#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3r s GLU 2 N 0.00 0.43 0.32 2.12 2.12 -1.26 -0.22 118.70 122.20 2w3r s GLU 2 Ca 0.00 0.74 0.10 0.00 0.36 0.00 0.00 54.97 56.17 2w3r s GLU 2 Cb 0.00 0.06 -0.06 0.00 0.26 0.00 0.00 34.13 34.39 2w3r s GLU 2 CO 0.00 -0.13 -0.13 0.96 -0.54 0.00 0.00 175.26 175.42 2w3r s ILE 3 N 1.03 2.29 0.00 -3.70 -4.36 -0.74 -4.96 121.20 110.78 2w3r s ILE 3 Ca -0.07 -2.28 0.05 0.00 -0.26 0.00 0.00 60.65 58.10 2w3r s ILE 3 Cb -0.07 -2.51 -0.02 0.00 1.25 0.00 0.00 42.46 41.12 2w3r s ILE 3 CO -0.09 -0.28 -0.16 0.00 0.24 0.00 0.00 174.94 174.65 2w3r s ALA 4 N -2.60 1.31 0.14 2.27 0.00 -1.26 -1.15 121.76 120.47 2w3r s ALA 4 Ca 0.31 -0.74 -0.15 0.00 0.00 0.00 0.00 51.96 51.39 2w3r s ALA 4 Cb -0.00 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.85 2w3r s ALA 4 CO 0.16 0.30 0.39 -0.59 0.00 0.00 0.00 175.76 176.02 2w3r s PHE 5 N -0.50 -0.10 -0.50 0.00 -0.12 0.37 0.42 117.98 117.55 2w3r s PHE 5 Ca 0.05 -0.24 -0.16 0.00 -0.05 0.00 0.00 56.93 56.53 2w3r s PHE 5 Cb -0.07 0.22 0.10 0.00 -0.63 0.00 0.00 43.02 42.64 2w3r s PHE 5 CO 0.00 -0.73 0.45 -1.17 -0.05 0.00 0.00 175.22 173.72 2w3r s LEU 6 N -2.84 5.83 -0.36 -1.99 2.96 -0.65 -0.38 118.68 121.25 2w3r s LEU 6 Ca 0.06 -1.50 -0.19 0.00 -0.22 0.00 0.00 54.13 52.27 2w3r s LEU 6 Cb 0.02 -2.20 0.00 0.00 0.50 0.00 0.00 46.19 44.51 2w3r s LEU 6 CO -0.09 -0.75 0.56 -0.22 -1.32 0.00 0.00 176.35 174.53 2w3r s LEU 7 N 1.67 4.34 -1.53 -0.68 2.96 0.44 0.57 118.68 126.46 2w3r s LEU 7 Ca 0.04 -0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.81 2w3r s LEU 7 Cb -0.26 -2.66 0.08 0.00 0.50 0.00 0.00 46.19 43.85 2w3r s LEU 7 CO 0.05 -0.54 0.88 0.59 -1.32 0.00 0.00 176.35 176.01 2w3r n ASN 8 N 5.88 -3.84 0.00 3.68 3.02 0.06 -1.57 115.26 122.48 2w3r n ASN 8 Ca -0.03 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 2w3r n ASN 8 Cb 0.49 -3.66 0.00 0.00 -0.61 0.00 0.00 39.78 36.00 2w3r n ASN 8 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w3r n GLY 9 N -1.65 0.82 3.25 7.41 0.00 -1.26 -5.01 105.19 108.75 2w3r n GLY 9 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2w3r n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w3r s GLU 10 N -0.25 2.44 0.38 1.61 2.02 -0.61 -5.10 118.70 119.20 2w3r s GLU 10 Ca 0.00 -0.86 -0.27 0.00 0.02 0.00 0.00 54.97 53.86 2w3r s GLU 10 Cb 0.00 -2.07 -0.09 0.00 0.10 0.00 0.00 34.13 32.06 2w3r s GLU 10 CO 0.00 0.36 1.30 0.95 0.02 0.00 0.00 175.26 177.89 2w3r s THR 11 N -0.13 2.66 -0.12 3.63 -4.23 -1.26 -0.42 115.64 115.77 2w3r s THR 11 Ca -0.04 0.62 -0.06 0.00 -1.18 0.00 0.00 61.69 61.03 2w3r s THR 11 Cb -0.13 -3.37 0.05 0.00 1.34 0.00 0.00 72.50 70.38 2w3r s THR 11 CO 0.03 0.11 0.28 -0.60 -0.54 0.00 0.00 174.62 173.90 2w3r s ARG 12 N -2.09 0.23 -0.13 3.99 6.06 0.48 -4.86 118.95 122.63 2w3r s ARG 12 Ca 0.54 0.61 0.00 0.00 -2.50 0.00 0.00 55.73 54.39 2w3r s ARG 12 Cb -0.38 -0.09 -0.01 0.00 0.06 0.00 0.00 34.95 34.53 2w3r s ARG 12 CO 0.50 -0.18 -0.15 1.03 -2.50 0.00 0.00 175.30 174.00 2w3r s ARG 13 N 1.45 3.29 -0.06 5.12 0.52 -1.26 -0.48 118.95 127.53 2w3r s ARG 13 Ca -0.08 -0.73 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 2w3r s ARG 13 Cb -0.10 -2.59 0.01 0.00 0.52 0.00 0.00 34.95 32.79 2w3r s ARG 13 CO -0.09 0.14 -0.12 0.08 0.02 0.00 0.00 175.30 175.33 2w3r s VAL 14 N 0.51 1.09 -0.24 3.52 1.01 -0.30 -5.00 120.40 120.99 2w3r s VAL 14 Ca -0.10 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 61.16 2w3r s VAL 14 Cb -0.16 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2w3r s VAL 14 CO 0.04 0.35 0.94 -0.60 0.00 0.00 0.00 175.10 175.83 2w3r s ARG 15 N 0.70 4.21 -0.31 2.72 3.52 -1.26 -1.79 118.95 126.74 2w3r s ARG 15 Ca -0.14 1.15 -0.22 0.00 -0.13 0.00 0.00 55.73 56.39 2w3r s ARG 15 Cb -0.16 -3.65 -0.00 0.00 -1.56 0.00 0.00 34.95 29.58 2w3r s ARG 15 CO 0.03 -0.59 0.70 0.42 -0.81 0.00 0.00 175.30 175.05 2w3r s ILE 16 N 3.05 4.87 -0.05 4.11 1.01 0.69 -4.86 121.20 130.02 2w3r s ILE 16 Ca 0.40 0.95 0.07 0.00 0.00 0.00 0.00 60.65 62.07 2w3r s ILE 16 Cb -0.15 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 2w3r s ILE 16 CO 0.07 -0.21 0.06 -0.62 0.00 0.00 0.00 174.94 174.24 2w3r n GLU 17 N 6.04 2.13 -3.96 2.79 1.02 -1.26 -3.82 120.64 123.58 2w3r n GLU 17 Ca 0.01 -0.02 -0.30 0.00 -0.02 0.00 0.00 57.16 56.83 2w3r n GLU 17 Cb 0.48 -1.18 -0.14 0.00 -0.02 0.00 0.00 31.44 30.58 2w3r n GLU 17 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2w3r s ASP 18 N -3.58 4.38 0.33 1.62 3.68 -1.26 -4.97 116.67 116.86 2w3r s ASP 18 Ca -0.03 -2.85 0.26 0.00 2.13 0.00 0.00 52.55 52.05 2w3r s ASP 18 Cb 0.03 -1.62 1.12 0.00 -1.45 0.00 0.00 42.92 40.99 2w3r s ASP 18 CO 0.29 -0.26 1.77 1.55 0.13 0.00 0.00 175.17 178.65 2w3r h PRO 19 N 6.70 0.00 0.00 4.34 0.13 -1.90 -2.75 132.00 138.52 2w3r h PRO 19 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2w3r h PRO 19 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2w3r h PRO 19 CO 0.65 0.00 -0.95 -2.37 -0.23 0.00 0.00 178.00 175.11 2w3r n THR 20 N -2.41 0.13 -1.81 1.56 5.66 -1.26 -4.56 114.28 111.60 2w3r n THR 20 Ca 0.01 -0.18 -0.41 0.00 -3.05 0.00 0.00 64.05 60.42 2w3r n THR 20 Cb 0.21 0.30 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 2w3r n THR 20 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2w3r s GLN 21 N -3.15 4.04 0.33 1.09 0.74 -1.04 -4.89 119.66 116.78 2w3r s GLN 21 Ca 0.05 2.54 -0.09 0.00 0.05 0.00 0.00 55.36 57.91 2w3r s GLN 21 Cb 0.15 -2.91 -0.06 0.00 1.10 0.00 0.00 33.01 31.28 2w3r s GLN 21 CO 0.79 -0.58 0.66 -1.54 -0.55 0.00 0.00 175.29 174.07 2w3r s SER 22 N -0.22 6.53 0.22 6.67 1.04 -1.26 -3.29 113.70 123.39 2w3r s SER 22 Ca 0.54 0.97 -0.08 0.00 0.48 0.00 0.00 55.95 57.86 2w3r s SER 22 Cb -0.46 -2.25 0.29 0.00 0.10 0.00 0.00 66.02 63.70 2w3r s SER 22 CO 0.62 -0.26 1.80 0.25 0.98 0.00 0.00 173.24 176.63 2w3r h LEU 23 N 1.68 0.54 -0.42 2.42 5.85 -0.55 -1.35 115.31 123.48 2w3r h LEU 23 Ca -0.47 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.31 2w3r h LEU 23 Cb 1.18 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 2w3r h LEU 23 CO 0.66 0.34 0.24 0.25 -0.34 0.00 0.00 178.44 179.58 2w3r h LEU 24 N 0.68 0.38 -0.70 2.25 5.85 -1.72 0.79 115.31 122.84 2w3r h LEU 24 Ca 0.33 0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.11 2w3r h LEU 24 Cb 0.26 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 2w3r h LEU 24 CO -0.21 0.27 0.40 -0.33 -0.34 0.00 0.00 178.44 178.23 2w3r h GLU 25 N 0.49 0.71 -0.08 1.25 4.39 -1.76 -2.82 114.58 116.76 2w3r h GLU 25 Ca 0.17 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.80 2w3r h GLU 25 Cb 0.03 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.51 2w3r h GLU 25 CO -0.09 0.47 -0.05 2.35 -1.16 0.00 0.00 179.01 180.54 2w3r h TRP 26 N 0.74 0.21 -0.63 4.33 7.01 -0.37 -1.50 115.95 125.73 2w3r h TRP 26 Ca 0.31 -0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.26 2w3r h TRP 26 Cb 0.18 -0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.16 2w3r h TRP 26 CO -0.07 0.56 0.41 -0.07 -2.79 0.00 0.00 178.44 176.47 2w3r h LEU 27 N -0.20 0.74 -0.63 0.65 3.38 -0.87 -0.04 115.31 118.35 2w3r h LEU 27 Ca 0.02 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 2w3r h LEU 27 Cb 0.51 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2w3r h LEU 27 CO 0.01 0.55 -0.63 0.03 0.09 0.00 0.00 178.44 178.50 2w3r h ARG 28 N 0.86 0.22 -0.46 1.13 3.08 -1.54 -1.30 114.38 116.37 2w3r h ARG 28 Ca 0.23 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2w3r h ARG 28 Cb -0.07 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2w3r h ARG 28 CO -0.05 0.78 0.06 0.00 -1.07 0.00 0.00 179.97 179.69 2w3r h ALA 29 N 1.18 1.25 -0.31 0.04 0.00 -0.89 -2.87 119.26 117.65 2w3r h ALA 29 Ca -0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2w3r h ALA 29 Cb 1.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2w3r h ALA 29 CO 0.10 0.51 0.12 0.93 0.00 0.00 0.00 179.25 180.90 2w3r h GLU 30 N 0.69 0.48 0.00 0.00 4.39 -0.52 -3.47 114.58 116.14 2w3r h GLU 30 Ca 0.15 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2w3r h GLU 30 Cb 0.33 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2w3r h GLU 30 CO 0.01 0.50 0.00 0.41 -1.16 0.00 0.00 179.01 178.76 2w3r n GLY 31 N -0.70 0.17 2.68 -3.84 0.00 -0.73 -5.04 105.19 97.73 2w3r n GLY 31 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2w3r n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2w3r n LEU 32 N 0.00 6.88 0.00 0.99 4.77 -0.57 -4.76 117.00 124.32 2w3r n LEU 32 Ca 0.00 -4.01 0.01 0.00 -0.03 0.00 0.00 56.01 51.98 2w3r n LEU 32 Cb 0.00 -1.57 0.09 0.00 -2.33 0.00 0.00 43.42 39.61 2w3r n LEU 32 CO 0.00 1.13 0.40 1.07 -1.33 0.00 0.00 177.39 178.66 2w3r n THR 33 N 4.87 0.00 0.18 -5.08 5.66 -1.26 -3.29 114.28 115.37 2w3r n THR 33 Ca 0.57 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 61.63 2w3r n THR 33 Cb 0.35 -0.24 0.25 0.00 -1.55 0.00 0.00 70.33 69.14 2w3r n THR 33 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2w3r h GLY 34 N 3.90 0.00 -6.29 1.09 0.00 -1.95 -3.43 103.07 96.40 2w3r h GLY 34 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 2w3r h GLY 34 CO 0.00 0.00 0.49 -1.59 0.00 0.00 0.00 176.54 175.44 2w3r s THR 35 N -3.33 4.70 0.44 4.70 2.01 -1.21 -4.82 115.64 118.12 2w3r s THR 35 Ca 0.02 1.19 -0.05 0.00 0.31 0.00 0.00 61.69 63.17 2w3r s THR 35 Cb 0.09 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 2w3r s THR 35 CO 0.69 -0.38 0.73 -0.54 -0.69 0.00 0.00 174.62 174.43 2w3r s LYS 36 N 3.19 3.56 -0.21 4.92 -0.14 -0.93 -4.89 119.74 125.25 2w3r s LYS 36 Ca 0.35 0.12 -0.03 0.00 -1.36 0.00 0.00 55.97 55.05 2w3r s LYS 36 Cb -0.13 -2.44 -0.01 0.00 -1.68 0.00 0.00 37.83 33.57 2w3r s LYS 36 CO 0.15 -0.10 -0.06 -2.00 -0.76 0.00 0.00 175.35 172.58 2w3r s GLU 37 N -4.49 3.36 -0.05 1.68 2.12 -1.26 -3.32 118.70 116.74 2w3r s GLU 37 Ca 0.46 -0.64 0.04 0.00 0.36 0.00 0.00 54.97 55.19 2w3r s GLU 37 Cb -0.10 -2.95 -0.06 0.00 0.26 0.00 0.00 34.13 31.28 2w3r s GLU 37 CO 0.41 -0.16 0.01 0.41 -0.54 0.00 0.00 175.26 175.39 2w3r n GLY 38 N 4.66 -0.24 0.00 -1.50 0.00 -1.26 -4.91 105.19 101.94 2w3r n GLY 38 Ca -0.18 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2w3r n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r n ASN 40 N -0.43 -5.66 0.00 0.00 4.05 -1.26 -4.84 115.26 107.12 2w3r n ASN 40 Ca 0.00 0.22 0.00 0.00 0.45 0.00 0.00 54.58 55.25 2w3r n ASN 40 Cb 0.00 -4.80 0.00 0.00 1.23 0.00 0.00 39.78 36.21 2w3r n ASN 40 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2w3r n GLU 41 N -2.71 2.10 -0.86 1.20 1.02 -1.26 -4.83 120.64 115.29 2w3r n GLU 41 Ca -0.23 -0.23 0.00 0.00 -0.02 0.00 0.00 57.16 56.68 2w3r n GLU 41 Cb 0.68 -0.70 0.00 0.00 -0.02 0.00 0.00 31.44 31.40 2w3r n GLU 41 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3r n GLY 42 N 0.37 0.47 0.12 0.62 0.00 -1.26 -4.98 105.19 100.53 2w3r n GLY 42 Ca 0.00 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 2w3r n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2w3r n ASP 43 N 1.71 2.09 -0.01 1.61 -0.08 -1.26 -4.72 116.55 115.88 2w3r n ASP 43 Ca 0.00 -0.13 -0.16 0.00 -1.51 0.00 0.00 54.79 52.99 2w3r n ASP 43 Cb 0.00 -0.38 -0.14 0.00 2.34 0.00 0.00 41.12 42.94 2w3r n ASP 43 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2w3r n GLY 45 N 1.82 0.50 0.14 0.00 0.00 -1.07 0.12 105.19 106.70 2w3r n GLY 45 Ca -0.27 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.84 2w3r n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r n ALA 46 N -1.65 0.91 -1.13 4.61 0.00 -1.26 -1.07 120.51 120.92 2w3r n ALA 46 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.65 2w3r n ALA 46 Cb 0.00 -1.11 0.22 0.00 0.00 0.00 0.00 19.45 18.56 2w3r n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n THR 48 N -0.85 0.44 -4.51 0.00 -1.04 -0.23 -1.97 114.28 106.11 2w3r n THR 48 Ca 0.23 -0.08 -0.25 0.00 -2.04 0.00 0.00 64.05 61.91 2w3r n THR 48 Cb 0.88 -2.15 -0.10 0.00 -1.82 0.00 0.00 70.33 67.14 2w3r n THR 48 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2w3r s VAL 49 N 3.04 2.23 -0.16 12.58 -7.23 0.23 -4.74 120.40 126.35 2w3r s VAL 49 Ca 0.83 -2.24 -0.01 0.00 -1.81 0.00 0.00 61.98 58.74 2w3r s VAL 49 Cb -0.48 -2.54 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 2w3r s VAL 49 CO 0.38 -0.26 -0.10 -0.32 -0.31 0.00 0.00 175.10 174.49 2w3r s MET 50 N -3.60 3.40 -0.08 4.82 1.75 0.50 -0.77 119.30 125.33 2w3r s MET 50 Ca 0.31 -0.66 0.01 0.00 -1.25 0.00 0.00 55.69 54.11 2w3r s MET 50 Cb 0.01 -2.76 -0.03 0.00 2.84 0.00 0.00 34.83 34.89 2w3r s MET 50 CO 0.16 0.09 -0.10 0.96 -0.65 0.00 0.00 175.02 175.48 2w3r s ILE 51 N 0.70 3.43 0.04 10.11 -4.36 -0.45 0.31 121.20 130.99 2w3r s ILE 51 Ca -0.05 -0.57 0.08 0.00 -0.26 0.00 0.00 60.65 59.85 2w3r s ILE 51 Cb -0.15 -2.40 -0.03 0.00 1.25 0.00 0.00 42.46 41.13 2w3r s ILE 51 CO 0.02 0.57 -0.22 -0.60 0.24 0.00 0.00 174.94 174.96 2w3r s ARG 52 N -0.49 1.48 0.00 0.37 3.52 0.12 -1.38 118.95 122.56 2w3r s ARG 52 Ca 0.07 -0.96 0.00 0.00 -0.13 0.00 0.00 55.73 54.71 2w3r s ARG 52 Cb -0.12 -1.59 0.00 0.00 -1.56 0.00 0.00 34.95 31.68 2w3r s ARG 52 CO 0.02 0.41 0.00 -0.40 -0.81 0.00 0.00 175.30 174.52 2w3r n ASP 53 N 1.87 0.00 -0.06 -2.12 5.75 0.44 0.74 116.55 123.17 2w3r n ASP 53 Ca -0.17 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.58 2w3r n ASP 53 Cb 0.53 0.00 0.22 0.00 -1.03 0.00 0.00 41.12 40.84 2w3r n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w3r h ALA 54 N 1.74 1.22 0.00 2.12 0.00 -1.91 -2.64 119.26 119.79 2w3r h ALA 54 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2w3r h ALA 54 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2w3r h ALA 54 CO 0.00 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.77 2w3r n ALA 55 N -2.47 1.89 0.00 0.00 0.00 -1.26 -5.01 120.51 113.66 2w3r n ALA 55 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2w3r n ALA 55 Cb 0.28 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2w3r n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3r n GLY 56 N 0.47 0.21 3.18 0.00 0.00 -1.00 -5.05 105.19 103.01 2w3r n GLY 56 Ca 0.05 -1.91 -0.20 0.00 0.00 0.00 0.00 46.02 43.96 2w3r n GLY 56 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w3r s SER 57 N -4.00 1.81 0.12 1.61 1.04 -1.26 -0.42 113.70 112.60 2w3r s SER 57 Ca 0.00 -0.55 -0.20 0.00 0.48 0.00 0.00 55.95 55.68 2w3r s SER 57 Cb 0.00 -0.09 0.05 0.00 0.10 0.00 0.00 66.02 66.08 2w3r s SER 57 CO 0.00 -0.00 0.50 0.00 0.98 0.00 0.00 173.24 174.72 2w3r s ARG 58 N -1.48 1.14 -0.15 4.02 1.70 -0.48 -4.99 118.95 118.71 2w3r s ARG 58 Ca 0.01 -0.51 -0.14 0.00 -0.47 0.00 0.00 55.73 54.62 2w3r s ARG 58 Cb -0.09 0.51 -0.05 0.00 -0.57 0.00 0.00 34.95 34.76 2w3r s ARG 58 CO 0.02 -0.46 0.31 0.00 -1.08 0.00 0.00 175.30 174.09 2w3r s ALA 59 N -3.47 3.59 0.04 7.88 0.00 -1.26 -1.33 121.76 127.21 2w3r s ALA 59 Ca 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 51.96 51.52 2w3r s ALA 59 Cb 0.00 -2.40 -0.03 0.00 0.00 0.00 0.00 23.12 20.70 2w3r s ALA 59 CO -0.10 0.12 0.00 0.14 0.00 0.00 0.00 175.76 175.92 2w3r s VAL 60 N 0.36 0.17 -0.14 0.00 -7.23 0.06 -4.08 120.40 109.54 2w3r s VAL 60 Ca 0.17 -1.38 -0.29 0.00 -1.81 0.00 0.00 61.98 58.67 2w3r s VAL 60 Cb -0.13 -1.02 -0.01 0.00 0.56 0.00 0.00 36.38 35.77 2w3r s VAL 60 CO 0.05 -0.76 1.16 0.20 -0.31 0.00 0.00 175.10 175.43 2w3r s ASN 61 N -2.33 7.05 0.42 4.85 0.01 -1.26 -0.60 114.94 123.08 2w3r s ASN 61 Ca -0.02 1.64 0.16 0.00 -0.71 0.00 0.00 52.86 53.93 2w3r s ASN 61 Cb 0.01 -2.55 0.91 0.00 0.41 0.00 0.00 41.25 40.03 2w3r s ASN 61 CO -0.06 -0.64 1.91 0.00 -1.51 0.00 0.00 177.10 176.79 2w3r h ALA 62 N 7.66 1.44 -0.35 0.60 0.00 -1.75 -3.02 119.26 123.84 2w3r h ALA 62 Ca -0.28 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.21 2w3r h ALA 62 Cb 1.12 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2w3r h ALA 62 CO 0.93 0.35 -0.42 0.00 0.00 0.00 0.00 179.25 180.10 2w3r n LEU 64 N -4.06 0.17 -4.15 0.00 4.77 -1.14 -4.75 117.00 107.84 2w3r n LEU 64 Ca -0.03 -0.09 -0.26 0.00 -0.03 0.00 0.00 56.01 55.61 2w3r n LEU 64 Cb 0.56 -0.02 -0.16 0.00 -2.33 0.00 0.00 43.42 41.48 2w3r n LEU 64 CO 0.49 0.04 -0.50 -0.32 -1.33 0.00 0.00 177.39 175.77 2w3r s MET 65 N -1.96 1.66 0.16 3.23 1.75 -1.16 -4.41 119.30 118.57 2w3r s MET 65 Ca 0.03 -0.62 0.05 0.00 -1.25 0.00 0.00 55.69 53.91 2w3r s MET 65 Cb 0.02 -1.50 -0.04 0.00 2.84 0.00 0.00 34.83 36.15 2w3r s MET 65 CO 0.02 0.30 0.10 -1.64 -0.65 0.00 0.00 175.02 173.15 2w3r s MET 66 N -0.13 2.77 0.18 4.11 -1.94 -1.26 -0.39 119.30 122.63 2w3r s MET 66 Ca 0.00 -0.91 -0.18 0.00 -1.71 0.00 0.00 55.69 52.89 2w3r s MET 66 Cb -0.10 -2.58 0.12 0.00 2.01 0.00 0.00 34.83 34.28 2w3r s MET 66 CO 0.01 0.49 1.64 -0.07 -0.01 0.00 0.00 175.02 177.08 2w3r h LEU 67 N 2.57 -0.58 -1.87 -0.03 3.38 -1.79 -2.13 115.31 114.85 2w3r h LEU 67 Ca -0.47 0.15 0.14 0.00 0.09 0.00 0.00 57.88 57.79 2w3r h LEU 67 Cb 1.20 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 2w3r h LEU 67 CO 0.62 -0.20 0.54 -0.65 0.09 0.00 0.00 178.44 178.84 2w3r h PRO 68 N -0.07 0.00 0.00 1.13 0.11 -1.91 -1.11 132.00 130.14 2w3r h PRO 68 Ca 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.30 2w3r h PRO 68 Cb 0.40 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 2w3r h PRO 68 CO -0.49 0.00 -0.10 1.96 -0.21 0.00 0.00 178.00 179.16 2w3r h GLN 69 N 0.00 0.00 -0.65 1.05 4.20 -1.78 -3.03 115.11 114.89 2w3r h GLN 69 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 2w3r h GLN 69 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 2w3r h GLN 69 CO -0.00 0.10 0.00 0.44 -0.67 0.00 0.00 178.83 178.70 2w3r n ILE 70 N -3.31 1.48 -1.71 2.54 -5.35 -0.42 -4.98 119.36 107.62 2w3r n ILE 70 Ca -0.00 -1.02 -0.43 0.00 -0.27 0.00 0.00 62.75 61.03 2w3r n ILE 70 Cb 0.32 0.17 -0.03 0.00 -1.74 0.00 0.00 39.64 38.35 2w3r n ILE 70 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2w3r n ALA 71 N 1.12 2.48 -1.88 -1.28 0.00 -1.15 -2.08 120.51 117.71 2w3r n ALA 71 Ca 0.23 0.38 -0.16 0.00 0.00 0.00 0.00 53.44 53.90 2w3r n ALA 71 Cb 0.76 -2.52 -0.04 0.00 0.00 0.00 0.00 19.45 17.65 2w3r n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3r n GLY 72 N 3.97 0.65 3.40 0.00 0.00 0.17 -5.00 105.19 108.38 2w3r n GLY 72 Ca 0.17 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2w3r n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s LYS 73 N -4.07 1.47 -0.49 1.61 1.02 -0.89 -4.85 119.74 113.54 2w3r s LYS 73 Ca 0.00 -1.52 -0.19 0.00 0.02 0.00 0.00 55.97 54.28 2w3r s LYS 73 Cb 0.00 -1.69 0.05 0.00 -0.52 0.00 0.00 37.83 35.66 2w3r s LYS 73 CO 0.00 0.36 0.63 0.00 -0.92 0.00 0.00 175.35 175.42 2w3r s ALA 74 N -1.86 3.37 -0.19 5.17 0.00 0.23 -1.63 121.76 126.85 2w3r s ALA 74 Ca 0.20 -1.62 -0.14 0.00 0.00 0.00 0.00 51.96 50.40 2w3r s ALA 74 Cb -0.07 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2w3r s ALA 74 CO 0.09 -1.96 0.29 -1.17 0.00 0.00 0.00 175.76 173.01 2w3r s LEU 75 N 2.69 4.19 -0.10 0.00 2.96 0.19 0.16 118.68 128.77 2w3r s LEU 75 Ca 0.17 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.52 2w3r s LEU 75 Cb -0.18 -2.36 0.02 0.00 0.50 0.00 0.00 46.19 44.17 2w3r s LEU 75 CO 0.13 0.04 -0.13 -0.60 -1.32 0.00 0.00 176.35 174.48 2w3r s ARG 76 N 0.82 1.91 0.31 1.98 6.06 0.15 -0.76 118.95 129.42 2w3r s ARG 76 Ca 0.15 -0.45 0.03 0.00 -2.50 0.00 0.00 55.73 52.96 2w3r s ARG 76 Cb -0.13 -1.67 0.03 0.00 0.06 0.00 0.00 34.95 33.24 2w3r s ARG 76 CO 0.05 -0.07 0.25 0.25 -2.50 0.00 0.00 175.30 173.28 2w3r n THR 77 N 4.22 0.00 -0.34 4.11 -2.24 -1.26 -0.37 114.28 118.40 2w3r n THR 77 Ca -0.19 -1.21 -0.03 0.00 -2.27 0.00 0.00 64.05 60.34 2w3r n THR 77 Cb 0.51 -0.28 0.09 0.00 -2.10 0.00 0.00 70.33 68.55 2w3r n THR 77 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2w3r h ILE 78 N 0.54 1.25 0.00 2.28 6.09 -1.87 -2.16 117.51 123.65 2w3r h ILE 78 Ca -0.19 -0.56 0.00 0.00 -1.37 0.00 0.00 64.86 62.74 2w3r h ILE 78 Cb 0.71 -0.03 0.00 0.00 0.47 0.00 0.00 36.82 37.97 2w3r h ILE 78 CO 0.30 0.27 0.00 -1.84 -3.07 0.00 0.00 178.15 173.81 2w3r n GLU 79 N -4.37 0.26 0.00 2.19 0.00 -1.26 -2.24 120.64 115.21 2w3r n GLU 79 Ca 0.10 0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.33 2w3r n GLU 79 Cb 0.06 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.00 2w3r n GLU 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2w3r n GLY 80 N -0.37 1.46 0.12 -1.84 0.00 -0.82 -4.73 105.19 99.00 2w3r n GLY 80 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2w3r n GLY 80 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2w3r h ILE 81 N 0.16 1.49 -4.22 -0.61 1.08 -1.36 -3.45 117.51 110.60 2w3r h ILE 81 Ca 0.00 -2.85 -0.51 0.00 -0.39 0.00 0.00 64.86 61.12 2w3r h ILE 81 Cb 0.39 2.70 0.10 0.00 -3.07 0.00 0.00 36.82 36.94 2w3r h ILE 81 CO 0.00 0.83 0.37 0.00 -0.69 0.00 0.00 178.15 178.66 2w3r s ALA 82 N -2.93 2.52 0.69 1.87 0.00 -1.26 -4.43 121.76 118.21 2w3r s ALA 82 Ca -0.04 0.46 -0.14 0.00 0.00 0.00 0.00 51.96 52.24 2w3r s ALA 82 Cb 0.08 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.94 2w3r s ALA 82 CO 0.86 -1.22 1.13 0.00 0.00 0.00 0.00 175.76 176.53 2w3r s ALA 83 N -2.46 2.35 0.43 0.00 0.00 0.16 -4.94 121.76 117.28 2w3r s ALA 83 Ca 0.65 0.59 0.11 0.00 0.00 0.00 0.00 51.96 53.31 2w3r s ALA 83 Cb -0.19 -3.35 0.94 0.00 0.00 0.00 0.00 23.12 20.52 2w3r s ALA 83 CO 0.43 -1.49 2.02 -1.35 0.00 0.00 0.00 175.76 175.37 2w3r h PRO 84 N -0.20 0.26 0.00 0.00 0.11 -1.94 -2.19 132.00 128.03 2w3r h PRO 84 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2w3r h PRO 84 Cb 1.26 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2w3r h PRO 84 CO 0.52 0.27 0.00 -0.40 -0.21 0.00 0.00 178.00 178.18 2w3r n ASP 85 N -4.41 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.70 2w3r n ASP 85 Ca -0.00 -0.63 0.00 0.00 -0.01 0.00 0.00 54.79 54.15 2w3r n ASP 85 Cb 0.16 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 2w3r n ASP 85 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w3r n GLY 86 N 1.11 0.56 3.70 6.12 0.00 -0.82 -5.07 105.19 110.79 2w3r n GLY 86 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2w3r n GLY 86 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3r s ARG 87 N -0.67 4.37 0.77 1.61 3.52 -1.26 -4.78 118.95 122.51 2w3r s ARG 87 Ca 0.00 1.85 -0.12 0.00 -0.13 0.00 0.00 55.73 57.33 2w3r s ARG 87 Cb 0.00 -3.41 0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2w3r s ARG 87 CO 0.00 -0.39 1.11 -0.51 -0.81 0.00 0.00 175.30 174.70 2w3r s LEU 88 N 1.53 3.10 0.38 -0.88 1.43 -1.26 0.35 118.68 123.33 2w3r s LEU 88 Ca 0.60 1.95 -0.25 0.00 -1.03 0.00 0.00 54.13 55.41 2w3r s LEU 88 Cb -0.30 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.29 2w3r s LEU 88 CO 0.28 -2.12 1.07 -2.28 0.23 0.00 0.00 176.35 173.53 2w3r s HIS 89 N -2.68 3.28 0.36 0.29 5.65 -1.26 -4.75 115.29 116.17 2w3r s HIS 89 Ca 0.64 1.64 0.17 0.00 0.25 0.00 0.00 55.06 57.76 2w3r s HIS 89 Cb -0.19 -3.19 1.22 0.00 -1.18 0.00 0.00 32.58 29.23 2w3r s HIS 89 CO 0.52 -0.72 1.61 -1.35 -0.65 0.00 0.00 174.74 174.15 2w3r h PRO 90 N 2.68 0.11 -0.08 2.88 0.10 -1.93 0.14 132.00 135.91 2w3r h PRO 90 Ca -0.48 -0.01 -0.01 0.00 0.10 0.00 0.00 66.00 65.60 2w3r h PRO 90 Cb 1.22 -0.03 -0.00 0.00 0.10 0.00 0.00 31.00 32.29 2w3r h PRO 90 CO 0.63 0.08 -0.00 0.28 0.10 0.00 0.00 178.00 179.08 2w3r h VAL 91 N 0.12 1.26 -0.98 3.15 2.07 -1.91 -2.36 116.25 117.60 2w3r h VAL 91 Ca 0.79 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 67.53 2w3r h VAL 91 Cb 1.97 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 33.34 2w3r h VAL 91 CO -0.72 0.23 0.64 1.56 0.02 0.00 0.00 177.57 179.31 2w3r h GLN 92 N -0.15 1.21 -0.17 1.57 4.20 -1.16 -1.67 115.11 118.94 2w3r h GLN 92 Ca 0.02 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.52 2w3r h GLN 92 Cb 0.36 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 2w3r h GLN 92 CO 0.01 0.80 -0.49 0.37 -0.67 0.00 0.00 178.83 178.85 2w3r h GLN 93 N 1.24 0.46 -0.77 1.46 5.75 -1.13 -3.15 115.11 118.96 2w3r h GLN 93 Ca 0.39 -0.26 -0.05 0.00 -0.15 0.00 0.00 58.65 58.58 2w3r h GLN 93 Cb 0.00 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 2w3r h GLN 93 CO -0.12 0.84 0.27 0.00 -2.65 0.00 0.00 178.83 177.17 2w3r h ALA 94 N 1.12 1.01 -0.42 3.38 0.00 -0.76 -1.89 119.26 121.69 2w3r h ALA 94 Ca 0.02 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2w3r h ALA 94 Cb 0.99 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2w3r h ALA 94 CO 0.09 0.67 -0.01 0.52 0.00 0.00 0.00 179.25 180.51 2w3r h MET 95 N 1.14 0.68 -0.03 0.00 2.86 -1.35 0.30 114.93 118.54 2w3r h MET 95 Ca 0.25 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 2w3r h MET 95 Cb 0.27 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2w3r h MET 95 CO -0.01 0.71 -0.02 0.82 1.06 0.00 0.00 176.91 179.46 2w3r h ILE 96 N 0.64 1.37 -0.38 -1.22 2.04 -1.47 -0.22 117.51 118.27 2w3r h ILE 96 Ca 0.13 -1.14 0.07 0.00 1.00 0.00 0.00 64.86 64.92 2w3r h ILE 96 Cb 0.42 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.52 2w3r h ILE 96 CO 0.02 0.30 0.01 0.44 0.00 0.00 0.00 178.15 178.92 2w3r h ASP 97 N -0.39 -0.14 -0.57 1.72 3.32 -1.13 -3.11 116.42 116.12 2w3r h ASP 97 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2w3r h ASP 97 Cb 0.51 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2w3r h ASP 97 CO 0.01 -0.03 0.00 1.41 -1.72 0.00 0.00 179.24 178.90 2w3r n HIS 98 N -5.18 0.75 -3.59 4.55 8.25 0.08 -4.97 115.22 115.11 2w3r n HIS 98 Ca 0.02 -0.38 -0.22 0.00 -0.26 0.00 0.00 57.72 56.89 2w3r n HIS 98 Cb 0.20 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.38 2w3r n HIS 98 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2w3r n HIS 99 N 1.35 -2.41 1.18 4.41 8.25 -0.63 -4.74 115.22 122.63 2w3r n HIS 99 Ca 0.21 0.95 0.01 0.00 -0.26 0.00 0.00 57.72 58.62 2w3r n HIS 99 Cb 0.55 -4.83 0.03 0.00 1.12 0.00 0.00 29.99 26.85 2w3r n HIS 99 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2w3r n GLY 100 N -1.58 0.85 3.21 -1.41 0.00 -0.19 -4.76 105.19 101.31 2w3r n GLY 100 Ca -0.15 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 2w3r n GLY 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w3r s SER 101 N -0.35 -0.33 0.03 1.61 1.04 -1.26 -4.72 113.70 109.71 2w3r s SER 101 Ca 0.04 0.64 -0.02 0.00 0.48 0.00 0.00 55.95 57.09 2w3r s SER 101 Cb 0.02 0.65 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 2w3r s SER 101 CO 0.01 -0.11 -0.03 0.00 0.98 0.00 0.00 173.24 174.09 2w3r n GLN 102 N 2.90 0.05 0.07 4.02 6.02 -1.26 -4.82 117.38 124.36 2w3r n GLN 102 Ca -0.13 0.02 -0.01 0.00 -0.01 0.00 0.00 57.00 56.87 2w3r n GLN 102 Cb 0.58 -0.39 -0.06 0.00 1.02 0.00 0.00 30.24 31.39 2w3r n GLN 102 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2w3r n GLY 104 N 1.35 0.80 0.13 0.00 0.00 -1.26 -4.95 105.19 101.25 2w3r n GLY 104 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2w3r n GLY 104 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2w3r h PHE 105 N 0.00 0.31 0.00 1.61 3.57 -2.01 -3.15 116.94 117.28 2w3r h PHE 105 Ca 0.00 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2w3r h PHE 105 Cb 0.00 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.71 2w3r h PHE 105 CO 0.00 0.99 -0.61 0.00 -2.23 0.00 0.00 178.31 176.47 2w3r h THR 107 N 0.00 0.76 -0.97 0.00 2.02 -1.91 -0.22 112.91 112.58 2w3r h THR 107 Ca 0.00 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.29 2w3r h THR 107 Cb 0.61 0.76 -0.08 0.00 -1.74 0.00 0.00 68.15 67.70 2w3r h THR 107 CO 0.00 0.00 0.62 -0.65 0.37 0.00 0.00 175.52 175.86 2w3r h PRO 108 N -0.17 0.93 -0.19 6.66 0.11 -1.77 0.14 132.00 137.71 2w3r h PRO 108 Ca 0.03 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.10 2w3r h PRO 108 Cb 0.21 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 2w3r h PRO 108 CO -0.09 0.62 0.07 0.78 -0.21 0.00 0.00 178.00 179.17 2w3r h GLY 109 N 0.96 0.24 0.77 -0.55 0.00 -1.52 -2.92 103.07 100.05 2w3r h GLY 109 Ca 0.47 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.75 2w3r h GLY 109 CO -0.23 0.04 -0.01 0.74 0.00 0.00 0.00 176.54 177.07 2w3r h PHE 110 N 0.17 -0.04 -0.51 5.60 -1.00 0.11 -2.76 116.94 118.51 2w3r h PHE 110 Ca 0.08 -0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.94 2w3r h PHE 