27 115.29 116.05 3fgw s HIS 533 Ca 0.58 -0.90 0.00 0.00 -1.54 0.00 0.00 55.06 53.20 3fgw s HIS 533 Cb 0.22 -0.29 0.00 0.00 0.04 0.00 0.00 32.58 32.55 3fgw s HIS 533 CO -0.02 -0.40 0.00 0.41 -2.34 0.00 0.00 174.74 172.39 3fgw n GLY 534 N 0.23 0.13 3.73 1.59 0.00 -0.90 -2.14 105.19 107.83 3fgw n GLY 534 Ca -0.15 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 3fgw n GLY 534 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fgw n GLY 535 N -0.81 1.49 0.00 -0.02 0.00 0.02 -0.90 105.19 104.98 3fgw n GLY 535 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.59 3fgw n GLY 535 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3fgw n ILE 536 N 3.44 0.00 -3.71 -0.61 -5.35 0.12 -3.87 119.36 109.38 3fgw n ILE 536 Ca 0.14 -0.37 -0.07 0.00 -0.27 0.00 0.00 62.75 62.18 3fgw n ILE 536 Cb 0.35 1.16 -0.02 0.00 -1.74 0.00 0.00 39.64 39.40 3fgw n ILE 536 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 3fgw s ASP 537 N -0.28 -0.29 -0.04 7.28 3.84 -1.24 0.23 116.67 126.18 3fgw s ASP 537 Ca 0.00 -0.36 -0.01 0.00 -0.00 0.00 0.00 52.55 52.18 3fgw s ASP 537 Cb 0.00 0.57 0.03 0.00 -1.38 0.00 0.00 42.92 42.15 3fgw s ASP 537 CO 0.00 -1.03 0.07 -0.69 -0.00 0.00 0.00 175.17 173.52 3fgw s VAL 538 N -3.55 -0.06 -0.07 2.11 1.01 -0.44 -3.32 120.40 116.08 3fgw s VAL 538 Ca 0.09 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.33 3fgw s VAL 538 Cb -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.22 3fgw s VAL 538 CO 0.00 0.09 -0.18 -0.54 0.00 0.00 0.00 175.10 174.48 3fgw s LYS 539 N 1.18 2.18 0.04 2.72 1.02 -0.45 -0.53 119.74 125.90 3fgw s LYS 539 Ca -0.08 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.32 3fgw s LYS 539 Cb -0.13 -1.76 -0.02 0.00 -0.52 0.00 0.00 37.83 35.41 3fgw s LYS 539 CO -0.04 0.15 -0.12 0.08 -0.92 0.00 0.00 175.35 174.50 3fgw s VAL 540 N 0.37 0.90 0.03 3.17 1.01 0.19 -1.42 120.40 124.64 3fgw s VAL 540 Ca -0.13 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 60.74 3fgw s VAL 540 Cb -0.15 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.38 3fgw s VAL 540 CO 0.05 -0.13 0.22 0.28 0.00 0.00 0.00 175.10 175.53 3fgw s THR 541 N -1.00 0.09 0.07 3.92 -1.32 -0.79 -0.19 115.64 116.42 3fgw s THR 541 Ca -0.02 -0.75 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 3fgw s THR 541 Cb -0.08 -0.79 0.00 0.00 -1.51 0.00 0.00 72.50 70.12 3fgw s THR 541 CO 0.01 -0.42 0.02 -1.54 -2.21 0.00 0.00 174.62 170.49 3fgw n SER 542 N 0.89 1.75 0.20 8.08 3.41 -1.26 -1.81 113.62 124.88 3fgw n SER 542 Ca -0.20 -1.27 -0.14 0.00 -0.26 0.00 0.00 58.87 57.01 3fgw n SER 542 Cb 0.58 0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 64.47 3fgw n SER 542 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3fgw h PHE 543 N 0.80 -0.48 -0.50 7.33 3.57 -1.97 -2.43 116.94 123.26 3fgw h PHE 543 Ca -0.05 