110 Cb 0.04 0.01 -0.10 0.00 3.61 0.00 0.00 35.95 39.51 2w3r h PHE 110 CO -0.11 0.20 -0.40 0.82 -1.61 0.00 0.00 178.31 177.21 2w3r h ILE 111 N -0.28 0.13 -0.50 -0.55 1.08 -0.77 0.31 117.51 116.93 2w3r h ILE 111 Ca -0.00 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.49 2w3r h ILE 111 Cb 0.26 0.13 -0.04 0.00 -3.07 0.00 0.00 36.82 34.10 2w3r h ILE 111 CO 0.01 0.00 0.29 0.58 -0.69 0.00 0.00 178.15 178.34 2w3r h VAL 112 N -0.25 1.04 -0.70 1.67 2.07 -1.56 0.68 116.25 119.20 2w3r h VAL 112 Ca 0.18 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2w3r h VAL 112 Cb 0.57 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2w3r h VAL 112 CO -0.63 0.11 0.44 0.28 0.02 0.00 0.00 177.57 177.78 2w3r h SER 113 N 0.58 0.82 0.04 0.57 0.02 -0.93 -0.52 113.55 114.13 2w3r h SER 113 Ca 0.21 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2w3r h SER 113 Cb 0.04 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.37 2w3r h SER 113 CO -0.10 0.62 -0.02 0.24 -1.14 0.00 0.00 176.83 176.43 2w3r h MET 114 N 0.96 -0.05 -0.90 3.45 2.07 0.43 -2.99 114.93 117.90 2w3r h MET 114 Ca 0.25 0.00 0.11 0.00 -2.07 0.00 0.00 59.70 58.00 2w3r h MET 114 Cb -0.07 0.01 -0.08 0.00 -1.87 0.00 0.00 31.60 29.60 2w3r h MET 114 CO -0.05 0.57 0.53 0.00 1.07 0.00 0.00 176.91 179.03 2w3r h ALA 115 N 0.15 1.32 -0.79 6.32 0.00 0.48 0.40 119.26 127.14 2w3r h ALA 115 Ca -0.01 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2w3r h ALA 115 Cb 0.64 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 115 CO 0.01 0.14 0.48 0.00 0.00 0.00 0.00 179.25 179.88 2w3r h ALA 116 N 1.50 1.01 -0.31 0.00 0.00 -1.18 0.42 119.26 120.71 2w3r h ALA 116 Ca 0.44 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 55.11 2w3r h ALA 116 Cb 0.44 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2w3r h ALA 116 CO -0.26 0.47 -0.44 0.00 0.00 0.00 0.00 179.25 179.02 2w3r h ALA 117 N 1.26 0.65 -0.08 0.00 0.00 -0.95 -2.77 119.26 117.37 2w3r h ALA 117 Ca 0.29 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2w3r h ALA 117 Cb -0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2w3r h ALA 117 CO -0.05 0.67 -0.32 1.25 0.00 0.00 0.00 179.25 180.79 2w3r h HIS 118 N 0.63 0.17 -0.42 0.00 6.17 0.05 0.49 115.15 122.23 2w3r h HIS 118 Ca 0.04 -0.04 -0.13 0.00 0.71 0.00 0.00 60.37 60.96 2w3r h HIS 118 Cb 1.00 -0.04 -0.01 0.00 2.52 0.00 0.00 27.41 30.88 2w3r h HIS 118 CO 0.05 0.46 -0.24 0.22 0.71 0.00 0.00 177.93 179.14 2w3r h ASP 119 N 0.14 0.89 -0.54 3.26 -0.00 -0.79 -3.00 116.42 116.38 2w3r h ASP 119 Ca 0.02 -0.34 -0.12 0.00 -0.00 0.00 0.00 57.03 56.59 2w3r h ASP 119 Cb 0.64 -0.25 -0.07 0.00 -0.00 0.00 0.00 39.33 39.66 2w3r h ASP 119 CO 0.05 1.09 0.12 0.54 -0.00 0.00 0.00 179.24 181.03 2w3r n ARG 120 N -4.10 3.52 -4.39 0.28 1.74 -1.00 -4.96 116.66 107.76 2w3r n ARG 120 Ca -0.00 -3.05 -0.39 0.00 -0.77 0.00 0.00 57.85 53.64 2w3r n ARG 120 Cb 0.46 -2.09 -0.06 0.00 -1.02 0.00 0.00 32.46 29.75 2w3r n ARG 120 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2w3r n ASP 121 N -0.22 -1.89 -4.81 0.55 2.03 0.52 -4.92 116.55 107.80 2w3r n ASP 121 Ca 0.33 -1.16 -0.37 0.00 0.52 0.00 0.00 54.79 54.11 2w3r n ASP 121 Cb 1.19 -2.05 -0.06 0.00 -0.72 0.00 0.00 41.12 39.48 2w3r n ASP 121 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2w3r s ARG 122 N -7.13 4.33 0.00 -0.67 1.81 0.14 -4.99 118.95 112.44 2w3r s ARG 122 Ca 0.66 0.96 0.00 0.00 -1.72 0.00 0.00 55.73 55.64 2w3r s ARG 122 Cb -0.38 -2.91 0.00 0.00 -0.45 0.00 0.00 34.95 31.21 2w3r s ARG 122 CO 0.99 0.40 0.35 1.63 -0.68 0.00 0.00 175.30 177.98 2w3r n LYS 123 N 0.79 0.11 -2.78 3.54 5.02 -1.26 -4.63 118.16 118.95 2w3r n LYS 123 Ca -0.02 -0.41 -0.44 0.00 -2.02 0.00 0.00 58.31 55.42 2w3r n LYS 123 Cb 0.51 -0.69 0.00 0.00 -0.02 0.00 0.00 35.03 34.83 2w3r n LYS 123 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2w3r n ASP 124 N -0.06 5.24 -0.04 4.39 5.75 -1.26 -4.84 116.55 125.73 2w3r n ASP 124 Ca 0.00 -3.04 -0.02 0.00 -0.01 0.00 0.00 54.79 51.72 2w3r n ASP 124 Cb 0.24 -1.52 0.22 0.00 -1.03 0.00 0.00 41.12 39.03 2w3r n ASP 124 CO 0.00 0.00 0.00 1.88 -0.11 0.00 0.00 177.20 178.97 2w3r h TYR 125 N 6.61 0.66 -0.06 2.11 -1.99 -1.97 -1.21 116.97 121.11 2w3r h TYR 125 Ca 0.33 -0.09 -0.00 0.00 2.00 0.00 0.00 58.73 60.97 2w3r h TYR 125 Cb 0.79 -0.18 -0.00 0.00 2.00 0.00 0.00 36.73 39.33 2w3r h TYR 125 CO 1.13 0.66 0.02 -0.44 -0.00 0.00 0.00 178.16 179.53 2w3r h ASP 126 N 0.58 0.08 0.12 3.88 3.32 -1.95 0.54 116.42 122.98 2w3r h ASP 126 Ca 0.11 -0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.80 2w3r h ASP 126 Cb 0.45 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 2w3r h ASP 126 CO 0.02 0.08 -1.99 0.47 -1.72 0.00 0.00 179.24 176.10 2w3r n ASP 127 N -4.50 2.11 -0.24 6.45 8.00 -1.01 -3.03 116.55 124.33 2w3r n ASP 127 Ca -0.02 0.21 -0.03 0.00 0.71 0.00 0.00 54.79 55.65 2w3r n ASP 127 Cb 0.10 -0.86 0.14 0.00 -0.02 0.00 0.00 41.12 40.49 2w3r n ASP 127 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2w3r h LEU 128 N 0.02 0.97 -1.99 0.64 4.07 -0.86 -3.17 115.31 114.99 2w3r h LEU 128 Ca -0.43 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.41 2w3r h LEU 128 Cb 2.00 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 43.49 2w3r h LEU 128 CO 0.07 0.84 0.00 0.18 -1.08 0.00 0.00 178.44 178.45 2w3r n LEU 129 N -4.31 2.74 -0.15 1.67 4.77 0.19 -4.47 117.00 117.45 2w3r n LEU 129 Ca 0.07 -1.27 -0.03 0.00 -0.03 0.00 0.00 56.01 54.75 2w3r n LEU 129 Cb 0.16 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.21 2w3r n LEU 129 CO 0.40 0.55 0.88 0.00 -1.33 0.00 0.00 177.39 177.89 2w3r h ALA 130 N 3.40 0.49 0.00 -1.18 0.00 -1.50 0.05 119.26 120.52 2w3r h ALA 130 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2w3r h ALA 130 Cb 0.77 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2w3r h ALA 130 CO 0.00 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.31 2w3r n GLY 131 N -1.29 -0.37 3.42 0.00 0.00 -1.26 -4.48 105.19 101.20 2w3r n GLY 131 Ca 0.05 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2w3r n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w3r s ASN 132 N -2.29 4.76 -0.14 1.61 -0.87 0.00 -2.60 114.94 115.42 2w3r s ASN 132 Ca 0.09 -0.24 -0.05 0.00 -1.57 0.00 0.00 52.86 51.09 2w3r s ASN 132 Cb 0.05 -1.82 -0.03 0.00 -0.02 0.00 0.00 41.25 39.42 2w3r s ASN 132 CO 0.10 0.04 0.02 -0.76 -2.57 0.00 0.00 177.10 173.92 2w3r s LEU 133 N 1.16 3.64 -0.09 0.60 1.43 0.12 -4.99 118.68 120.54 2w3r s LEU 133 Ca 0.03 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.23 2w3r s LEU 133 Cb -0.14 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2w3r s LEU 133 CO 0.01 0.26 -0.13 0.00 0.23 0.00 0.00 176.35 176.72 2w3r h ARG 135 N 7.25 0.00 0.00 0.00 9.65 -2.02 -3.42 114.38 125.83 2w3r h ARG 135 Ca -0.30 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.43 2w3r h ARG 135 Cb 1.18 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.74 2w3r h ARG 135 CO 0.47 0.17 -0.91 0.00 2.80 0.00 0.00 179.97 182.50 2w3r h THR 137 N -1.00 1.33 0.00 0.00 1.35 -1.95 -3.48 112.91 109.16 2w3r h THR 137 Ca -0.22 -2.75 0.00 0.00 -0.55 0.00 0.00 66.41 62.89 2w3r h THR 137 Cb 1.03 2.97 0.00 0.00 -1.73 0.00 0.00 68.15 70.43 2w3r h THR 137 CO -0.13 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.57 2w3r n GLY 138 N 1.62 0.76 4.47 5.82 0.00 -1.26 -4.63 105.19 111.97 2w3r n GLY 138 Ca -0.14 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2w3r n GLY 138 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2w3r n TYR 139 N -2.43 0.00 -0.34 1.61 4.02 -1.26 -4.77 117.16 114.00 2w3r n TYR 139 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.94 2w3r n TYR 139 Cb 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 39.34 39.45 2w3r n TYR 139 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2w3r h ALA 140 N 0.00 0.63 -0.48 -0.72 0.00 -2.01 0.26 119.26 116.94 2w3r h ALA 140 Ca 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 2w3r h ALA 140 Cb 0.00 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2w3r h ALA 140 CO 0.00 -0.39 0.16 -1.00 0.00 0.00 0.00 179.25 178.02 2w3r h PRO 141 N 0.00 0.70 -0.47 0.00 0.13 -1.86 -2.79 132.00 127.71 2w3r h PRO 141 Ca 0.45 -0.11 -0.07 0.00 -0.87 0.00 0.00 66.00 65.40 2w3r h PRO 141 Cb 0.70 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.68 2w3r h PRO 141 CO -0.96 0.60 -0.00 0.82 -0.23 0.00 0.00 178.00 178.23 2w3r h ILE 142 N 0.69 1.24 -0.33 -3.56 2.04 -0.79 -1.98 117.51 114.81 2w3r h ILE 142 Ca 0.16 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.03 2w3r h ILE 142 Cb 0.19 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2w3r h ILE 142 CO -0.01 0.35 0.22 0.25 0.00 0.00 0.00 178.15 178.96 2w3r h LEU 143 N 0.73 0.37 0.02 1.44 6.46 -1.14 -1.26 115.31 121.93 2w3r h LEU 143 Ca 0.14 -0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.90 2w3r h LEU 143 Cb 0.45 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.28 2w3r h LEU 143 CO 0.02 0.27 -0.05 0.03 -0.62 0.00 0.00 178.44 178.09 2w3r h ARG 144 N 0.44 -0.10 -0.98 1.25 3.08 -1.23 -1.33 114.38 115.51 2w3r h ARG 144 Ca 0.12 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.21 2w3r h ARG 144 Cb -0.04 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 2w3r h ARG 144 CO -0.03 -0.06 0.65 0.00 -1.07 0.00 0.00 179.97 179.45 2w3r h ALA 145 N 0.87 1.35 -0.25 0.04 0.00 -1.33 -1.09 119.26 118.86 2w3r h ALA 145 Ca 0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 145 Cb 0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2w3r h ALA 145 CO -0.03 0.56 0.08 0.00 0.00 0.00 0.00 179.25 179.86 2w3r h ALA 146 N 1.42 0.32 -0.26 0.00 0.00 -0.84 -1.88 119.26 118.03 2w3r h ALA 146 Ca 0.39 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 2w3r h ALA 146 Cb -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2w3r h ALA 146 CO -0.11 -0.06 -0.38 0.93 0.00 0.00 0.00 179.25 179.63 2w3r h GLU 147 N 0.23 0.59 0.34 0.00 5.08 -1.08 -2.52 114.58 117.21 2w3r h GLU 147 Ca 0.08 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 2w3r h GLU 147 Cb 0.23 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2w3r h GLU 147 CO -0.00 0.87 -0.16 0.00 -1.00 0.00 0.00 179.01 178.72 2w3r h ALA 148 N 1.10 -0.45 0.00 3.43 0.00 -1.12 -2.94 119.26 119.27 2w3r h ALA 148 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2w3r h ALA 148 Cb 0.88 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2w3r h ALA 148 CO 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 178.67 2w3r h ALA 149 N -0.06 1.00 -0.09 0.00 0.00 -1.37 -1.83 119.26 116.91 2w3r h ALA 149 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 149 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 149 CO 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 2w3r h ALA 150 N 2.06 1.61 -0.74 0.00 0.00 -1.26 -2.56 119.26 118.37 2w3r h ALA 150 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2w3r h ALA 150 Cb 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2w3r h ALA 150 CO 0.00 0.28 0.44 0.78 0.00 0.00 0.00 179.25 180.75 2w3r h GLY 151 N 0.63 1.08 -1.73 0.00 0.00 -1.39 -3.45 103.07 98.21 2w3r h GLY 151 Ca 0.03 -0.46 -0.52 0.00 0.00 0.00 0.00 47.33 46.38 2w3r h GLY 151 CO 0.02 0.44 0.38 -0.54 0.00 0.00 0.00 176.54 176.84 2w3r s GLU 152 N -5.95 2.60 0.55 4.80 0.41 -0.96 -5.02 118.70 115.13 2w3r s GLU 152 Ca -0.13 1.51 -0.19 0.00 -0.41 0.00 0.00 54.97 55.75 2w3r s GLU 152 Cb 0.15 -1.91 -0.06 0.00 -1.78 0.00 0.00 34.13 30.53 2w3r s GLU 152 CO 0.79 -1.43 1.13 -1.25 -0.49 0.00 0.00 175.26 174.01 2w3r s PRO 153 N -4.01 3.35 0.66 0.39 0.04 -1.26 -5.01 135.00 129.15 2w3r s PRO 153 Ca 0.69 1.60 -0.18 0.00 0.04 0.00 0.00 61.00 63.16 2w3r s PRO 153 Cb -0.23 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 2w3r s PRO 153 CO 0.42 -0.85 1.28 -2.30 0.04 0.00 0.00 177.00 175.59 2w3r n PRO 154 N -1.33 1.06 -2.38 0.56 -0.02 -1.26 -4.91 135.00 126.72 2w3r n PRO 154 Ca 0.12 0.42 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 2w3r n PRO 154 Cb 0.51 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 2w3r n PRO 154 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3r s ALA 155 N -1.43 3.43 0.10 3.55 0.00 -1.26 -4.96 121.76 121.19 2w3r s ALA 155 Ca 0.82 0.98 -0.00 0.00 0.00 0.00 0.00 51.96 53.76 2w3r s ALA 155 Cb -0.38 -3.38 -0.24 0.00 0.00 0.00 0.00 23.12 19.13 2w3r s ALA 155 CO 0.41 -0.31 1.21 0.38 0.00 0.00 0.00 175.76 177.45 2w3r h ASP 156 N 4.20 0.27 0.31 0.00 3.04 -1.99 -3.24 116.42 119.01 2w3r h ASP 156 Ca -0.46 -0.29 -0.11 0.00 -3.24 0.00 0.00 57.03 52.93 2w3r h ASP 156 Cb 1.21 -0.09 -0.01 0.00 -1.04 0.00 0.00 39.33 39.40 2w3r h ASP 156 CO 0.69 1.21 -0.45 4.11 -2.04 0.00 0.00 179.24 182.77 2w3r h TRP 157 N 0.05 0.21 -0.03 4.15 0.09 -2.00 -1.48 115.95 116.94 2w3r h TRP 157 Ca -0.09 -0.06 -0.21 0.00 0.09 0.00 0.00 58.89 58.63 2w3r h TRP 157 Cb 1.87 -0.04 -0.00 0.00 0.08 0.00 0.00 29.16 31.06 2w3r h TRP 157 CO 0.04 0.59 -0.85 -0.07 0.09 0.00 0.00 178.44 178.24 2w3r h LEU 158 N 0.15 0.50 -0.72 0.11 3.38 -1.94 -3.22 115.31 113.57 2w3r h LEU 158 Ca 0.01 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 2w3r h LEU 158 Cb 0.85 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2w3r h LEU 158 CO 0.07 1.15 -0.31 1.56 0.09 0.00 0.00 178.44 180.99 2w3r h GLN 159 N 0.25 0.00 -0.89 1.13 4.20 -1.53 -3.18 115.11 115.09 2w3r h GLN 159 Ca -0.06 0.00 0.24 0.00 0.06 0.00 0.00 58.65 58.89 2w3r h GLN 159 Cb 1.46 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.19 2w3r h GLN 159 CO 0.15 0.31 0.62 0.00 -0.67 0.00 0.00 178.83 179.24 2w3r h ALA 160 N 1.69 2.59 0.00 3.87 0.00 -1.28 -1.24 119.26 124.88 2w3r h ALA 160 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2w3r h ALA 160 Cb 0.96 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2w3r h ALA 160 CO 0.04 -0.86 0.00 -0.25 0.00 0.00 0.00 179.25 178.18 2w3r n ASP 161 N -4.37 0.00 -0.25 0.00 9.92 -1.20 -2.97 116.55 117.68 2w3r n ASP 161 Ca 0.19 0.47 -0.03 0.00 -0.53 0.00 0.00 54.79 54.89 2w3r n ASP 161 Cb 0.86 -0.48 0.16 0.00 -0.64 0.00 0.00 41.12 41.02 2w3r n ASP 161 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2w3r h ALA 162 N 2.11 1.25 -0.25 2.24 0.00 -1.48 -3.21 119.26 119.93 2w3r h ALA 162 Ca 0.00 -0.13 -0.27 0.00 0.00 0.00 0.00 54.91 54.51 2w3r h ALA 162 Cb 0.05 -0.31 -0.10 0.00 0.00 0.00 0.00 17.79 17.43 2w3r h ALA 162 CO 0.00 0.59 0.07 0.00 0.00 0.00 0.00 179.25 179.91 2w3r n ALA 163 N -2.43 5.70 -2.84 0.00 0.00 -1.16 -4.90 120.51 114.88 2w3r n ALA 163 Ca 0.08 -1.80 -0.36 0.00 0.00 0.00 0.00 53.44 51.36 2w3r n ALA 163 Cb 0.12 -1.83 -0.07 0.00 0.00 0.00 0.00 19.45 17.67 2w3r n ALA 163 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2w3r s PHE 164 N -0.53 3.53 -0.45 0.00 5.36 -1.21 -4.50 117.98 120.18 2w3r s PHE 164 Ca 0.45 0.46 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 2w3r s PHE 164 Cb 0.26 -1.96 0.00 0.00 -0.34 0.00 0.00 43.02 40.98 2w3r s PHE 164 CO -0.06 0.64 0.00 -2.37 -1.46 0.00 0.00 175.22 171.96 2w3r n THR 165 N 2.25 -0.12 -1.60 0.12 5.66 -1.26 -4.97 114.28 114.36 2w3r n THR 165 Ca -0.19 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.51 2w3r n THR 165 Cb 0.54 -0.56 -0.05 0.00 -1.55 0.00 0.00 70.33 68.71 2w3r n THR 165 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2w3r n LEU 166 N -1.99 6.88 0.00 1.09 4.77 -1.26 -5.17 117.00 121.31 2w3r n LEU 166 Ca -0.05 -4.25 0.00 0.00 -0.03 0.00 0.00 56.01 51.68 2w3r n LEU 166 Cb 0.36 -1.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 2w3r n LEU 166 CO 0.07 1.83 0.00 -2.65 -1.33 0.00 0.00 177.39 175.31 2w3r n PRO 179 N 1.28 0.00 -3.76 3.23 -0.02 -1.26 -5.72 135.00 128.74 2w3r n PRO 179 Ca 0.53 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.88 2w3r n PRO 179 Cb 0.48 -0.35 -0.12 0.00 -0.02 0.00 0.00 33.50 33.49 2w3r n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3r s ALA 180 N 0.00 -0.68 -0.07 3.55 0.00 -1.26 -4.67 121.76 118.62 2w3r s ALA 180 Ca 0.00 0.86 -0.25 0.00 0.00 0.00 0.00 51.96 52.57 2w3r s ALA 180 Cb 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 2w3r s ALA 180 CO 0.00 -0.15 0.79 0.12 0.00 0.00 0.00 175.76 176.52 2w3r s PHE 181 N 0.40 3.56 -0.52 0.00 5.36 -0.21 -4.96 117.98 121.62 2w3r s PHE 181 Ca -0.02 1.35 0.04 0.00 -0.96 0.00 0.00 56.93 57.33 2w3r s PHE 181 Cb -0.04 -2.91 0.13 0.00 -0.34 0.00 0.00 43.02 39.86 2w3r s PHE 181 CO -0.02 -0.00 0.27 -0.51 -1.46 0.00 0.00 175.22 173.50 2w3r s LEU 182 N 1.12 4.09 0.66 6.12 1.02 -1.26 -1.85 118.68 128.57 2w3r s LEU 182 Ca 0.41 -3.00 -0.17 0.00 0.02 0.00 0.00 54.13 51.39 2w3r s LEU 182 Cb -0.18 -1.55 -0.00 0.00 0.02 0.00 0.00 46.19 44.48 2w3r s LEU 182 CO 0.19 -0.23 1.24 -2.16 0.02 0.00 0.00 176.35 175.41 2w3r s PRO 183 N -0.25 2.53 -0.21 1.29 0.04 -1.26 -4.97 135.00 132.16 2w3r s PRO 183 Ca 0.17 1.89 0.03 0.00 0.04 0.00 0.00 61.00 63.14 2w3r s PRO 183 Cb -0.25 -1.86 -0.20 0.00 0.04 0.00 0.00 34.50 32.23 2w3r s PRO 183 CO -0.01 -1.57 -0.02 0.39 0.04 0.00 0.00 177.00 175.83 2w3r n GLU 184 N -2.10 0.68 -4.25 4.56 -0.58 -1.26 -4.33 120.64 113.36 2w3r n GLU 184 Ca 0.14 0.16 -0.14 0.00 -0.42 0.00 0.00 57.16 56.90 2w3r n GLU 184 Cb 0.49 -1.57 -0.10 0.00 -0.57 0.00 0.00 31.44 29.69 2w3r n GLU 184 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2w3r s THR 185 N -2.53 0.71 0.52 2.62 -4.23 -1.26 -4.11 115.64 107.36 2w3r s THR 185 Ca -0.27 -1.99 0.40 0.00 -1.18 0.00 0.00 61.69 58.65 2w3r s THR 185 Cb 0.08 -2.14 0.40 0.00 1.34 0.00 0.00 72.50 72.18 2w3r s THR 185 CO 0.68 -0.46 2.23 0.28 -0.54 0.00 0.00 174.62 176.81 2w3r h SER 186 N 2.68 0.00 0.14 3.99 0.02 -1.94 -2.18 113.55 116.25 2w3r h SER 186 Ca -0.37 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.58 2w3r h SER 186 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2w3r h SER 186 CO 0.63 0.00 -0.07 0.44 -1.14 0.00 0.00 176.83 176.69 2w3r h ASP 187 N 0.00 -0.16 -0.70 3.07 5.19 -1.96 -1.29 116.42 120.57 2w3r h ASP 187 Ca 0.00 -0.37 0.14 0.00 -0.62 0.00 0.00 57.03 56.18 2w3r h ASP 187 Cb 0.04 0.04 -0.04 0.00 0.18 0.00 0.00 39.33 39.54 2w3r h ASP 187 CO 0.00 0.42 0.47 0.00 -3.12 0.00 0.00 179.24 177.01 2w3r h ALA 188 N -0.35 2.14 0.08 3.45 0.00 -1.82 -2.22 119.26 120.53 2w3r h ALA 188 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2w3r h ALA 188 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2w3r h ALA 188 CO 0.03 -0.33 -0.04 1.25 0.00 0.00 0.00 179.25 180.17 2w3r h LEU 189 N 0.36 -0.09 -1.29 0.00 5.85 -1.49 -3.01 115.31 115.64 2w3r h LEU 189 Ca 0.34 -0.50 0.13 0.00 0.84 0.00 0.00 57.88 58.68 2w3r h LEU 189 Cb 0.81 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.79 2w3r h LEU 189 CO -0.09 0.58 0.56 0.00 -0.34 0.00 0.00 178.44 179.15 2w3r h ALA 190 N -0.25 1.79 0.39 1.25 0.00 -0.91 0.22 119.26 121.75 2w3r h ALA 190 Ca -0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2w3r h ALA 190 Cb 0.59 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 190 CO 0.02 -0.01 -0.19 -0.44 0.00 0.00 0.00 179.25 178.63 2w3r h ASP 191 N 0.72 -0.44 -0.51 0.00 5.19 -1.54 -2.42 116.42 117.43 2w3r h ASP 191 Ca 0.43 -0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.71 2w3r h ASP 191 Cb 0.62 0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.22 2w3r h ASP 191 CO -0.19 -0.10 0.31 -0.25 -3.12 0.00 0.00 179.24 175.89 2w3r h TRP 192 N -0.82 0.66 0.00 4.55 7.01 -1.13 -2.35 115.95 123.87 2w3r h TRP 192 Ca -0.05 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.95 2w3r h TRP 192 Cb 0.54 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.38 2w3r h TRP 192 CO 0.01 0.45 0.00 -0.92 -2.79 0.00 0.00 178.44 175.19 2w3r h TYR 193 N 0.68 0.00 -0.12 2.65 3.20 -0.73 -0.84 116.97 121.81 2w3r h TYR 193 Ca 0.18 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.91 2w3r h TYR 193 Cb -0.03 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 2w3r h TYR 193 CO -0.03 0.00 -0.53 1.25 -1.64 0.00 0.00 178.16 177.21 2w3r h LEU 194 N 0.00 0.37 0.03 2.82 5.85 -0.94 -3.27 115.31 120.16 2w3r h LEU 194 Ca 0.00 -0.19 -0.23 0.00 0.84 0.00 0.00 57.88 58.30 2w3r h LEU 194 Cb 0.73 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2w3r h LEU 194 CO 0.00 0.83 -1.12 0.00 -0.34 0.00 0.00 178.44 177.82 2w3r h ALA 195 N 1.18 0.33 -2.94 1.25 0.00 -0.88 -3.40 119.26 114.80 2w3r h ALA 195 Ca 0.01 -0.95 -0.61 0.00 0.00 0.00 0.00 54.91 53.35 2w3r h ALA 195 Cb 1.02 -0.06 -0.41 0.00 0.00 0.00 0.00 17.79 18.34 2w3r h ALA 195 CO 0.09 1.22 -0.64 0.72 0.00 0.00 0.00 179.25 180.64 2w3r n HIS 196 N -3.36 2.63 0.28 0.00 8.25 -0.39 -4.95 115.22 117.68 2w3r n HIS 196 Ca -0.03 -4.16 0.17 0.00 -0.26 0.00 0.00 57.72 53.44 2w3r n HIS 196 Cb 0.97 -0.49 0.73 0.00 1.12 0.00 0.00 29.99 32.32 2w3r n HIS 196 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2w3r h PRO 197 N 5.36 0.00 -0.64 -0.41 0.13 -1.79 -2.62 132.00 132.03 2w3r h PRO 197 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2w3r h PRO 197 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2w3r h PRO 197 CO 0.67 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.62 2w3r n GLU 198 N -3.15 2.60 -2.48 0.86 0.00 -1.26 -4.51 120.64 112.70 2w3r n GLU 198 Ca -0.00 -1.52 -0.41 0.00 0.00 0.00 0.00 57.16 55.23 2w3r n GLU 198 Cb 0.29 -1.68 -0.04 0.00 0.00 0.00 0.00 31.44 30.00 2w3r n GLU 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2w3r s ALA 199 N -1.76 3.40 -0.95 -1.84 0.00 -0.99 -4.89 121.76 114.73 2w3r s ALA 199 Ca 0.27 0.87 -0.24 0.00 0.00 0.00 0.00 51.96 52.86 2w3r s ALA 199 Cb 0.18 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 20.00 2w3r s ALA 199 CO 0.11 -0.20 1.40 0.99 0.00 0.00 0.00 175.76 178.07 2w3r s THR 200 N -0.70 3.87 0.13 0.00 2.01 0.19 -4.99 115.64 116.15 2w3r s THR 200 Ca 0.47 -0.45 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 2w3r s THR 200 Cb -0.31 -5.02 -0.07 0.00 0.01 0.00 0.00 72.50 67.11 2w3r s THR 200 CO 0.38 -1.92 1.17 -0.76 -0.69 0.00 0.00 174.62 172.80 2w3r s LEU 201 N 5.18 4.43 -0.13 4.42 1.43 -1.26 -2.21 118.68 130.54 2w3r s LEU 201 Ca 0.43 2.10 -0.01 0.00 -1.03 0.00 0.00 54.13 55.62 2w3r s LEU 201 Cb -0.02 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.64 2w3r s LEU 201 CO -0.03 -0.37 -0.05 -0.63 0.23 0.00 0.00 176.35 175.50 2w3r s ILE 202 N 0.35 0.93 0.00 -0.59 1.01 0.83 -4.94 121.20 118.80 2w3r s ILE 202 Ca 0.54 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.83 2w3r s ILE 202 Cb -0.30 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.12 2w3r s ILE 202 CO 0.33 0.24 0.00 0.00 0.00 0.00 0.00 174.94 175.51 2w3r n ALA 203 N 4.96 0.00 0.12 9.38 0.00 -1.26 -0.21 120.51 133.49 2w3r n ALA 203 Ca -0.11 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.34 2w3r n ALA 203 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.94 2w3r n ALA 203 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2w3r h GLY 204 N 0.00 0.00 -2.28 0.00 0.00 -1.94 -3.38 103.07 95.47 2w3r h GLY 204 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 2w3r h GLY 204 CO 0.00 0.00 -0.36 0.61 0.00 0.00 0.00 176.54 176.79 2w3r n GLY 205 N 1.25 -0.14 0.72 4.60 0.00 -1.26 -4.79 105.19 105.58 2w3r n GLY 205 Ca 0.01 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 45.85 2w3r n GLY 205 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2w3r n THR 206 N -4.03 0.29 0.00 2.61 -2.24 -1.26 -3.18 114.28 106.47 2w3r n THR 206 Ca -0.13 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2w3r n THR 206 Cb 0.60 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 2w3r n THR 206 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2w3r n ASP 207 N 0.66 3.59 -0.12 3.42 8.00 -1.26 -4.79 116.55 126.05 2w3r n ASP 207 Ca 0.17 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.55 2w3r n ASP 207 Cb 0.41 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 2w3r n ASP 207 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2w3r h VAL 208 N 0.00 1.28 0.00 2.53 2.07 -1.97 -3.14 116.25 117.03 2w3r h VAL 208 Ca 0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2w3r h VAL 208 Cb 0.81 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 2w3r h VAL 208 CO 0.00 0.41 0.00 0.77 0.02 0.00 0.00 177.57 178.77 2w3r h SER 209 N 0.49 0.00 1.19 0.57 4.64 -1.86 -0.94 113.55 117.64 2w3r h SER 209 Ca 0.08 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2w3r h SER 209 Cb 0.67 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 2w3r h SER 209 CO 0.05 0.00 -0.18 -0.07 -0.87 0.00 0.00 176.83 175.75 2w3r h LEU 210 N 0.00 0.00 -0.28 5.97 3.38 -1.83 -1.63 115.31 120.92 2w3r h LEU 210 Ca 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 2w3r h LEU 210 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2w3r h LEU 210 CO 0.00 0.18 -0.74 -0.50 0.09 0.00 0.00 178.44 177.47 2w3r h TRP 211 N 0.00 0.85 0.04 1.13 6.55 -1.27 -1.91 115.95 121.34 2w3r h TRP 211 Ca -0.00 -0.37 -0.24 0.00 0.95 0.00 0.00 58.89 59.23 2w3r h TRP 211 Cb 0.82 -0.13 0.00 0.00 -0.86 0.00 0.00 29.16 28.99 2w3r h TRP 211 CO 0.00 1.16 -1.04 -0.24 -1.05 0.00 0.00 178.44 177.27 2w3r h VAL 212 N 0.44 1.42 0.07 1.49 3.04 -1.48 0.26 116.25 121.48 2w3r h VAL 212 Ca -0.04 -2.61 -0.31 0.00 -1.01 0.00 0.00 66.70 62.73 2w3r h VAL 212 Cb 1.34 2.58 -0.02 0.00 -2.01 0.00 0.00 31.29 33.17 2w3r h VAL 212 CO 0.14 0.78 -1.68 0.35 -1.01 0.00 0.00 177.57 176.14 2w3r n THR 213 N -3.69 1.68 -0.12 3.17 -2.24 -0.63 -3.63 114.28 108.82 2w3r n THR 213 Ca -0.08 -0.39 -0.25 0.00 -2.27 0.00 0.00 64.05 61.07 2w3r n THR 213 Cb 0.89 -1.87 -0.11 0.00 -2.10 0.00 0.00 70.33 67.14 2w3r n THR 213 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2w3r n LYS 214 N -3.90 0.62 0.00 -0.78 4.76 -0.75 -4.17 118.16 113.93 2w3r n LYS 214 Ca -0.32 0.26 0.13 0.00 -2.87 0.00 0.00 58.31 55.51 2w3r n LYS 214 Cb 0.89 -1.54 0.69 0.00 -1.84 0.00 0.00 35.03 33.24 2w3r n LYS 214 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2w3r n ALA 215 N -3.79 2.36 -3.52 7.82 0.00 -1.01 -4.91 120.51 117.45 2w3r n ALA 215 Ca -0.49 -0.13 -0.25 0.00 0.00 0.00 0.00 53.44 52.57 2w3r n ALA 215 Cb 0.91 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.92 2w3r n ALA 215 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2w3r n LEU 216 N -1.22 -1.41 -4.86 0.00 4.77 -0.77 -4.93 117.00 108.57 2w3r n LEU 216 Ca 0.14 -0.49 -0.32 0.00 -0.03 0.00 0.00 56.01 55.31 2w3r n LEU 216 Cb 0.18 -2.00 -0.06 0.00 -2.33 0.00 0.00 43.42 39.21 2w3r n LEU 216 CO 0.19 0.16 0.32 -0.13 -1.33 0.00 0.00 177.39 176.60 2w3r s ARG 217 N -6.17 3.91 -0.11 3.23 0.52 0.84 -4.96 118.95 116.21 2w3r s ARG 217 Ca 0.46 0.49 -0.02 0.00 -0.52 0.00 0.00 55.73 56.13 2w3r s ARG 217 Cb -0.25 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.64 2w3r s ARG 217 CO 0.56 0.25 -0.02 0.34 0.02 0.00 0.00 175.30 176.44 2w3r s ASP 218 N -2.28 4.97 -0.08 0.23 -1.08 -1.26 -4.23 116.67 112.94 2w3r s ASP 218 Ca 0.50 0.01 0.05 0.00 -0.52 0.00 0.00 52.55 52.59 2w3r s ASP 218 Cb -0.11 -1.54 -0.00 0.00 -1.46 0.00 0.00 42.92 39.80 2w3r s ASP 218 CO 0.19 0.29 -0.24 -0.76 0.52 0.00 0.00 175.17 175.17 2w3r s LEU 219 N -0.36 2.06 0.47 -1.34 1.43 -1.26 -5.13 118.68 114.55 2w3r s LEU 219 Ca 0.06 -0.52 0.08 0.00 -1.03 0.00 0.00 54.13 52.72 2w3r s LEU 219 Cb -0.12 -1.36 0.02 0.00 0.03 0.00 0.00 46.19 44.76 2w3r s LEU 219 CO 0.02 0.19 0.56 -2.16 0.23 0.00 0.00 176.35 175.19 2w3r s PRO 220 N 0.11 2.56 -0.58 1.29 0.04 -1.26 -4.89 135.00 132.27 2w3r s PRO 220 Ca -0.11 -1.50 -0.19 0.00 0.04 0.00 0.00 61.00 59.24 2w3r s PRO 220 Cb -0.16 -2.56 0.03 0.00 0.04 0.00 0.00 34.50 31.85 2w3r s PRO 220 CO 0.06 -0.43 0.64 -1.91 0.04 0.00 0.00 177.00 175.40 2w3r n GLU 221 N -1.86 -1.86 -4.80 4.56 4.07 -1.26 -4.04 120.64 115.46 2w3r n GLU 221 Ca 0.08 1.45 -0.33 0.00 -0.06 0.00 0.00 57.16 58.30 2w3r n GLU 221 Cb 0.61 -3.53 -0.13 0.00 -0.06 0.00 0.00 31.44 28.33 2w3r n GLU 221 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2w3r s VAL 222 N -2.33 3.19 -0.05 6.31 1.01 -1.26 0.57 120.40 127.85 2w3r s VAL 222 Ca 0.21 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.54 2w3r s VAL 222 Cb -0.03 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 34.08 2w3r s VAL 222 CO 0.84 0.57 -0.04 0.00 0.00 0.00 0.00 175.10 176.46 2w3r s ALA 223 N -0.37 