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.38 3fgw h PHE 543 Cb 0.16 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 3fgw h PHE 543 CO 0.00 -0.16 0.09 1.79 -2.23 0.00 0.00 178.31 177.80 3fgw h THR 544 N -0.82 1.22 -0.10 4.41 1.35 -1.97 -1.67 112.91 115.34 3fgw h THR 544 Ca -0.05 -0.84 -0.12 0.00 -0.55 0.00 0.00 66.41 64.85 3fgw h THR 544 Cb 0.53 0.74 -0.01 0.00 -1.73 0.00 0.00 68.15 67.68 3fgw h THR 544 CO 0.09 0.31 -0.48 -0.07 -0.25 0.00 0.00 175.52 175.12 3fgw h LEU 545 N 0.75 0.27 -0.15 3.87 3.38 -1.87 -2.75 115.31 118.80 3fgw h LEU 545 Ca 0.16 -0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.81 3fgw h LEU 545 Cb 0.32 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.01 3fgw h LEU 545 CO 0.00 0.70 -0.69 0.00 0.09 0.00 0.00 178.44 178.55 3fgw h ALA 546 N 1.31 0.29 -0.69 1.53 0.00 -1.18 0.63 119.26 121.14 3fgw h ALA 546 Ca 0.01 -0.57 0.20 0.00 0.00 0.00 0.00 54.91 54.55 3fgw h ALA 546 Cb 0.92 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3fgw h ALA 546 CO 0.07 0.61 0.54 -0.22 0.00 0.00 0.00 179.25 180.25 3fgw h LYS 547 N 0.45 0.00 -0.29 0.00 3.64 -1.21 -0.08 116.57 119.08 3fgw h LYS 547 Ca -0.04 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.21 3fgw h LYS 547 Cb 1.32 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.07 3fgw h LYS 547 CO 0.14 0.00 -0.09 0.66 -2.27 0.00 0.00 179.45 177.89 3fgw n TYR 548 N -4.16 0.92 -4.03 1.91 4.01 -1.05 -4.99 117.16 109.78 3fgw n TYR 548 Ca 0.14 -1.43 -0.30 0.00 -0.16 0.00 0.00 57.90 56.15 3fgw n TYR 548 Cb 0.80 -0.42 -0.01 0.00 -0.31 0.00 0.00 39.34 39.40 3fgw n TYR 548 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3fgw n MET 549 N -1.03 -3.91 -4.34 -0.72 2.81 -0.04 -4.92 117.12 104.97 3fgw n MET 549 Ca 0.29 0.46 -0.18 0.00 -1.81 0.00 0.00 57.70 56.45 3fgw n MET 549 Cb 0.96 -5.02 -0.10 0.00 -0.71 0.00 0.00 33.22 28.35 3fgw n MET 549 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3fgw s SER 550 N -3.71 2.51 0.18 7.83 0.01 0.21 -4.66 113.70 116.07 3fgw s SER 550 Ca 0.44 -1.01 -0.12 0.00 1.31 0.00 0.00 55.95 56.57 3fgw s SER 550 Cb -0.23 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 65.88 3fgw s SER 550 CO 0.88 -0.18 0.38 0.00 0.41 0.00 0.00 173.24 174.74 3fgw s MET 551 N -3.60 1.27 -0.15 12.44 0.23 -1.23 -4.11 119.30 124.15 3fgw s MET 551 Ca 0.21 -1.08 -0.07 0.00 -1.03 0.00 0.00 55.69 53.73 3fgw s MET 551 Cb -0.01 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 33.69 3fgw s MET 551 CO 0.06 -0.50 0.09 -0.51 -2.03 0.00 0.00 175.02 172.13 3fgw s LEU 552 N -2.94 4.02 -0.05 0.18 1.43 0.73 -1.62 118.68 120.43 3fgw s LEU 552 Ca 0.15 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 3fgw s LEU 552 Cb 0.01 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.26 3fgw s LEU 552 CO 0.00 0.27 -0.03 0.00 0.23 0.00 0.00 176.35 176.82 3fgw s ALA 553 N -0.21 0.68 -0.17 4.21 0.00 0.54 -0.63 121.76 126.18 3fgw s ALA 553 Ca 0.09 -0.08 0.01 0.00 0.00 0.00 0.00 51.96 51.98 3fgw s ALA 553 Cb -0.12 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.50 3fgw s ALA 553 CO 0.01 -0.13 -0.18 0.00 0.00 0.00 0.00 175.76 175.46 3fgw s ALA 554 N 1.18 2.40 -0.09 0.00 0.00 0.31 -1.20 121.76 124.36 3fgw s ALA 554 Ca -0.07 -1.13 -0.11 0.00 0.00 0.00 0.00 51.96 50.65 3fgw s ALA 554 Cb -0.14 -1.19 -0.05 0.00 0.00 0.00 0.00 23.12 21.75 3fgw s ALA 554 CO -0.01 -0.18 0.25 0.45 0.00 0.00 0.00 175.76 176.27 3fgw s SER 555 N 1.04 6.52 0.00 0.00 0.15 -1.26 -1.33 113.70 118.82 3fgw s SER 555 Ca -0.01 0.61 0.00 0.00 0.70 0.00 0.00 55.95 57.25 3fgw s SER 555 Cb -0.14 -2.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.02 3fgw s SER 555 CO -0.05 0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.32 3fgw n GLY 556 N 2.24 1.84 3.71 9.45 0.00 0.14 -4.39 105.19 118.18 3fgw n GLY 556 Ca -0.17 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 3fgw n GLY 556 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fgw s PRO 557 N -2.25 1.53 0.30 1.61 0.02 -1.25 -3.67 135.00 131.29 3fgw s PRO 557 Ca 0.00 1.45 -0.29 0.00 0.02 0.00 0.00 61.00 62.18 3fgw s PRO 557 Cb 0.00 -1.79 -0.10 0.00 0.02 0.00 0.00 34.50 32.63 3fgw s PRO 557 CO 0.00 -2.23 1.25 -0.08 -0.33 0.00 0.00 177.00 175.60 3fgw s THR 558 N -2.66 3.00 -0.01 0.99 -1.32 -1.26 -4.79 115.64 109.59 3fgw s THR 558 Ca 0.66 0.99 0.02 0.00 -1.21 0.00 0.00 61.69 62.14 3fgw s THR 558 Cb -0.22 -3.63 0.03 0.00 -1.51 0.00 0.00 72.50 67.17 3fgw s THR 558 CO 0.56 0.22 0.78 -2.67 -2.21 0.00 0.00 174.62 171.30 3fgw n TRP 559 N 1.14 0.00 -0.29 9.09 4.27 -1.26 -4.60 117.44 125.79 3fgw n TRP 559 Ca 0.00 -0.16 -0.01 0.00 -3.89 0.00 0.00 57.50 53.45 3fgw n TRP 559 Cb 0.43 -0.04 0.11 0.00 -1.36 0.00 0.00 31.31 30.46 3fgw n TRP 559 CO 0.00 0.00 0.00 -0.44 -2.29 0.00 0.00 177.69 174.96 3fgw h ASP 560 N 0.00 0.80 0.00 -0.67 3.45 -1.92 -3.39 116.42 114.69 3fgw h ASP 560 Ca 0.00 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.47 3fgw h ASP 560 Cb 1.05 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.66 3fgw h ASP 560 CO 0.00 0.53 -0.39 0.00 -1.57 0.00 0.00 179.24 177.82 3fgw n GLN 561 N -4.63 0.97 -2.51 3.56 6.02 -1.26 -5.07 117.38 114.47 3fgw n GLN 561 Ca 0.10 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.74 3fgw n GLN 561 Cb 0.13 -0.69 -0.03 0.00 1.02 0.00 0.00 30.24 30.67 3fgw n GLN 561 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3fgw s PRO 563 N -2.83 4.12 0.34 0.00 0.04 -1.26 -4.33 135.00 131.07 3fgw s PRO 563 Ca 0.63 2.60 -0.28 0.00 0.04 0.00 0.00 61.00 63.99 3fgw s PRO 563 Cb -0.20 -3.05 -0.12 0.00 0.04 0.00 0.00 34.50 31.17 3fgw s PRO 563 CO 0.25 -0.70 1.35 -2.30 0.04 0.00 0.00 177.00 