0.69 -0.29 5.51 0.00 -0.94 -1.04 121.76 125.32 2w3r s ALA 223 Ca 0.04 -0.07 -0.12 0.00 0.00 0.00 0.00 51.96 51.81 2w3r s ALA 223 Cb -0.12 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 2w3r s ALA 223 CO 0.02 -0.05 0.22 -0.06 0.00 0.00 0.00 175.76 175.89 2w3r s PHE 224 N 0.99 3.22 -0.58 0.00 0.40 -0.77 -0.12 117.98 121.12 2w3r s PHE 224 Ca -0.10 0.10 0.24 0.00 -0.60 0.00 0.00 56.93 56.57 2w3r s PHE 224 Cb -0.14 -2.42 0.32 0.00 0.51 0.00 0.00 43.02 41.29 2w3r s PHE 224 CO -0.00 -0.20 1.31 -0.07 0.70 0.00 0.00 175.22 176.96 2w3r h LEU 225 N 8.42 0.00 0.00 -0.37 3.38 -0.85 -3.36 115.31 122.53 2w3r h LEU 225 Ca -0.34 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2w3r h LEU 225 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2w3r h LEU 225 CO 0.57 0.08 0.00 -1.54 0.09 0.00 0.00 178.44 177.65 2w3r n SER 226 N -2.24 0.00 -2.21 -0.43 3.41 -1.26 -2.31 113.62 108.58 2w3r n SER 226 Ca 0.03 0.26 -0.30 0.00 -0.26 0.00 0.00 58.87 58.60 2w3r n SER 226 Cb 0.46 -0.31 0.05 0.00 -0.26 0.00 0.00 64.21 64.16 2w3r n SER 226 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2w3r n HIS 227 N -1.31 3.04 -3.78 7.33 8.25 -1.26 -4.90 115.22 122.59 2w3r n HIS 227 Ca 0.02 -2.70 -0.30 0.00 -0.26 0.00 0.00 57.72 54.48 2w3r n HIS 227 Cb 0.03 -0.99 -0.14 0.00 1.12 0.00 0.00 29.99 30.01 2w3r n HIS 227 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2w3r h LYS 229 N 7.63 1.02 0.00 0.00 1.57 -1.91 -2.47 116.57 122.42 2w3r h LYS 229 Ca -0.09 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 2w3r h LYS 229 Cb 0.99 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 2w3r h LYS 229 CO 0.49 0.68 -0.13 0.38 -0.57 0.00 0.00 179.45 180.29 2w3r h ASP 230 N 1.05 0.00 0.82 0.86 -0.00 -1.95 -3.09 116.42 114.11 2w3r h ASP 230 Ca 0.30 0.00 -0.24 0.00 -0.00 0.00 0.00 57.03 57.09 2w3r h ASP 230 Cb -0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 39.21 2w3r h ASP 230 CO -0.07 0.13 -1.26 0.25 -0.00 0.00 0.00 179.24 178.29 2w3r h LEU 231 N 0.00 0.00 -7.38 0.15 6.46 -1.82 -3.39 115.31 109.33 2w3r h LEU 231 Ca -0.00 0.00 -0.79 0.00 -0.12 0.00 0.00 57.88 56.96 2w3r h LEU 231 Cb 0.76 0.00 -0.26 0.00 -0.73 0.00 0.00 40.66 40.42 2w3r h LEU 231 CO 0.02 1.00 0.69 0.00 -0.62 0.00 0.00 178.44 179.53 2w3r n ALA 232 N -2.42 4.47 -3.56 1.25 0.00 -1.08 -2.37 120.51 116.79 2w3r n ALA 232 Ca -0.06 -4.64 -0.23 0.00 0.00 0.00 0.00 53.44 48.50 2w3r n ALA 232 Cb 0.98 -2.52 -0.17 0.00 0.00 0.00 0.00 19.45 17.75 2w3r n ALA 232 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2w3r s GLN 233 N -1.29 1.39 -0.41 0.00 -1.52 -1.26 -4.76 119.66 111.80 2w3r s GLN 233 Ca 0.33 -0.29 -0.11 0.00 -1.95 0.00 0.00 55.36 53.34 2w3r s GLN 233 Cb -0.05 -1.24 0.06 0.00 -0.22 0.00 0.00 33.01 31.56 2w3r s GLN 233 CO -0.02 -0.04 0.25 0.42 -0.25 0.00 0.00 175.29 175.64 2w3r s ILE 234 N 0.87 4.49 0.09 1.08 1.01 -1.26 0.07 121.20 127.55 2w3r s ILE 234 Ca -0.11 -1.13 0.06 0.00 0.00 0.00 0.00 60.65 59.46 2w3r s ILE 234 Cb -0.15 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.65 2w3r s ILE 234 CO 0.01 -0.40 -0.15 -0.13 0.00 0.00 0.00 174.94 174.28 2w3r s ARG 235 N 1.50 0.91 0.08 2.79 0.52 0.49 -5.00 118.95 120.23 2w3r s ARG 235 Ca 0.02 -1.06 -0.16 0.00 -0.52 0.00 0.00 55.73 54.02 2w3r s ARG 235 Cb -0.21 -0.91 -0.06 0.00 0.52 0.00 0.00 34.95 34.28 2w3r s ARG 235 CO 0.05 0.19 0.51 -2.00 0.02 0.00 0.00 175.30 174.07 2w3r s GLU 236 N -2.02 4.04 0.02 3.54 2.12 -1.26 0.15 118.70 125.29 2w3r s GLU 236 Ca 0.02 0.56 -0.00 0.00 0.36 0.00 0.00 54.97 55.91 2w3r s GLU 236 Cb -0.09 -3.13 -0.02 0.00 0.26 0.00 0.00 34.13 31.15 2w3r s GLU 236 CO 0.03 0.60 -0.02 -0.08 -0.54 0.00 0.00 175.26 175.25 2w3r s THR 237 N -1.22 0.11 0.43 -1.70 -1.32 -0.48 -4.87 115.64 106.60 2w3r s THR 237 Ca 0.30 -0.88 0.19 0.00 -1.21 0.00 0.00 61.69 60.10 2w3r s THR 237 Cb -0.17 -0.26 0.40 0.00 -1.51 0.00 0.00 72.50 70.95 2w3r s THR 237 CO 0.18 -0.48 1.84 1.55 -2.21 0.00 0.00 174.62 175.50 2w3r h PRO 238 N 4.68 0.35 -0.07 7.08 0.13 -2.02 -1.56 132.00 140.59 2w3r h PRO 238 Ca -0.32 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.68 2w3r h PRO 238 Cb 1.21 -0.08 0.01 0.00 0.13 0.00 0.00 31.00 32.27 2w3r h PRO 238 CO 0.41 0.23 -0.38 0.38 -0.23 0.00 0.00 178.00 178.41 2w3r h ASP 239 N 0.36 0.45 0.00 1.44 2.03 -1.97 -3.49 116.42 115.24 2w3r h ASP 239 Ca 0.49 -0.66 0.00 0.00 -0.73 0.00 0.00 57.03 56.13 2w3r h ASP 239 Cb 1.30 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 39.66 2w3r h ASP 239 CO -0.17 1.04 0.00 0.61 -1.03 0.00 0.00 179.24 179.69 2w3r n GLY 240 N 0.74 1.70 3.20 7.15 0.00 -0.59 -3.89 105.19 113.50 2w3r n GLY 240 Ca -0.08 0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2w3r n GLY 240 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2w3r s TYR 241 N 1.03 2.85 -0.58 1.61 1.51 -0.19 -1.38 117.35 122.21 2w3r s TYR 241 Ca 0.00 -1.34 -0.27 0.00 -1.01 0.00 0.00 57.07 54.45 2w3r s TYR 241 Cb 0.00 -1.99 0.03 0.00 -0.11 0.00 0.00 41.96 39.89 2w3r s TYR 241 CO 0.00 -0.69 1.12 0.20 -1.11 0.00 0.00 175.55 175.07 2w3r s GLY 242 N 1.35 1.21 -0.26 0.71 0.00 0.12 -2.33 107.32 108.12 2w3r s GLY 242 Ca 0.05 -0.98 -0.04 0.00 0.00 0.00 0.00 44.72 43.75 2w3r s GLY 242 CO -0.09 2.37 0.00 -0.42 0.00 0.00 0.00 173.10 174.97 2w3r s ILE 243 N 4.68 3.40 0.81 0.90 1.01 0.46 -0.38 121.20 132.08 2w3r s ILE 243 Ca 0.39 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 2w3r s ILE 243 Cb -0.09 -2.72 0.08 0.00 0.01 0.00 0.00 42.46 39.74 2w3r s ILE 243 CO 0.23 0.18 1.10 -0.83 0.00 0.00 0.00 174.94 175.62 2w3r s GLY 244 N 1.42 1.67 0.42 6.18 0.00 0.11 0.16 107.32 117.27 2w3r s GLY 244 Ca 0.02 0.25 0.21 0.00 0.00 0.00 0.00 44.72 45.19 2w3r s GLY 244 CO -0.01 0.63 1.84 0.00 0.00 0.00 0.00 173.10 175.55 2w3r h ALA 245 N -1.29 1.11 -0.00 3.20 0.00 -0.55 -2.97 119.26 118.76 2w3r h ALA 245 Ca -0.45 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2w3r h ALA 245 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2w3r h ALA 245 CO 0.51 0.37 -0.03 0.41 0.00 0.00 0.00 179.25 180.51 2w3r n GLY 246 N -0.07 -0.85 3.70 0.00 0.00 -1.00 -1.32 105.19 105.64 2w3r n GLY 246 Ca -0.01 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 2w3r n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w3r s VAL 247 N -2.19 3.51 0.50 1.61 1.01 -1.12 -4.63 120.40 119.09 2w3r s VAL 247 Ca 0.39 1.01 -0.19 0.00 0.00 0.00 0.00 61.98 63.19 2w3r s VAL 247 Cb 0.21 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.87 2w3r s VAL 247 CO 0.40 0.04 1.03 0.42 0.00 0.00 0.00 175.10 176.99 2w3r s THR 248 N 1.79 3.89 0.23 3.92 -4.23 -1.26 -2.59 115.64 117.39 2w3r s THR 248 Ca 0.65 1.11 -0.06 0.00 -1.18 0.00 0.00 61.69 62.20 2w3r s THR 248 Cb -0.34 -3.47 0.19 0.00 1.34 0.00 0.00 72.50 70.22 2w3r s THR 248 CO 0.29 -0.32 1.81 0.40 -0.54 0.00 0.00 174.62 176.26 2w3r h ILE 249 N 1.36 0.93 -0.40 2.99 1.08 -0.72 0.11 117.51 122.86 2w3r h ILE 249 Ca -0.49 -0.26 0.07 0.00 -0.39 0.00 0.00 64.86 63.79 2w3r h ILE 249 Cb 1.21 0.10 -0.06 0.00 -3.07 0.00 0.00 36.82 35.01 2w3r h ILE 249 CO 0.59 0.14 0.05 0.00 -0.69 0.00 0.00 178.15 178.24 2w3r h ALA 250 N 1.42 0.41 -0.61 1.87 0.00 -1.51 0.20 119.26 121.04 2w3r h ALA 250 Ca 0.36 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.27 2w3r h ALA 250 Cb 0.29 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2w3r h ALA 250 CO -0.22 -0.35 0.01 0.00 0.00 0.00 0.00 179.25 178.69 2w3r h ALA 251 N 1.32 0.82 -0.43 0.00 0.00 -1.54 0.59 119.26 120.02 2w3r h ALA 251 Ca 0.20 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2w3r h ALA 251 Cb 0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2w3r h ALA 251 CO -0.28 0.65 -0.09 1.25 0.00 0.00 0.00 179.25 180.78 2w3r h LEU 252 N 0.97 0.74 -0.36 0.00 5.85 -0.41 0.14 115.31 122.24 2w3r h LEU 252 Ca 0.17 -0.21 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 2w3r h LEU 252 Cb 0.55 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2w3r h LEU 252 CO 0.03 0.86 -0.12 -0.09 -0.34 0.00 0.00 178.44 178.78 2w3r h ARG 253 N 0.69 0.71 -0.50 1.25 2.43 -0.43 0.21 114.38 118.74 2w3r h ARG 253 Ca 0.12 -0.29 0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2w3r h ARG 253 Cb 0.55 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2w3r h ARG 253 CO 0.03 0.88 0.32 0.00 -1.51 0.00 0.00 179.97 179.70 2w3r h ALA 254 N 0.81 0.63 -0.33 2.80 0.00 -0.55 -1.47 119.26 121.16 2w3r h ALA 254 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 254 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2w3r h ALA 254 CO 0.04 0.06 -0.28 0.35 0.00 0.00 0.00 179.25 179.42 2w3r h PHE 255 N 0.66 0.78 0.00 0.00 3.57 -0.71 -3.01 116.94 118.23 2w3r h PHE 255 Ca 0.19 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2w3r h PHE 255 Cb -0.06 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.50 2w3r h PHE 255 CO -0.05 0.89 -0.04 0.00 -2.23 0.00 0.00 178.31 176.88 2w3r h ALA 256 N 1.10 1.04 -1.04 2.41 0.00 -0.44 -3.25 119.26 119.07 2w3r h ALA 256 Ca 0.07 -0.03 0.33 0.00 0.00 0.00 0.00 54.91 55.28 2w3r h ALA 256 Cb 0.78 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.42 2w3r h ALA 256 CO 0.06 0.05 0.61 1.49 0.00 0.00 0.00 179.25 181.46 2w3r h GLU 257 N 0.00 0.28 0.00 0.00 4.57 -1.14 -1.67 114.58 116.62 2w3r h GLU 257 Ca -0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2w3r h GLU 257 Cb 0.41 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 2w3r h GLU 257 CO 0.00 0.19 0.00 0.41 -1.18 0.00 0.00 179.01 178.43 2w3r n GLY 258 N -1.33 -0.10 0.23 1.92 0.00 -1.23 -4.50 105.19 100.19 2w3r n GLY 258 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2w3r n GLY 258 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2w3r h PRO 259 N 0.00 0.32 -2.52 1.61 0.11 -1.72 -3.37 132.00 126.43 2w3r h PRO 259 Ca 0.00 -0.10 -0.60 0.00 0.11 0.00 0.00 66.00 65.42 2w3r h PRO 259 Cb 0.00 -0.03 -0.39 0.00 0.11 0.00 0.00 31.00 30.68 2w3r h PRO 259 CO 0.00 0.51 -0.86 0.72 -0.21 0.00 0.00 178.00 178.16 2w3r n HIS 260 N -4.19 0.45 -0.27 0.65 8.25 -0.63 -4.57 115.22 114.90 2w3r n HIS 260 Ca -0.00 -3.64 0.04 0.00 -0.26 0.00 0.00 57.72 53.86 2w3r n HIS 260 Cb 0.33 -0.06 0.27 0.00 1.12 0.00 0.00 29.99 31.65 2w3r n HIS 260 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2w3r h PRO 261 N 5.36 0.94 0.01 -0.41 0.11 -1.71 -2.21 132.00 134.08 2w3r h PRO 261 Ca 0.22 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.29 2w3r h PRO 261 Cb 0.85 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.73 2w3r h PRO 261 CO 0.49 0.62 -0.11 0.00 -0.21 0.00 0.00 178.00 178.79 2w3r h ALA 262 N 1.53 -0.13 -0.88 -0.75 0.00 -1.88 0.22 119.26 117.37 2w3r h ALA 262 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2w3r h ALA 262 Cb 0.21 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2w3r h ALA 262 CO -0.13 -0.61 0.55 1.25 0.00 0.00 0.00 179.25 180.31 2w3r h LEU 263 N -0.20 1.04 -0.69 0.00 5.85 -1.80 -0.39 115.31 119.13 2w3r h LEU 263 Ca 0.04 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2w3r h LEU 263 Cb 0.24 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2w3r h LEU 263 CO -0.11 0.78 0.33 0.00 -0.34 0.00 0.00 178.44 179.11 2w3r h ALA 264 N 1.30 0.89 0.00 1.25 0.00 -1.01 -0.16 119.26 121.54 2w3r h ALA 264 Ca 0.32 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2w3r h ALA 264 Cb -0.09 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.43 2w3r h ALA 264 CO -0.06 0.46 -0.00 0.78 0.00 0.00 0.00 179.25 180.42 2w3r h GLY 265 N 0.96 -0.00 0.74 0.00 0.00 0.06 -2.97 103.07 101.86 2w3r h GLY 265 Ca 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 2w3r h GLY 265 CO -0.03 -0.00 -0.49 -2.00 0.00 0.00 0.00 176.54 174.02 2w3r h LEU 266 N -0.08 -1.28 -0.18 3.11 5.85 -0.97 -3.07 115.31 118.69 2w3r h LEU 266 Ca -0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2w3r h LEU 266 Cb 0.08 0.39 0.00 0.00 0.37 0.00 0.00 40.66 41.50 2w3r h LEU 266 CO 0.00 -0.73 0.05 0.18 -0.34 0.00 0.00 178.44 177.60 2w3r n LEU 267 N -5.61 0.07 -0.12 2.25 4.77 -0.08 -0.41 117.00 117.87 2w3r n LEU 267 Ca -0.14 0.49 -0.08 0.00 -0.03 0.00 0.00 56.01 56.25 2w3r n LEU 267 Cb 0.49 -0.49 0.09 0.00 -2.33 0.00 0.00 43.42 41.18 2w3r n LEU 267 CO 0.33 -0.51 0.75 -0.09 -1.33 0.00 0.00 177.39 176.54 2w3r h ARG 268 N 0.00 0.84 -0.71 3.23 2.43 -1.41 -2.73 114.38 116.02 2w3r h ARG 268 Ca 0.00 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 58.85 2w3r h ARG 268 Cb 0.10 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2w3r h ARG 268 CO 0.00 0.93 0.02 0.54 -1.51 0.00 0.00 179.97 179.96 2w3r n ARG 269 N -4.14 3.73 -2.97 0.20 1.74 0.45 -4.79 116.66 110.88 2w3r n ARG 269 Ca 0.01 -2.27 -0.43 0.00 -0.77 0.00 0.00 57.85 54.39 2w3r n ARG 269 Cb 0.40 -2.05 -0.05 0.00 -1.02 0.00 0.00 32.46 29.74 2w3r n ARG 269 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2w3r s PHE 270 N -2.28 2.85 0.00 -1.55 5.36 -1.03 -4.70 117.98 116.64 2w3r s PHE 270 Ca 0.39 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.94 2w3r s PHE 270 Cb 0.30 -3.98 0.00 0.00 -0.34 0.00 0.00 43.02 39.00 2w3r s PHE 270 CO 0.11 -1.34 0.00 0.00 -1.46 0.00 0.00 175.22 172.53 2w3r n ALA 271 N 7.04 0.00 -2.37 11.12 0.00 -1.26 -4.69 120.51 130.34 2w3r n ALA 271 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.18 2w3r n ALA 271 Cb 0.46 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.83 2w3r n ALA 271 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2w3r s SER 272 N -4.00 2.14 0.05 0.00 1.04 -1.26 -2.91 113.70 108.76 2w3r s SER 272 Ca 0.00 -1.75 -0.22 0.00 0.48 0.00 0.00 55.95 54.45 2w3r s SER 272 Cb 0.00 0.57 -0.14 0.00 0.10 0.00 0.00 66.02 66.55 2w3r s SER 272 CO 0.00 -1.04 1.49 -0.08 0.98 0.00 0.00 173.24 174.59 2w3r h GLU 273 N 1.98 0.18 0.00 4.02 4.57 -1.84 -0.26 114.58 123.24 2w3r h GLU 273 Ca -0.28 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 57.81 2w3r h GLU 273 Cb 1.25 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2w3r h GLU 273 CO 0.43 0.42 -0.15 1.96 -1.18 0.00 0.00 179.01 180.49 2w3r h GLN 274 N -0.07 0.00 0.04 1.92 7.50 -1.87 -1.08 115.11 121.53 2w3r h GLN 274 Ca 0.03 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.11 2w3r h GLN 274 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.86 2w3r h GLN 274 CO 0.00 0.15 -0.32 0.28 -1.50 0.00 0.00 178.83 177.44 2w3r h VAL 275 N 0.00 1.65 -0.40 -0.54 2.07 -1.85 -3.35 116.25 113.83 2w3r h VAL 275 Ca -0.00 -2.39 0.12 0.00 0.82 0.00 0.00 66.70 65.25 2w3r h VAL 275 Cb 0.28 3.26 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 2w3r h VAL 275 CO 0.02 0.62 0.29 0.03 0.02 0.00 0.00 177.57 178.55 2w3r h ARG 276 N -0.83 0.00 0.00 1.57 3.08 -0.67 0.87 114.38 118.40 2w3r h ARG 276 Ca -0.07 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2w3r h ARG 276 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 2w3r h ARG 276 CO 0.02 0.00 -0.15 1.96 -1.07 0.00 0.00 179.97 180.73 2w3r h GLN 277 N 0.00 0.00 0.00 0.04 1.08 -1.34 -1.38 115.11 113.51 2w3r h GLN 277 Ca 0.19 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.32 2w3r h GLN 277 Cb 0.78 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.19 2w3r h GLN 277 CO -0.00 0.15 -1.26 1.33 -0.95 0.00 0.00 178.83 178.09 2w3r n VAL 278 N -4.18 0.26 -1.79 -0.54 0.24 -0.59 -4.89 118.33 106.85 2w3r n VAL 278 Ca -0.02 -0.14 -0.41 0.00 -2.04 0.00 0.00 64.34 61.72 2w3r n VAL 278 Cb 0.22 -0.82 -0.01 0.00 -1.47 0.00 0.00 33.84 31.76 2w3r n VAL 278 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2w3r s ALA 279 N -2.09 3.73 0.29 2.33 0.00 0.20 -3.90 121.76 122.31 2w3r s ALA 279 Ca -0.04 1.57 0.08 0.00 0.00 0.00 0.00 51.96 53.57 2w3r s ALA 279 Cb 0.01 -3.64 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 2w3r s ALA 279 CO 0.14 -0.99 0.13 0.95 0.00 0.00 0.00 175.76 175.99 2w3r s THR 280 N -0.12 3.58 0.10 0.00 -4.23 -1.26 -0.45 115.64 113.26 2w3r s THR 280 Ca 0.62 -1.65 0.08 0.00 -1.18 0.00 0.00 61.69 59.55 2w3r s THR 280 Cb -0.47 -3.07 -0.20 0.00 1.34 0.00 0.00 72.50 70.10 2w3r s THR 280 CO 0.49 -0.29 1.25 0.40 -0.54 0.00 0.00 174.62 175.94 2w3r h ILE 281 N 1.61 1.65 0.50 2.99 2.04 -1.58 -1.35 117.51 123.36 2w3r h ILE 281 Ca -0.45 -3.35 -0.02 0.00 1.00 0.00 0.00 64.86 62.03 2w3r h ILE 281 Cb 1.25 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 40.14 2w3r h ILE 281 CO 0.61 0.94 -0.25 1.23 0.00 0.00 0.00 178.15 180.68 2w3r h GLY 282 N 3.04 -0.72 0.88 5.37 0.00 -1.48 0.57 103.07 110.73 2w3r h GLY 282 Ca -0.02 0.27 0.08 0.00 0.00 0.00 0.00 47.33 47.66 2w3r h GLY 282 CO 0.13 -0.26 0.52 -1.33 0.00 0.00 0.00 176.54 175.60 2w3r h GLY 283 N -0.69 1.09 0.75 4.60 0.00 -1.74 0.40 103.07 107.47 2w3r h GLY 283 Ca -0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2w3r h GLY 283 CO 0.10 0.21 -0.09 -0.57 0.00 0.00 0.00 176.54 176.19 2w3r h ASN 284 N 0.79 -0.22 -0.45 0.19 -0.00 -0.97 -2.51 115.58 112.43 2w3r h ASN 284 Ca 0.36 -0.19 -0.09 0.00 -0.00 0.00 0.00 56.30 56.38 2w3r h ASN 284 Cb 0.36 0.06 -0.01 0.00 -0.00 0.00 0.00 38.32 38.72 2w3r h ASN 284 CO -0.14 0.07 -0.08 0.40 -0.00 0.00 0.00 177.43 177.68 2w3r h ILE 285 N -0.51 1.27 0.00 2.57 2.04 -0.70 -2.93 117.51 119.25 2w3r h ILE 285 Ca -0.03 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.65 2w3r h ILE 285 Cb 0.39 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2w3r h ILE 285 CO 0.04 0.40 0.00 0.00 0.00 0.00 0.00 178.15 178.60 2w3r n ALA 286 N -2.46 2.03 0.11 1.87 0.00 0.11 -2.00 120.51 120.17 2w3r n ALA 286 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 2w3r n ALA 286 Cb 0.36 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 2w3r n ALA 286 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2w3r h ASN 287 N 0.00 0.00 -4.14 0.00 -1.24 -1.24 -3.48 115.58 105.48 2w3r h ASN 287 Ca 0.00 0.00 -0.39 0.00 0.71 0.00 0.00 56.30 56.62 2w3r h ASN 287 Cb 0.22 0.00 0.05 0.00 0.73 0.00 0.00 38.32 39.32 2w3r h ASN 287 CO 0.00 0.65 -0.58 0.61 -1.29 0.00 0.00 177.43 176.83 2w3r n GLY 288 N 1.28 -0.47 3.73 1.57 0.00 -0.85 -4.98 105.19 105.48 2w3r n GLY 288 Ca 0.00 0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2w3r n GLY 288 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2w3r s SER 289 N -2.66 7.37 0.57 1.61 0.15 -1.26 -4.62 113.70 114.85 2w3r s SER 289 Ca 0.26 1.94 0.36 0.00 0.70 0.00 0.00 55.95 59.21 2w3r s SER 289 Cb -0.12 -2.60 1.58 0.00 -1.71 0.00 0.00 66.02 63.18 2w3r s SER 289 CO 0.32 -0.16 2.06 1.55 1.20 0.00 0.00 173.24 178.22 2w3r h PRO 290 N 5.42 0.00 0.00 5.44 0.13 -1.88 -2.72 132.00 138.39 2w3r h PRO 290 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2w3r h PRO 290 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2w3r h PRO 290 CO 0.73 0.00 -1.01 -0.89 -0.23 0.00 0.00 178.00 176.60 2w3r n ILE 291 N -3.07 0.11 -1.65 -3.56 5.41 -1.26 0.12 119.36 115.47 2w3r n ILE 291 Ca -0.00 -0.19 -0.46 0.00 1.00 0.00 0.00 62.75 63.10 2w3r n ILE 291 Cb 0.26 0.34 -0.03 0.00 -0.71 0.00 0.00 39.64 39.49 2w3r n ILE 291 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2w3r n GLY 292 N 1.40 0.67 0.09 7.39 0.00 -1.03 -4.60 105.19 109.11 2w3r n GLY 292 Ca 0.02 0.55 0.12 0.00 0.00 0.00 0.00 46.02 46.71 2w3r n GLY 292 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2w3r n ASP 293 N 2.39 0.74 0.27 1.61 8.00 -1.26 -4.32 116.55 123.97 2w3r n ASP 293 Ca 0.14 0.18 -0.11 0.00 0.71 0.00 0.00 54.79 55.71 2w3r n ASP 293 Cb 0.29 0.51 -0.05 0.00 -0.02 0.00 0.00 41.12 41.85 2w3r n ASP 293 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2w3r h GLY 294 N 4.20 -0.72 -0.38 0.44 0.00 -1.94 -3.36 103.07 101.31 2w3r h GLY 294 Ca 0.00 0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.63 2w3r h GLY 294 CO 0.00 -0.26 -0.22 -1.05 0.00 0.00 0.00 176.54 175.01 2w3r n PRO 295 N -4.20 -0.17 -0.26 4.80 -0.02 -1.26 -2.62 135.00 131.27 2w3r n PRO 295 Ca -0.09 1.07 0.06 0.00 -2.02 0.00 0.00 63.50 62.53 2w3r n PRO 295 Cb 0.27 -1.59 0.20 0.00 -0.02 0.00 0.00 33.50 32.36 2w3r n PRO 295 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2w3r h PRO 296 N 0.00 0.41 0.77 0.52 0.11 -1.77 0.15 132.00 132.19 2w3r h PRO 296 Ca 0.06 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.11 2w3r h PRO 296 Cb 0.15 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 2w3r h PRO 296 CO -0.35 0.27 -0.48 0.00 -0.21 0.00 0.00 178.00 177.23 2w3r h ALA 297 N 1.57 -1.27 -1.00 -0.75 0.00 -1.65 0.55 119.26 116.71 2w3r h ALA 297 Ca 0.43 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2w3r h ALA 297 Cb 0.67 0.60 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 2w3r h ALA 297 CO -0.42 -1.22 0.65 -0.07 0.00 0.00 0.00 179.25 178.18 2w3r h LEU 298 N -1.18 1.05 -0.64 0.00 3.38 -1.14 -1.48 115.31 115.31 2w3r h LEU 298 Ca -0.10 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2w3r h LEU 298 Cb 0.94 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2w3r h LEU 298 CO 0.10 0.69 0.28 0.40 0.09 0.00 0.00 178.44 180.00 2w3r h ILE 299 N 1.20 1.23 -0.55 1.22 2.04 -0.61 0.73 117.51 122.77 2w3r h ILE 299 Ca 0.42 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2w3r h ILE 299 Cb 0.12 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 2w3r h ILE 299 CO -0.16 0.27 0.29 0.00 0.00 0.00 0.00 178.15 178.56 2w3r h ALA 300 N 1.12 1.50 -0.48 1.87 0.00 0.16 -1.20 119.26 122.22 2w3r h ALA 300 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2w3r h ALA 300 Cb 0.16 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2w3r h ALA 300 CO -0.02 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.65 2w3r n MET 301 N -4.40 2.14 -3.02 0.00 0.00 -0.91 -4.61 117.12 106.33 2w3r n MET 301 Ca 0.05 -1.78 -0.12 0.00 0.00 0.00 0.00 57.70 55.85 2w3r n MET 301 Cb 0.10 -1.39 0.06 0.00 0.00 0.00 0.00 33.22 31.99 2w3r n MET 301 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w3r n GLY 302 N 1.29 -0.13 3.82 3.17 0.00 -0.45 -4.56 105.19 108.32 2w3r n GLY 302 Ca 0.17 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2w3r n GLY 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s ALA 303 N -3.26 3.00 -0.05 4.61 0.00 0.18 -4.68 121.76 121.56 2w3r s ALA 303 Ca 0.01 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.40 2w3r s ALA 303 Cb -0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 2w3r s ALA 303 CO 0.52 -0.04 -0.08 -1.54 0.00 0.00 0.00 175.76 174.62 2w3r s SER 304 N -2.27 4.54 0.09 0.00 1.04 -0.31 -1.79 113.70 115.00 2w3r s SER 304 Ca 0.63 -0.08 -0.00 0.00 0.48 0.00 0.00 55.95 56.98 2w3r s SER 304 Cb -0.11 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 64.87 2w3r s SER 304 CO 0.17 0.34 0.25 -0.22 0.98 0.00 0.00 173.24 174.77 2w3r s LEU 305 N -0.93 4.34 -0.21 2.42 2.96 0.10 -0.53 118.68 126.84 2w3r s LEU 305 Ca 0.13 0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.35 2w3r s LEU 305 Cb -0.11 -3.02 0.05 0.00 0.50 0.00 0.00 46.19 43.62 2w3r s LEU 305 CO 0.03 0.12 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.24 2w3r s THR 306 N -1.58 1.35 0.06 3.68 2.01 0.72 -2.23 115.64 119.64 2w3r s THR 306 Ca 0.36 -0.97 -0.04 0.00 0.31 0.00 0.00 61.69 61.34 2w3r s THR 306 Cb -0.12 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.76 2w3r s THR 306 CO 0.28 -0.01 0.28 -0.76 -0.69 0.00 0.00 174.62 173.72 2w3r s LEU 307 N 1.50 4.34 -0.05 4.42 1.43 -0.76 -1.33 118.68 128.22 2w3r s LEU 307 Ca -0.03 0.49 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 2w3r s LEU 307 Cb -0.17 -2.92 0.01 0.00 0.03 0.00 0.00 46.19 43.14 2w3r s LEU 307 CO -0.07 0.18 -0.10 -0.60 0.23 0.00 0.00 176.35 175.99 2w3r s ARG 308 N -2.19 1.35 -0.65 1.70 3.52 -0.09 -1.48 118.95 121.11 2w3r s ARG 308 Ca 0.33 -0.31 0.05 0.00 -0.13 0.00 0.00 55.73 55.66 2w3r s ARG 308 Cb -0.13 -1.17 0.17 0.00 -1.56 0.00 0.00 34.95 32.26 2w3r s ARG 308 CO 0.21 0.02 0.47 0.50 -0.81 0.00 0.00 175.30 175.68 2w3r s ARG 309 N 0.65 2.17 0.00 5.12 3.00 -0.78 -0.82 118.95 128.28 2w3r s ARG 309 Ca -0.12 -3.11 0.00 0.00 -1.00 0.00 0.00 55.73 51.50 2w3r s ARG 309 Cb -0.14 -3.04 0.00 0.00 0.00 0.00 0.00 34.95 31.77 2w3r s ARG 309 CO 0.02 -1.31 0.00 0.41 0.00 0.00 0.00 175.30 174.43 2w3r n GLY 310 N 2.13 1.38 0.00 8.12 0.00 -1.25 -2.57 105.19 113.01 2w3r n GLY 310 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2w3r n GLY 310 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2w3r n GLN 311 N 0.00 0.97 -1.55 1.61 -0.06 -1.26 -4.59 117.38 112.51 2w3r n GLN 311 Ca 0.00 0.00 -0.38 0.00 -2.00 0.00 0.00 57.00 54.62 2w3r n GLN 311 Cb 0.00 -0.64 0.05 0.00 -4.06 0.00 0.00 30.24 25.59 2w3r n GLN 311 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2w3r n GLU 312 N -1.04 0.70 -3.45 3.69 -0.58 -1.06 -5.02 120.64 113.88 2w3r n GLU 312 Ca 0.00 0.27 -0.22 0.00 -0.42 0.00 0.00 57.16 56.80 2w3r n GLU 312 Cb 0.14 -1.97 -0.11 0.00 -0.57 0.00 0.00 31.44 28.93 2w3r n GLU 312 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2w3r s ARG 313 N -2.51 0.30 0.43 3.49 3.52 -1.26 -1.86 118.95 121.06 2w3r s ARG 313 Ca 0.73 -0.36 -0.09 0.00 -0.13 0.00 0.00 55.73 55.88 2w3r s ARG 313 Cb -0.42 -0.86 -0.06 0.00 -1.56 0.00 0.00 34.95 32.05 2w3r s ARG 313 CO 0.50 -1.04 0.79 1.03 -0.81 0.00 0.00 175.30 175.76 2w3r s ARG 314 N 2.18 3.72 -0.15 5.12 0.52 -0.55 -4.94 118.95 124.85 2w3r s ARG 314 Ca 0.10 0.43 -0.07 0.00 -0.52 0.00 0.00 55.73 55.67 2w3r s ARG 314 Cb -0.15 -2.37 0.06 0.00 0.52 0.00 0.00 34.95 33.01 2w3r s ARG 314 CO -0.32 -0.10 0.33 0.50 0.02 0.00 0.00 175.30 175.73 2w3r s ARG 315 N -4.12 0.27 0.21 3.54 3.52 -1.26 -1.84 118.95 119.27 2w3r s ARG 315 Ca 0.51 0.77 -0.12 0.00 -0.13 0.00 0.00 55.73 56.76 2w3r s ARG 315 Cb -0.10 0.03 -0.00 0.00 -1.56 0.00 0.00 34.95 33.31 2w3r s ARG 315 CO 0.35 -0.21 0.41 0.00 -0.81 0.00 0.00 175.30 175.04 2w3r s MET 316 N 1.91 1.38 0.34 5.12 0.23 -0.95 -5.00 119.30 122.33 2w3r s MET 316 Ca -0.05 -1.16 -0.29 0.00 -1.03 0.00 0.00 55.69 53.16 2w3r s MET 316 Cb -0.11 0.44 -0.11 0.00 -1.53 0.00 0.00 34.83 33.53 2w3r s MET 316 CO -0.11 -0.55 1.51 -2.14 -2.03 0.00 0.00 175.02 171.70 2w3r s PRO 317 N -3.98 4.14 0.29 3.16 0.02 -1.26 0.01 135.00 137.38 2w3r s PRO 317 Ca 0.19 2.54 0.04 0.00 0.02 0.00 0.00 61.00 63.79 2w3r s PRO 317 Cb 0.01 -3.00 0.72 0.00 0.02 0.00 0.00 34.50 32.25 2w3r s PRO 317 CO 0.04 -0.54 1.73 1.25 -0.33 0.00 0.00 177.00 179.15 2w3r h LEU 318 N 3.77 0.50 -2.46 -5.54 5.85 -1.68 -0.11 115.31 115.65 2w3r h LEU 318 Ca -0.49 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 2w3r h LEU 318 Cb 1.23 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2w3r h LEU 318 CO 0.70 0.10 -0.03 1.05 -0.34 0.00 0.00 178.44 179.92 2w3r h GLU 319 N 0.53 0.00 -0.10 1.25 9.09 -1.91 -2.14 114.58 121.31 2w3r h GLU 319 Ca 0.56 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.97 2w3r h GLU 319 Cb 0.99 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.09 2w3r h GLU 319 CO -0.46 0.03 0.00 -0.25 0.05 0.00 0.00 179.01 178.37 2w3r n ASP 320 N -3.47 0.83 -0.03 3.06 8.00 -0.05 -3.26 116.55 121.63 2w3r n ASP 320 Ca -0.02 -1.64 -0.04 0.00 0.71 0.00 0.00 54.79 53.80 2w3r n ASP 320 Cb 0.13 -0.06 -0.13 0.00 -0.02 0.00 0.00 41.12 41.04 2w3r n ASP 320 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2w3r n PHE 321 N -0.20 0.58 -3.13 1.24 7.35 -0.80 -4.78 117.46 117.73 2w3r n PHE 321 Ca 0.13 0.20 -0.44 0.00 -0.76 0.00 0.00 57.45 56.58 2w3r n PHE 321 Cb 0.19 -1.02 -0.05 0.00 0.35 0.00 0.00 39.48 38.94 2w3r n PHE 321 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2w3r s PHE 322 N -2.78 3.01 0.00 -5.13 0.40 -1.20 -0.37 117.98 111.91 2w3r s PHE 322 Ca -0.06 -0.77 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 2w3r s PHE 322 Cb 0.08 -3.81 0.00 0.00 0.51 0.00 0.00 43.02 39.80 2w3r s PHE 322 CO 0.83 -1.19 0.00 1.28 0.70 0.00 0.00 175.22 176.84 2w3r n LEU 323 N 6.29 0.07 -4.38 -0.37 4.77 -1.05 -4.90 117.00 117.42 2w3r n LEU 323 Ca -0.08 0.36 -0.21 0.00 -0.03 0.00 0.00 56.01 56.06 2w3r n LEU 323 Cb 0.44 -0.48 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 2w3r n LEU 323 CO 0.57 -0.48 -0.20 -1.61 -1.33 0.00 0.00 177.39 174.33 2w3r s GLU 324 N -0.97 1.68 0.18 3.23 2.02 -1.13 -4.96 118.70 118.75 2w3r s GLU 324 Ca 0.00 -1.97 -0.32 0.00 0.02 0.00 0.00 54.97 52.70 2w3r s GLU 324 Cb 0.00 -0.27 -0.11 0.00 0.10 0.00 0.00 34.13 33.84 2w3r s GLU 324 CO 