175.64 3fgw n PRO 564 N 3.07 2.26 -2.10 0.56 -0.02 -1.26 -4.89 135.00 132.62 3fgw n PRO 564 Ca 0.12 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 61.98 3fgw n PRO 564 Cb 0.36 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.39 3fgw n PRO 564 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3fgw s PHE 565 N -0.99 3.16 -0.05 6.00 5.36 -1.26 -4.85 117.98 125.37 3fgw s PHE 565 Ca 0.56 0.98 -0.02 0.00 -0.96 0.00 0.00 56.93 57.49 3fgw s PHE 565 Cb -0.55 -3.74 0.03 0.00 -0.34 0.00 0.00 43.02 38.42 3fgw s PHE 565 CO 0.61 -2.52 0.05 -1.14 -1.46 0.00 0.00 175.22 170.76 3fgw s GLN 566 N 0.45 0.07 0.19 10.12 0.74 -1.26 -0.36 119.66 129.61 3fgw s GLN 566 Ca 0.62 0.31 -0.12 0.00 0.05 0.00 0.00 55.36 56.22 3fgw s GLN 566 Cb -0.39 -0.59 0.19 0.00 1.10 0.00 0.00 33.01 33.31 3fgw s GLN 566 CO 0.35 -0.31 1.73 -1.49 -0.55 0.00 0.00 175.29 175.03 3fgw h TRP 567 N 8.34 0.26 -0.72 1.67 4.06 -1.51 -1.15 115.95 126.90 3fgw h TRP 567 Ca -0.16 0.03 0.10 0.00 2.06 0.00 0.00 58.89 60.92 3fgw h TRP 567 Cb 1.12 -0.04 -0.07 0.00 -1.00 0.00 0.00 29.16 29.17 3fgw h TRP 567 CO 0.48 0.06 0.35 0.77 -3.56 0.00 0.00 178.44 176.53 3fgw h SER 568 N 0.31 0.44 0.03 -3.49 0.02 -1.92 -2.48 113.55 106.46 3fgw h SER 568 Ca 0.25 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3fgw h SER 568 Cb 0.30 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3fgw h SER 568 CO -0.28 0.24 -0.13 0.29 -1.14 0.00 0.00 176.83 175.80 3fgw n LYS 569 N -4.88 1.61 -3.01 3.45 5.02 -1.03 -4.82 118.16 114.50 3fgw n LYS 569 Ca 0.12 -1.15 -0.29 0.00 -2.02 0.00 0.00 58.31 54.97 3fgw n LYS 569 Cb 0.30 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.80 3fgw n LYS 569 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3fgw s SER 570 N -2.18 6.45 0.00 4.39 1.04 -0.46 -4.96 113.70 117.97 3fgw s SER 570 Ca 0.29 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.66 3fgw s SER 570 Cb 0.20 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 64.08 3fgw s SER 570 CO 0.40 -0.35 0.42 -0.81 0.98 0.00 0.00 173.24 173.89 3fgw n PRO 571 N -1.33 0.69 -0.16 4.02 -0.04 -1.26 -2.67 135.00 134.26 3fgw n PRO 571 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.53 3fgw n PRO 571 Cb 0.54 -1.27 0.09 0.00 -0.04 0.00 0.00 33.50 32.82 3fgw n PRO 571 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3fgw n PHE 572 N 0.00 0.00 -0.24 0.54 3.72 -1.26 -4.81 117.46 115.41 3fgw n PHE 572 Ca 0.00 -0.67 0.32 0.00 -0.05 0.00 0.00 57.45 57.05 3fgw n PHE 572 Cb 0.13 -0.11 0.74 0.00 -0.94 0.00 0.00 39.48 39.30 3fgw n PHE 572 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 3fgw h HIS 573 N 0.00 0.00 -0.23 1.38 2.07 -1.54 -1.50 115.15 115.33 3fgw h HIS 573 Ca 0.00 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.40 3fgw h HIS 573 Cb 1.04 