0.00 -0.44 1.73 -0.47 0.02 0.00 0.00 175.26 176.11 2w3r s TYR 325 N -3.49 2.73 -1.32 1.61 5.04 -1.21 -1.26 117.35 119.45 2w3r s TYR 325 Ca 0.33 0.28 0.00 0.00 -2.44 0.00 0.00 57.07 55.24 2w3r s TYR 325 Cb 0.05 -4.13 0.00 0.00 0.35 0.00 0.00 41.96 38.23 2w3r s TYR 325 CO 0.17 -4.36 0.00 0.54 -1.34 0.00 0.00 175.55 170.56 2w3r n ARG 326 N 4.41 -0.90 -3.69 4.97 5.12 -1.26 -4.99 116.66 120.32 2w3r n ARG 326 Ca 0.16 0.93 -0.25 0.00 -1.93 0.00 0.00 57.85 56.77 2w3r n ARG 326 Cb 0.36 -4.97 -0.17 0.00 -1.16 0.00 0.00 32.46 26.52 2w3r n ARG 326 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2w3r s LYS 327 N -3.03 0.34 0.12 5.56 2.47 -0.39 -5.14 119.74 119.66 2w3r s LYS 327 Ca 0.00 -0.07 0.10 0.00 -1.56 0.00 0.00 55.97 54.44 2w3r s LYS 327 Cb 0.00 -1.53 -0.04 0.00 -1.46 0.00 0.00 37.83 34.80 2w3r s LYS 327 CO 0.00 -0.53 -0.25 -0.65 0.16 0.00 0.00 175.35 174.09 2w3r s GLN 328 N 2.02 1.55 -1.41 4.03 1.11 -1.26 -2.51 119.66 123.19 2w3r s GLN 328 Ca 0.02 -1.28 -0.15 0.00 0.01 0.00 0.00 55.36 53.97 2w3r s GLN 328 Cb -0.15 -1.97 0.02 0.00 -1.01 0.00 0.00 33.01 29.91 2w3r s GLN 328 CO -0.07 0.47 2.21 -3.47 0.01 0.00 0.00 175.29 174.44 2w3r n ASP 329 N 0.98 3.80 -3.79 5.90 -0.08 0.50 -4.87 116.55 119.01 2w3r n ASP 329 Ca -0.17 -2.82 -0.19 0.00 -1.51 0.00 0.00 54.79 50.10 2w3r n ASP 329 Cb 0.53 -1.61 -0.17 0.00 2.34 0.00 0.00 41.12 42.21 2w3r n ASP 329 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 2w3r s ARG 330 N 3.34 0.30 0.59 -0.67 3.52 -1.26 -4.95 118.95 119.82 2w3r s ARG 330 Ca 0.48 0.13 -0.10 0.00 -0.13 0.00 0.00 55.73 56.11 2w3r s ARG 330 Cb 0.14 -0.58 -0.04 0.00 -1.56 0.00 0.00 34.95 32.91 2w3r s ARG 330 CO -0.07 -0.19 0.98 1.03 -0.81 0.00 0.00 175.30 176.24 2w3r s ARG 331 N 1.36 3.58 0.01 5.12 1.81 -1.26 -4.97 118.95 124.61 2w3r s ARG 331 Ca -0.05 0.64 -0.30 0.00 -1.72 0.00 0.00 55.73 54.30 2w3r s ARG 331 Cb -0.13 -2.14 -0.08 0.00 -0.45 0.00 0.00 34.95 32.15 2w3r s ARG 331 CO -0.02 -0.50 1.85 -2.14 -0.68 0.00 0.00 175.30 173.80 2w3r s PRO 332 N -5.09 4.16 0.00 3.54 0.02 -1.26 -1.88 135.00 134.48 2w3r s PRO 332 Ca 0.53 2.46 0.00 0.00 0.02 0.00 0.00 61.00 64.01 2w3r s PRO 332 Cb -0.11 -4.08 0.00 0.00 0.02 0.00 0.00 34.50 30.34 2w3r s PRO 332 CO 0.52 -0.91 0.00 0.41 -0.33 0.00 0.00 177.00 176.69 2w3r n GLY 333 N 4.38 0.59 3.85 0.52 0.00 -1.26 -4.99 105.19 108.27 2w3r n GLY 333 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2w3r n GLY 333 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2w3r s GLU 334 N -0.81 3.82 0.13 1.61 2.12 -0.79 -4.23 118.70 120.55 2w3r s GLU 334 Ca 0.00 0.29 0.04 0.00 0.36 0.00 0.00 54.97 55.66 2w3r s GLU 334 Cb 0.00 -3.16 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 2w3r s GLU 334 CO 0.00 0.66 -0.09 -0.59 -0.54 0.00 0.00 175.26 174.70 2w3r s PHE 335 N -1.16 1.14 -0.04 5.30 -0.12 -0.00 -4.71 117.98 118.39 2w3r s PHE 335 Ca 0.25 -0.79 -0.30 0.00 -0.05 0.00 0.00 56.93 56.05 2w3r s PHE 335 Cb -0.15 -0.60 -0.03 0.00 -0.63 0.00 0.00 43.02 41.60 2w3r s PHE 335 CO 0.14 0.01 1.16 0.08 -0.05 0.00 0.00 175.22 176.56 2w3r s VAL 336 N -3.31 4.33 -0.11 -2.49 1.01 -1.26 -0.91 120.40 117.66 2w3r s VAL 336 Ca 0.14 1.65 -0.02 0.00 0.00 0.00 0.00 61.98 63.75 2w3r s VAL 336 Cb 0.03 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 32.28 2w3r s VAL 336 CO -0.01 0.03 -0.12 1.21 0.00 0.00 0.00 175.10 176.21 2w3r n GLU 337 N 4.90 0.26 -3.55 2.72 2.13 -0.44 -4.73 120.64 121.92 2w3r n GLU 337 Ca 0.10 0.08 -0.10 0.00 0.66 0.00 0.00 57.16 57.90 2w3r n GLU 337 Cb 0.47 -1.09 -0.04 0.00 0.27 0.00 0.00 31.44 31.05 2w3r n GLU 337 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2w3r s SER 338 N -5.47 -0.39 0.20 4.31 1.04 -1.11 -0.54 113.70 111.75 2w3r s SER 338 Ca -0.15 0.29 0.09 0.00 0.48 0.00 0.00 55.95 56.66 2w3r s SER 338 Cb 0.05 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 2w3r s SER 338 CO 0.23 -0.46 -0.09 0.68 0.98 0.00 0.00 173.24 174.58 2w3r s VAL 339 N -1.81 3.18 -0.08 5.02 -7.23 0.12 -0.20 120.40 119.40 2w3r s VAL 339 Ca -0.00 -1.74 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 2w3r s VAL 339 Cb -0.01 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.36 2w3r s VAL 339 CO -0.01 -0.17 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.64 2w3r s THR 340 N -1.84 0.92 0.21 5.32 2.01 0.31 -0.41 115.64 122.16 2w3r s THR 340 Ca 0.26 -0.29 0.04 0.00 0.31 0.00 0.00 61.69 62.01 2w3r s THR 340 Cb -0.08 -0.91 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 2w3r s THR 340 CO 0.16 0.33 0.32 -0.76 -0.69 0.00 0.00 174.62 173.97 2w3r s LEU 341 N 1.20 4.27 0.76 4.42 1.43 -0.98 -1.17 118.68 128.61 2w3r s LEU 341 Ca -0.05 0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 2w3r s LEU 341 Cb -0.14 -2.83 0.05 0.00 0.03 0.00 0.00 46.19 43.30 2w3r s LEU 341 CO -0.02 -0.02 1.11 -2.16 0.23 0.00 0.00 176.35 175.48 2w3r s PRO 342 N -3.70 2.26 0.24 1.29 0.04 -1.26 -1.02 135.00 132.85 2w3r s PRO 342 Ca 0.34 1.29 -0.07 0.00 0.04 0.00 0.00 61.00 62.61 2w3r s PRO 342 Cb -0.10 -1.89 0.25 0.00 0.04 0.00 0.00 34.50 32.80 2w3r s PRO 342 CO 0.28 -1.65 1.92 0.87 0.04 0.00 0.00 177.00 178.46 2w3r h LYS 343 N -0.87 1.28 -4.42 4.56 1.79 -1.88 -3.42 116.57 113.61 2w3r h LYS 343 Ca -0.44 -0.08 -0.35 0.00 -2.18 0.00 0.00 60.65 57.60 2w3r h LYS 343 Cb 1.24 -0.29 -0.29 0.00 -1.58 0.00 0.00 32.23 31.31 2w3r h LYS 343 CO 0.51 0.85 -0.76 0.45 -1.08 0.00 0.00 179.45 179.42 2w3r s SER 344 N -6.09 0.76 -0.41 0.86 0.15 -1.26 -4.86 113.70 102.86 2w3r s SER 344 Ca -0.13 -0.12 0.09 0.00 0.70 0.00 0.00 55.95 56.49 2w3r s SER 344 Cb 0.18 -0.10 0.30 0.00 -1.71 0.00 0.00 66.02 64.68 2w3r s SER 344 CO 0.81 0.07 0.75 0.00 1.20 0.00 0.00 173.24 176.07 2w3r n ALA 345 N 2.98 1.26 0.16 5.45 0.00 -1.26 -5.01 120.51 124.09 2w3r n ALA 345 Ca -0.14 -2.84 0.05 0.00 0.00 0.00 0.00 53.44 50.52 2w3r n ALA 345 Cb 0.57 -0.98 0.51 0.00 0.00 0.00 0.00 19.45 19.55 2w3r n ALA 345 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2w3r h PRO 346 N 3.44 0.17 0.00 0.00 0.11 -1.96 -2.62 132.00 131.14 2w3r h PRO 346 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2w3r h PRO 346 Cb 0.97 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2w3r h PRO 346 CO 0.41 0.20 0.00 0.78 -0.21 0.00 0.00 178.00 179.18 2w3r h GLY 347 N 0.40 0.00 -4.49 -0.55 0.00 -1.95 -3.46 103.07 93.02 2w3r h GLY 347 Ca 0.04 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.85 2w3r h GLY 347 CO 0.00 0.00 0.83 -2.27 0.00 0.00 0.00 176.54 175.10 2w3r s LEU 348 N -5.34 4.37 0.19 3.11 2.96 -0.99 -4.29 118.68 118.69 2w3r s LEU 348 Ca 0.06 2.60 0.09 0.00 -0.22 0.00 0.00 54.13 56.65 2w3r s LEU 348 Cb 0.09 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.13 2w3r s LEU 348 CO 0.55 -0.77 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.51 2w3r s ARG 349 N 0.67 1.33 -0.15 1.98 1.81 -0.28 -4.69 118.95 119.62 2w3r s ARG 349 Ca 0.66 -1.50 -0.02 0.00 -1.72 0.00 0.00 55.73 53.14 2w3r s ARG 349 Cb -0.42 -1.30 0.05 0.00 -0.45 0.00 0.00 34.95 32.83 2w3r s ARG 349 CO 0.35 0.25 0.03 0.00 -0.68 0.00 0.00 175.30 175.24 2w3r s TYR 351 N 1.92 2.90 -0.14 0.00 4.12 -0.51 -4.77 117.35 120.87 2w3r s TYR 351 Ca 0.02 -1.00 -0.03 0.00 0.02 0.00 0.00 57.07 56.08 2w3r s TYR 351 Cb -0.15 -2.02 -0.03 0.00 -1.52 0.00 0.00 41.96 38.24 2w3r s TYR 351 CO -0.07 -0.52 -0.05 0.21 0.02 0.00 0.00 175.55 175.13 2w3r s LYS 352 N 1.21 3.49 -0.12 -0.62 2.20 -1.26 -1.71 119.74 122.93 2w3r s LYS 352 Ca 0.02 -0.54 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 2w3r s LYS 352 Cb -0.14 -2.83 0.02 0.00 -1.51 0.00 0.00 37.83 33.37 2w3r s LYS 352 CO -0.03 0.31 -0.11 -1.17 -0.36 0.00 0.00 175.35 173.99 2w3r s LEU 353 N 0.15 1.47 0.00 5.43 2.96 -0.55 -5.04 118.68 123.11 2w3r s LEU 353 Ca -0.02 -0.37 -0.05 0.00 -0.22 0.00 0.00 54.13 53.46 2w3r s LEU 353 Cb -0.14 -0.97 0.02 0.00 0.50 0.00 0.00 46.19 45.60 2w3r s LEU 353 CO 0.03 -0.06 0.53 -1.54 -1.32 0.00 0.00 176.35 173.99 2w3r n SER 354 N 4.63 -1.49 -0.09 3.68 3.41 -1.26 0.58 113.62 123.08 2w3r n SER 354 Ca -0.16 -2.62 -0.11 0.00 -0.26 0.00 0.00 58.87 55.71 2w3r n SER 354 Cb 0.50 2.66 -0.04 0.00 -0.26 0.00 0.00 64.21 67.07 2w3r n SER 354 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2w3r h LYS 355 N 0.00 0.46 -6.75 4.33 1.57 -1.88 -3.44 116.57 110.85 2w3r h LYS 355 Ca -0.26 -0.15 -0.69 0.00 -1.87 0.00 0.00 60.65 57.67 2w3r h LYS 355 Cb 1.09 -0.04 -0.26 0.00 0.08 0.00 0.00 32.23 33.10 2w3r h LYS 355 CO 0.35 0.64 -0.88 0.50 -0.57 0.00 0.00 179.45 179.49 2w3r s ARG 356 N -4.94 1.77 0.09 3.15 3.52 -1.26 -5.07 118.95 116.21 2w3r s ARG 356 Ca -0.14 -1.13 -0.19 0.00 -0.13 0.00 0.00 55.73 54.14 2w3r s ARG 356 Cb 0.08 -1.97 -0.08 0.00 -1.56 0.00 0.00 34.95 31.41 2w3r s ARG 356 CO 0.75 0.51 1.59 0.74 -0.81 0.00 0.00 175.30 178.07 2w3r h PHE 357 N 4.69 0.39 -2.79 5.12 -1.00 -1.95 -3.40 116.94 118.00 2w3r h PHE 357 Ca -0.47 -0.05 -0.64 0.00 2.81 0.00 0.00 57.97 59.62 2w3r h PHE 357 Cb 1.14 -0.11 -0.05 0.00 3.61 0.00 0.00 35.95 40.54 2w3r h PHE 357 CO 0.49 0.46 -0.48 -0.51 -1.61 0.00 0.00 178.31 176.67 2w3r s ASP 358 N -5.75 6.38 0.00 2.17 1.11 -1.26 -4.61 116.67 114.71 2w3r s ASP 358 Ca -0.14 0.38 0.00 0.00 0.18 0.00 0.00 52.55 52.98 2w3r s ASP 358 Cb 0.07 -2.02 0.00 0.00 1.07 0.00 0.00 42.92 42.05 2w3r s ASP 358 CO 0.73 0.28 0.00 1.67 1.18 0.00 0.00 175.17 179.03 2w3r n GLN 359 N 1.10 0.00 -1.79 8.23 -0.06 -1.15 -4.94 117.38 118.78 2w3r n GLN 359 Ca -0.12 0.00 -0.38 0.00 -2.00 0.00 0.00 57.00 54.50 2w3r n GLN 359 Cb 0.53 -0.77 0.05 0.00 -4.06 0.00 0.00 30.24 25.99 2w3r n GLN 359 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 2w3r s ASP 360 N 0.00 5.01 0.35 1.69 2.15 -1.26 -4.52 116.67 120.09 2w3r s ASP 360 Ca 0.00 2.68 0.02 0.00 0.43 0.00 0.00 52.55 55.68 2w3r s ASP 360 Cb 0.00 -2.63 -0.02 0.00 -0.30 0.00 0.00 42.92 39.97 2w3r s ASP 360 CO 0.00 -1.74 0.53 0.27 -0.17 0.00 0.00 175.17 174.06 2w3r s ILE 361 N -1.36 4.77 0.50 4.11 -4.36 -1.26 -4.74 121.20 118.85 2w3r s ILE 361 Ca 0.76 -0.64 -0.21 0.00 -0.26 0.00 0.00 60.65 60.29 2w3r s ILE 361 Cb -0.38 -3.72 -0.06 0.00 1.25 0.00 0.00 42.46 39.54 2w3r s ILE 361 CO 0.43 -0.41 1.17 -0.44 0.24 0.00 0.00 174.94 175.93 2w3r s SER 362 N -4.08 5.89 -0.19 4.36 0.01 -1.26 -4.68 113.70 113.74 2w3r s SER 362 Ca 0.41 2.31 -0.16 0.00 1.31 0.00 0.00 55.95 59.83 2w3r s SER 362 Cb -0.10 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.46 2w3r s SER 362 CO 0.34 -1.11 -0.27 0.00 0.41 0.00 0.00 173.24 172.61 2w3r n ALA 363 N -0.85 0.84 -2.44 1.44 0.00 0.20 -4.96 120.51 114.74 2w3r n ALA 363 Ca 0.09 -0.77 -0.31 0.00 0.00 0.00 0.00 53.44 52.46 2w3r n ALA 363 Cb 0.49 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.78 2w3r n ALA 363 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2w3r s VAL 364 N -2.65 2.00 -0.35 0.00 1.01 -1.18 -4.53 120.40 114.71 2w3r s VAL 364 Ca -0.28 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 60.62 2w3r s VAL 364 Cb 0.06 -1.67 0.12 0.00 0.00 0.00 0.00 36.38 34.89 2w3r s VAL 364 CO 0.41 0.56 0.17 0.00 0.00 0.00 0.00 175.10 176.24 2w3r s GLY 366 N 1.28 1.91 -0.21 0.00 0.00 -0.70 -0.83 107.32 108.77 2w3r s GLY 366 Ca 0.14 -0.98 -0.02 0.00 0.00 0.00 0.00 44.72 43.85 2w3r s GLY 366 CO -0.15 0.46 -0.09 0.00 0.00 0.00 0.00 173.10 173.33 2w3r s LEU 368 N 1.41 2.81 -0.26 0.00 1.02 -1.13 -0.98 118.68 121.54 2w3r s LEU 368 Ca 0.05 -0.17 -0.03 0.00 0.02 0.00 0.00 54.13 53.99 2w3r s LEU 368 Cb -0.14 -1.58 0.10 0.00 0.02 0.00 0.00 46.19 44.59 2w3r s LEU 368 CO -0.06 0.34 0.19 0.21 0.02 0.00 0.00 176.35 177.05 2w3r s ASN 369 N -0.78 2.45 -0.03 2.29 3.84 -0.15 -1.12 114.94 121.43 2w3r s ASN 369 Ca 0.12 -0.85 0.02 0.00 0.21 0.00 0.00 52.86 52.36 2w3r s ASN 369 Cb -0.11 0.04 -0.03 0.00 -0.55 0.00 0.00 41.25 40.60 2w3r s ASN 369 CO 0.01 -0.39 -0.07 -0.76 -2.79 0.00 0.00 177.10 173.10 2w3r s LEU 370 N 2.22 3.18 -0.12 3.21 1.43 -1.26 -0.07 118.68 127.26 2w3r s LEU 370 Ca 0.08 -0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 2w3r s LEU 370 Cb -0.15 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 2w3r s LEU 370 CO -0.27 0.32 -0.01 -0.89 0.23 0.00 0.00 176.35 175.72 2w3r s THR 371 N -0.91 4.13 -0.02 5.49 2.01 -0.29 -4.53 115.64 121.52 2w3r s THR 371 Ca 0.15 -0.29 0.04 0.00 0.31 0.00 0.00 61.69 61.89 2w3r s THR 371 Cb -0.11 -2.78 -0.03 0.00 0.01 0.00 0.00 72.50 69.59 2w3r s THR 371 CO 0.05 0.54 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.64 2w3r s LEU 372 N -0.21 2.89 -0.61 4.42 1.43 -1.26 0.16 118.68 125.50 2w3r s LEU 372 Ca 0.05 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2w3r s LEU 372 Cb -0.13 -1.64 0.39 0.00 0.03 0.00 0.00 46.19 44.85 2w3r s LEU 372 CO 0.02 0.32 1.51 1.17 0.23 0.00 0.00 176.35 179.59 2w3r n LYS 373 N 1.96 3.14 -2.11 1.70 3.00 0.31 -4.80 118.16 121.36 2w3r n LYS 373 Ca -0.17 -4.07 -0.03 0.00 -0.00 0.00 0.00 58.31 54.05 2w3r n LYS 373 Cb 0.52 -2.26 -0.02 0.00 0.00 0.00 0.00 35.03 33.27 2w3r n LYS 373 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2w3r n GLY 374 N -0.52 -4.51 4.33 3.14 0.00 -1.26 -4.35 105.19 102.01 2w3r n GLY 374 Ca 0.46 0.77 0.00 0.00 0.00 0.00 0.00 46.02 47.25 2w3r n GLY 374 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2w3r n SER 375 N 1.10 0.00 -4.18 1.61 2.88 -1.26 -4.93 113.62 108.83 2w3r n SER 375 Ca -0.21 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.08 2w3r n SER 375 Cb 0.33 -0.40 -0.15 0.00 -0.75 0.00 0.00 64.21 63.25 2w3r n SER 375 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2w3r s LYS 376 N 0.00 1.35 -0.28 -1.46 1.02 -1.26 -2.35 119.74 116.76 2w3r s LYS 376 Ca 0.00 -0.71 -0.29 0.00 0.02 0.00 0.00 55.97 54.99 2w3r s LYS 376 Cb 0.00 -1.35 0.01 0.00 -0.52 0.00 0.00 37.83 35.98 2w3r s LYS 376 CO 0.00 0.36 1.09 0.42 -0.92 0.00 0.00 175.35 176.30 2w3r s ILE 377 N -0.55 4.54 -0.05 2.17 1.01 -0.69 -0.53 121.20 127.11 2w3r s ILE 377 Ca 0.06 1.81 -0.03 0.00 0.00 0.00 0.00 60.65 62.49 2w3r s ILE 377 Cb -0.07 -4.34 -0.02 0.00 0.01 0.00 0.00 42.46 38.04 2w3r s ILE 377 CO 0.00 -0.35 0.20 -0.33 0.00 0.00 0.00 174.94 174.46 2w3r h GLU 