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.01 3fgw h HIS 573 CO 0.02 0.00 -0.37 0.66 -3.07 0.00 0.00 177.93 175.17 3fgw h SER 574 N 0.00 0.55 -3.60 3.10 4.64 -1.89 -3.45 113.55 112.90 3fgw h SER 574 Ca 0.49 -0.23 -0.53 0.00 -0.47 0.00 0.00 61.79 61.05 3fgw h SER 574 Cb 2.01 -0.15 0.08 0.00 -0.31 0.00 0.00 62.40 64.03 3fgw h SER 574 CO -0.01 0.87 0.79 -0.04 -0.87 0.00 0.00 176.83 177.58 3fgw s MET 575 N -4.29 4.18 0.25 4.77 1.00 -0.57 -4.97 119.30 119.67 3fgw s MET 575 Ca -0.07 2.46 -0.29 0.00 0.00 0.00 0.00 55.69 57.79 3fgw s MET 575 Cb 0.13 -3.03 -0.09 0.00 0.00 0.00 0.00 34.83 31.83 3fgw s MET 575 CO 0.81 -0.49 0.93 -0.48 0.00 0.00 0.00 175.02 175.79 3fgw s LEU 576 N -1.13 4.61 -0.44 -0.03 2.34 -1.26 -5.00 118.68 117.78 3fgw s LEU 576 Ca 0.57 1.93 0.08 0.00 0.06 0.00 0.00 54.13 56.76 3fgw s LEU 576 Cb -0.45 -3.64 0.30 0.00 -0.56 0.00 0.00 46.19 41.84 3fgw s LEU 576 CO 0.52 0.14 0.90 0.00 -1.06 0.00 0.00 176.35 176.85 3fgw n HIS 577 N 1.39 -1.99 -1.83 3.48 1.44 -1.26 -4.79 115.22 111.66 3fgw n HIS 577 Ca -0.02 -2.60 -0.42 0.00 -2.01 0.00 0.00 57.72 52.67 3fgw n HIS 577 Cb 0.47 0.91 -0.02 0.00 0.12 0.00 0.00 29.99 31.47 3fgw n HIS 577 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 3fgw s MET 578 N -0.42 4.16 0.00 -1.40 -1.94 -1.26 -2.37 119.30 116.07 3fgw s MET 578 Ca 0.30 2.50 0.00 0.00 -1.71 0.00 0.00 55.69 56.78 3fgw s MET 578 Cb 0.27 -3.08 0.00 0.00 2.01 0.00 0.00 34.83 34.03 3fgw s MET 578 CO -0.11 -0.64 0.00 0.41 -0.01 0.00 0.00 175.02 174.67 3fgw n GLY 579 N 3.13 2.21 3.74 -0.03 0.00 -1.26 -4.79 105.19 108.20 3fgw n GLY 579 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3fgw n GLY 579 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fgw s GLN 580 N -0.00 4.59 0.39 1.61 -0.21 -1.00 -4.92 119.66 120.13 3fgw s GLN 580 Ca 0.00 1.23 -0.27 0.00 0.02 0.00 0.00 55.36 56.34 3fgw s GLN 580 Cb 0.00 -3.35 -0.10 0.00 1.00 0.00 0.00 33.01 30.56 3fgw s GLN 580 CO 0.00 0.32 1.42 -2.14 -2.12 0.00 0.00 175.29 172.77 3fgw s PRO 581 N -0.27 4.03 0.06 2.91 0.02 -1.26 -4.95 135.00 135.54 3fgw s PRO 581 Ca 0.41 2.43 -0.26 0.00 0.02 0.00 0.00 61.00 63.60 3fgw s PRO 581 Cb -0.22 -2.88 -0.17 0.00 0.02 0.00 0.00 34.50 31.25 3fgw s PRO 581 CO 0.26 -0.54 1.60 0.22 -0.33 0.00 0.00 177.00 178.21 3fgw h ASP 582 N 2.86 -0.20 -2.73 2.53 3.58 -1.96 -3.43 116.42 117.06 3fgw h ASP 582 Ca -0.50 -0.07 -0.65 0.00 0.42 0.00 0.00 57.03 56.22 3fgw h ASP 582 Cb 1.24 0.05 -0.06 0.00 1.72 0.00 0.00 39.33 42.28 3fgw h ASP 582 CO 0.63 -0.05 -0.49 -0.22 -2.88 0.00 0.00 179.24 176.23 3fgw s LEU 583 N -9.96 4.37 -0.44 2.28 2.96 -1.26 -1.29 118.68 115.34 3fgw s LEU 583 Ca -0.14 0.40 0.03 0.00 -0.22 0.00 0.00 54.13 54.20 3fgw s LEU 583 Cb 0.04 -2.34 0.12 0.00 0.50 0.00 0.00 46.19 44.51 3fgw s LEU 583 CO 0.64 0.34 0.17 0.26 -1.32 0.00 0.00 176.35 176.43 3fgw s TRP 584 N -1.17 3.48 -0.30 5.38 0.52 0.51 -4.92 118.94 122.43 3fgw s TRP 584 Ca 0.21 -3.06 0.14 0.00 0.02 0.00 0.00 56.10 53.41 3fgw s TRP 584 Cb -0.12 -2.90 0.47 0.00 -1.15 0.00 0.00 33.47 29.77 3fgw s TRP 584 CO 0.11 -0.85 1.12 -1.33 0.02 0.00 0.00 176.95 176.02 3fgw n MET 585 N 3.70 2.60 -3.17 4.98 2.81 -1.26 -3.99 117.12 122.79 3fgw n MET 585 Ca 0.04 -3.86 -0.39 0.00 -1.81 0.00 0.00 57.70 51.68 3fgw n MET 585 Cb 0.37 -1.90 -0.06 0.00 -0.71 0.00 0.00 33.22 30.92 3fgw n MET 585 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 3fgw s PHE 586 N -3.61 3.84 0.25 2.03 0.08 -1.26 -5.08 117.98 114.24 3fgw s PHE 586 Ca 0.39 1.40 0.04 0.00 0.12 0.00 0.00 56.93 58.89 3fgw s PHE 586 Cb 0.38 -2.60 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 3fgw s PHE 586 CO -0.02 0.56 0.39 -1.12 -0.10 0.00 0.00 175.22 174.93 3fgw s SER 587 N -1.11 6.32 0.53 1.36 0.01 -1.26 -4.63 113.70 114.91 3fgw s SER 587 Ca 0.31 0.13 -0.22 0.00 1.31 0.00 0.00 55.95 57.48 3fgw s SER 587 Cb -0.21 -1.89 -0.05 0.00 0.21 0.00 0.00 66.02 64.08 3fgw s SER 587 CO 0.22 -0.10 1.36 -2.16 0.41 0.00 0.00 173.24 172.96 3fgw s PRO 588 N -4.02 3.25 0.08 12.44 0.04 -1.26 -4.65 135.00 140.88 3fgw s PRO 588 Ca 0.35 2.24 0.02 0.00 0.04 0.00 0.00 61.00 63.65 3fgw s PRO 588 Cb -0.09 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3fgw s PRO 588 CO 0.30 -1.10 -0.07 0.96 0.04 0.00 0.00 177.00 177.13 3fgw s ILE 589 N -1.30 0.65 -0.17 0.56 -4.36 -0.34 -4.92 121.20 111.32 3fgw s ILE 589 Ca 0.70 -1.68 -0.13 0.00 -0.26 0.00 0.00 60.65 59.27 3fgw s ILE 589 Cb -0.40 -1.37 -0.05 0.00 1.25 0.00 0.00 42.46 41.89 3fgw s ILE 589 CO 0.48 -0.73 0.26 -0.60 0.24 0.00 0.00 174.94 174.60 3fgw s ARG 590 N -3.17 4.24 0.37 0.37 3.52 -1.26 -0.34 118.95 122.68 3fgw s ARG 590 Ca 0.05 0.03 -0.06 0.00 -0.13 0.00 0.00 55.73 55.63 3fgw s ARG 590 Cb 0.01 -3.42 -0.05 0.00 -1.56 0.00 0.00 34.95 29.92 3fgw s ARG 590 CO -0.03 0.25 0.66 0.14 -0.81 0.00 0.00 175.30 175.51 3fgw s VAL 591 N 0.45 4.93 0.20 7.11 -7.23 -0.64 -4.30 120.40 120.92 3fgw s VAL 591 Ca 0.15 0.22 -0.30 0.00 -1.81 0.00 0.00 61.98 60.23 3fgw s VAL 591 Cb -0.13 -3.77 -0.08 0.00 0.56 0.00 0.00 36.38 32.97 3fgw s VAL 591 CO 0.03 -0.50 0.96 -2.84 -0.31 0.00 0.00 175.10 172.44 3fgw s PRO 592 N -3.92 4.79 -0.12 4.82 0.02 -1.26 -3.56 135.00 135.76 3fgw s PRO 592 Ca 0.46 1.50 -0.03 0.00 0.02 0.00 0.00 61.00 62.95 3fgw s PRO 592 Cb -0.10 -3.31 0.01 0.00 0.02 0.00 0.00 34.50 31.12 3fgw s PRO 592 CO 0.34 0.40 0.07 0.91 -0.33 0.00 0.00 177.00 178.38 3fgw n TRP 593 N 1.91 -2.14 0.00 6.54 5.03 -1.26 -5.15 117.44 122.37 3fgw n TRP 593 Ca -0.00 1.11 0.00 0.00 3.03 0.00 0.00 57.50 61.64 3fgw n TRP 593 Cb 0.48 -2.74 0.00 0.00 -1.03 0.00 0.00 31.31 28.01 3fgw n TRP 593 CO 0.00 0.00 0.00 -0.40 -0.03 0.00 0.00 177.69 177.26