378 N 7.93 -0.12 -5.92 2.79 4.39 0.12 0.15 114.58 123.92 2w3r h GLU 378 Ca -0.21 0.01 -0.60 0.00 0.34 0.00 0.00 59.36 58.91 2w3r h GLU 378 Cb 1.06 0.03 -0.30 0.00 -0.10 0.00 0.00 28.75 29.44 2w3r h GLU 378 CO 1.01 -0.08 -0.85 0.99 -1.16 0.00 0.00 179.01 178.92 2w3r s THR 379 N -1.85 1.59 -0.27 1.13 2.01 -1.11 -4.69 115.64 112.45 2w3r s THR 379 Ca -0.02 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.11 2w3r s THR 379 Cb 0.00 -1.33 0.04 0.00 0.01 0.00 0.00 72.50 71.22 2w3r s THR 379 CO 0.05 0.45 -0.03 0.00 -0.69 0.00 0.00 174.62 174.40 2w3r s ALA 380 N -0.43 2.75 -0.66 7.40 0.00 -1.26 -1.13 121.76 128.42 2w3r s ALA 380 Ca 0.07 -1.62 0.04 0.00 0.00 0.00 0.00 51.96 50.44 2w3r s ALA 380 Cb -0.08 -1.80 0.16 0.00 0.00 0.00 0.00 23.12 21.40 2w3r s ALA 380 CO -0.00 -1.06 0.45 1.03 0.00 0.00 0.00 175.76 176.17 2w3r s ARG 381 N 1.28 2.40 -0.28 0.00 0.52 0.89 -4.90 118.95 118.86 2w3r s ARG 381 Ca -0.03 -3.08 -0.03 0.00 -0.52 0.00 0.00 55.73 52.07 2w3r s ARG 381 Cb -0.18 -3.46 0.04 0.00 0.52 0.00 0.00 34.95 31.86 2w3r s ARG 381 CO -0.03 -1.22 -0.00 0.42 0.02 0.00 0.00 175.30 174.48 2w3r s ILE 382 N -1.02 3.13 0.09 1.52 1.01 -1.26 -0.98 121.20 123.68 2w3r s ILE 382 Ca 0.22 -1.15 0.10 0.00 0.00 0.00 0.00 60.65 59.82 2w3r s ILE 382 Cb -0.12 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 2w3r s ILE 382 CO -0.10 0.02 -0.26 0.00 0.00 0.00 0.00 174.94 174.59 2w3r s ALA 383 N 1.32 2.34 0.08 9.38 0.00 -0.16 -0.34 121.76 134.39 2w3r s ALA 383 Ca -0.02 -1.37 0.08 0.00 0.00 0.00 0.00 51.96 50.65 2w3r s ALA 383 Cb -0.18 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 2w3r s ALA 383 CO -0.02 0.54 -0.20 -0.06 0.00 0.00 0.00 175.76 176.03 2w3r s PHE 384 N -0.95 1.72 -0.04 0.00 0.40 -0.82 -1.09 117.98 117.21 2w3r s PHE 384 Ca 0.13 -0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.13 2w3r s PHE 384 Cb -0.10 -0.97 -0.02 0.00 0.51 0.00 0.00 43.02 42.44 2w3r s PHE 384 CO 0.04 0.15 -0.25 0.20 0.70 0.00 0.00 175.22 176.06 2w3r s GLY 385 N -1.65 1.27 0.00 4.36 0.00 -0.01 -3.16 107.32 108.13 2w3r s GLY 385 Ca 0.06 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 43.70 2w3r s GLY 385 CO 0.03 -0.80 0.00 0.61 0.00 0.00 0.00 173.10 172.94 2w3r n GLY 386 N 2.67 0.47 0.00 0.20 0.00 0.32 -1.58 105.19 107.27 2w3r n GLY 386 Ca -0.17 -0.33 0.08 0.00 0.00 0.00 0.00 46.02 45.60 2w3r n GLY 386 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2w3r n MET 387 N -2.98 1.50 -0.28 1.61 2.00 -1.26 -4.79 117.12 112.92 2w3r n MET 387 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 57.70 57.68 2w3r n MET 387 Cb 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 33.22 31.94 2w3r n MET 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2w3r n ALA 388 N -1.46 0.00 1.30 3.04 0.00 -1.26 -4.12 120.51 118.00 2w3r n ALA 388 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.58 2w3r n ALA 388 Cb 0.27 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.14 2w3r n ALA 388 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3r n GLY 389 N 0.00 0.22 3.50 0.00 0.00 -1.26 -4.82 105.19 102.83 2w3r n GLY 389 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2w3r n GLY 389 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s VAL 390 N -1.85 -0.00 -0.04 1.61 0.11 -1.26 -3.34 120.40 115.63 2w3r s VAL 390 Ca 0.34 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.09 2w3r s VAL 390 Cb 0.19 -0.83 -0.06 0.00 -1.53 0.00 0.00 36.38 34.15 2w3r s VAL 390 CO 0.29 0.00 1.61 -2.84 -3.33 0.00 0.00 175.10 170.82 2w3r s PRO 391 N 0.32 4.20 0.04 1.54 0.02 -1.26 -4.87 135.00 134.98 2w3r s PRO 391 Ca -0.00 2.16 -0.06 0.00 0.02 0.00 0.00 61.00 63.11 2w3r s PRO 391 Cb -0.04 -3.89 -0.01 0.00 0.02 0.00 0.00 34.50 30.58 2w3r s PRO 391 CO 0.01 -0.80 0.12 -1.59 -0.33 0.00 0.00 177.00 174.41 2w3r s LYS 392 N 3.69 0.60 0.34 5.54 -2.85 -1.19 -4.91 119.74 120.97 2w3r s LYS 392 Ca 0.72 -0.70 -0.22 0.00 -1.00 0.00 0.00 55.97 54.77 2w3r s LYS 392 Cb -0.33 0.24 -0.10 0.00 -2.06 0.00 0.00 37.83 35.58 2w3r s LYS 392 CO 0.29 -0.16 0.88 1.03 0.10 0.00 0.00 175.35 177.49 2w3r s ARG 393 N -2.50 4.32 -1.06 1.78 0.52 -1.26 -1.95 118.95 118.80 2w3r s ARG 393 Ca -0.06 1.09 -0.23 0.00 -0.52 0.00 0.00 55.73 56.01 2w3r s ARG 393 Cb -0.02 -2.54 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 2w3r s ARG 393 CO -0.04 0.17 1.82 0.00 0.02 0.00 0.00 175.30 177.27 2w3r s ALA 394 N -1.85 2.14 0.07 2.13 0.00 0.54 -4.87 121.76 119.92 2w3r s ALA 394 Ca 0.54 -2.04 -0.18 0.00 0.00 0.00 0.00 51.96 50.27 2w3r s ALA 394 Cb -0.14 -4.60 -0.06 0.00 0.00 0.00 0.00 23.12 18.32 2w3r s ALA 394 CO 0.19 -4.49 1.30 0.00 0.00 0.00 0.00 175.76 172.76 2w3r h ALA 395 N 10.01 -0.60 -0.10 0.00 0.00 -1.92 0.40 119.26 127.06 2w3r h ALA 395 Ca 0.20 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 395 Cb 0.97 0.89 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 2w3r h ALA 395 CO 1.29 -0.73 -0.40 0.00 0.00 0.00 0.00 179.25 179.40 2w3r h ALA 396 N -0.69 1.14 -0.16 0.00 0.00 -1.89 -2.14 119.26 115.51 2w3r h ALA 396 Ca 0.03 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 2w3r h ALA 396 Cb 0.34 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2w3r h ALA 396 CO -0.29 0.58 -0.55 0.35 0.00 0.00 0.00 179.25 179.34 2w3r h PHE 397 N 0.18 0.87 -0.23 0.00 3.57 -1.71 -1.89 116.94 117.73 2w3r h PHE 397 Ca 0.02 -0.35 0.00 0.00 3.53 0.00 0.00 57.97 61.16 2w3r h PHE 397 Cb 0.80 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 2w3r h PHE 397 CO 0.01 1.15 0.15 0.93 -2.23 0.00 0.00 178.31 178.32 2w3r h GLU 398 N 0.34 0.31 0.26 1.11 5.08 -0.16 -3.30 114.58 118.22 2w3r h GLU 398 Ca -0.02 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2w3r h GLU 398 Cb 1.17 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2w3r h GLU 398 CO 0.12 0.20 -0.12 0.00 -1.00 0.00 0.00 179.01 178.21 2w3r h ALA 399 N 1.08 -0.35 0.00 3.43 0.00 -1.38 -3.02 119.26 119.02 2w3r h ALA 399 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2w3r h ALA 399 Cb -0.03 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2w3r h ALA 399 CO -0.02 -0.57 0.00 0.00 0.00 0.00 0.00 179.25 178.66 2w3r n ALA 400 N -2.38 1.93 -0.01 0.00 0.00 -0.71 -2.32 120.51 117.01 2w3r n ALA 400 Ca -0.09 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.36 2w3r n ALA 400 Cb 0.23 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.63 2w3r n ALA 400 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2w3r n LEU 401 N -0.41 0.00 -4.71 0.00 7.94 -1.14 -4.94 117.00 113.74 2w3r n LEU 401 Ca 0.00 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.48 2w3r n LEU 401 Cb 0.01 0.05 -0.03 0.00 0.53 0.00 0.00 43.42 43.98 2w3r n LEU 401 CO 0.00 0.05 1.20 -0.63 -1.11 0.00 0.00 177.39 176.90 2w3r s ILE 402 N -2.39 3.00 0.00 1.96 1.01 -0.98 -2.20 121.20 121.60 2w3r s ILE 402 Ca -0.03 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.26 2w3r s ILE 402 Cb 0.04 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 39.10 2w3r s ILE 402 CO 0.28 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.86 2w3r n GLY 403 N 3.74 0.94 3.90 6.18 0.00 0.52 -4.98 105.19 115.49 2w3r n GLY 403 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2w3r n GLY 403 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3r s GLN 404 N -0.09 3.56 0.01 1.61 -1.52 -0.93 -4.63 119.66 117.67 2w3r s GLN 404 Ca 0.00 0.36 -0.30 0.00 -1.95 0.00 0.00 55.36 53.46 2w3r s GLN 404 Cb 0.00 -2.29 -0.06 0.00 -0.22 0.00 0.00 33.01 30.44 2w3r s GLN 404 CO 0.00 -0.30 1.42 -0.51 -0.25 0.00 0.00 175.29 175.65 2w3r s ASP 405 N -4.10 6.83 -1.14 5.90 1.11 -1.26 -1.71 116.67 122.30 2w3r s ASP 405 Ca 0.50 2.16 -0.21 0.00 0.18 0.00 0.00 52.55 55.17 2w3r s ASP 405 Cb -0.10 -2.56 0.05 0.00 1.07 0.00 0.00 42.92 41.37 2w3r s ASP 405 CO 0.47 -0.72 1.61 0.12 1.18 0.00 0.00 175.17 177.83 2w3r s PHE 406 N 2.30 2.59 0.13 4.23 5.36 -0.99 -4.73 117.98 126.87 2w3r s PHE 406 Ca 0.65 -1.07 -0.01 0.00 -0.96 0.00 0.00 56.93 55.53 2w3r s PHE 406 Cb -0.32 -4.67 -0.04 0.00 -0.34 0.00 0.00 43.02 37.64 2w3r s PHE 406 CO 0.27 -1.85 0.05 1.03 -1.46 0.00 0.00 175.22 173.26 2w3r s ARG 407 N 4.79 0.91 0.13 10.12 0.52 -1.26 -5.03 118.95 129.14 2w3r s ARG 407 Ca 0.51 -1.43 -0.18 0.00 -0.52 0.00 0.00 55.73 54.11 2w3r s ARG 407 Cb 0.01 0.22 -0.03 0.00 0.52 0.00 0.00 34.95 35.68 2w3r s ARG 407 CO -0.01 -0.25 1.76 1.49 0.02 0.00 0.00 175.30 178.32 2w3r h GLU 408 N 2.88 0.43 -0.48 3.54 4.81 -1.95 -2.82 114.58 120.98 2w3r h GLU 408 Ca -0.35 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.83 2w3r h GLU 408 Cb 1.20 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 2w3r h GLU 408 CO 0.60 0.33 0.24 0.38 -0.73 0.00 0.00 179.01 179.82 2w3r h ASP 409 N 0.41 0.60 -0.26 1.04 3.04 -1.98 0.13 116.42 119.39 2w3r h ASP 409 Ca 0.11 -0.05 -0.08 0.00 -3.24 0.00 0.00 57.03 53.77 2w3r h ASP 409 Cb 0.01 -0.15 -0.01 0.00 -1.04 0.00 0.00 39.33 38.14 2w3r h ASP 409 CO -0.02 0.50 -0.16 0.71 -2.04 0.00 0.00 179.24 178.23 2w3r h THR 410 N 0.67 1.30 -0.78 1.15 1.35 -1.83 -2.97 112.91 111.81 2w3r h THR 410 Ca 0.17 -1.27 -0.02 0.00 -0.55 0.00 0.00 66.41 64.74 2w3r h THR 410 Cb 0.06 1.56 -0.04 0.00 -1.73 0.00 0.00 68.15 68.01 2w3r h THR 410 CO -0.02 0.40 0.41 0.40 -0.25 0.00 0.00 175.52 176.45 2w3r h ILE 411 N 0.30 1.24 -0.86 6.82 1.08 -1.17 -2.98 117.51 121.94 2w3r h ILE 411 Ca 0.05 -0.61 0.06 0.00 -0.39 0.00 0.00 64.86 63.97 2w3r h ILE 411 Cb 0.68 0.20 -0.06 0.00 -3.07 0.00 0.00 36.82 34.57 2w3r h ILE 411 CO 0.04 0.27 0.53 0.00 -0.69 0.00 0.00 178.15 178.31 2w3r h ALA 412 N 1.35 1.19 0.00 1.87 0.00 -0.66 -0.92 119.26 122.09 2w3r h ALA 412 Ca 0.27 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 2w3r h ALA 412 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2w3r h ALA 412 CO -0.04 0.27 -0.42 0.00 0.00 0.00 0.00 179.25 179.06 2w3r h ALA 413 N 1.41 1.03 0.00 0.00 0.00 -1.40 -3.00 119.26 117.29 2w3r h ALA 413 Ca 0.38 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2w3r h ALA 413 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2w3r h ALA 413 CO -0.18 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2w3r h ALA 414 N 1.58 1.00 -0.49 0.00 0.00 -1.06 -3.38 119.26 116.91 2w3r h ALA 414 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2w3r h ALA 414 Cb 0.91 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 2w3r h ALA 414 CO 0.05 0.00 0.09 -0.07 0.00 0.00 0.00 179.25 179.33 2w3r h LEU 415 N 0.00 -0.01 -2.28 0.00 3.38 -1.18 -2.57 115.31 112.66 2w3r h LEU 415 Ca 0.00 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.10 2w3r h LEU 415 Cb 0.77 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2w3r h LEU 415 CO 0.00 0.02 0.16 -0.65 0.09 0.00 0.00 178.44 178.06 2w3r h PRO 416 N 0.23 0.00 0.00 1.13 0.11 -1.80 -1.89 132.00 129.77 2w3r h PRO 416 Ca 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 2w3r h PRO 416 Cb 0.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 2w3r h PRO 416 CO -0.33 0.00 -0.00 -0.07 -0.21 0.00 0.00 178.00 177.39 2w3r h LEU 417 N 0.00 0.00 -1.42 2.35 3.38 -1.76 -0.54 115.31 117.32 2w3r h LEU 417 Ca 0.07 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2w3r h LEU 417 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2w3r h LEU 417 CO -0.00 0.00 -0.17 -0.07 0.09 0.00 0.00 178.44 178.29 2w3r h LEU 418 N 0.00 0.16 -0.06 1.67 3.38 -1.52 -1.40 115.31 117.54 2w3r h LEU 418 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2w3r h LEU 418 Cb 0.01 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2w3r h LEU 418 CO 0.00 0.35 0.00 0.00 0.09 0.00 0.00 178.44 178.88 2w3r n ALA 419 N -2.49 1.68 -0.01 1.53 0.00 -0.21 -1.18 120.51 119.83 2w3r n ALA 419 Ca -0.01 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.45 2w3r n ALA 419 Cb 0.28 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.33 2w3r n ALA 419 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2w3r n GLN 420 N -1.57 0.66 0.02 0.00 6.02 -0.58 -4.42 117.38 117.51 2w3r n GLN 420 Ca 0.03 -0.09 -0.08 0.00 -0.01 0.00 0.00 57.00 56.86 2w3r n GLN 420 Cb 0.18 -1.58 -0.13 0.00 1.02 0.00 0.00 30.24 29.74 2w3r n GLN 420 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 2w3r h ASP 421 N 0.00 0.00 -3.92 1.08 3.32 -0.72 -3.47 116.42 112.71 2w3r h ASP 421 Ca -0.12 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.68 2w3r h ASP 421 Cb 1.30 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.58 2w3r h ASP 421 CO 0.01 0.99 -0.73 -0.36 -1.72 0.00 0.00 179.24 177.43 2w3r s PHE 422 N -2.66 0.17 -0.60 4.55 0.40 -0.32 -4.94 117.98 114.57 2w3r s PHE 422 Ca -0.02 -0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.24 2w3r s PHE 422 Cb 0.09 -0.11 0.15 0.00 0.51 0.00 0.00 43.02 43.66 2w3r s PHE 422 CO 0.82 -0.02 0.38 0.99 0.70 0.00 0.00 175.22 178.09 2w3r s THR 423 N -0.21 3.15 0.86 0.64 2.01 -1.26 -4.48 115.64 116.35 2w3r s THR 423 Ca -0.01 -3.33 -0.11 0.00 0.31 0.00 0.00 61.69 58.55 2w3r s THR 423 Cb -0.02 -3.10 0.12 0.00 0.01 0.00 0.00 72.50 69.51 2w3r s THR 423 CO -0.00 -0.87 1.14 -2.84 -0.69 0.00 0.00 174.62 171.36 2w3r s PRO 424 N -0.40 1.40 0.56 4.92 0.02 -1.26 -4.91 135.00 135.33 2w3r s PRO 424 Ca 0.18 1.50 0.07 0.00 0.02 0.00 0.00 61.00 62.77 2w3r s PRO 424 Cb -0.21 -1.77 0.06 0.00 0.02 0.00 0.00 34.50 32.59 2w3r s PRO 424 CO -0.03 -2.34 0.52 -1.17 -0.33 0.00 0.00 177.00 173.65 2w3r s LEU 425 N -6.30 2.79 0.01 -5.54 2.96 -1.26 -4.77 118.68 106.58 2w3r s LEU 425 Ca 0.66 -1.15 0.07 0.00 -0.22 0.00 0.00 54.13 53.50 2w3r s LEU 425 Cb -0.22 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.16 2w3r s LEU 425 CO 0.56 -1.20 -0.21 -0.44 -1.32 0.00 0.00 176.35 173.74 2w3r s SER 426 N -4.41 2.51 0.00 3.68 0.01 -1.26 -2.57 113.70 111.67 2w3r s SER 426 Ca 0.42 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.23 2w3r s SER 426 Cb -0.03 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2w3r s SER 426 CO 0.26 0.22 0.00 -0.90 0.41 0.00 0.00 173.24 173.23 2w3r n ASP 427 N 2.21 0.00 0.24 2.44 5.75 -0.55 -4.97 116.55 121.67 2w3r n ASP 427 Ca -0.16 -0.54 0.12 0.00 -0.01 0.00 0.00 54.79 54.19 2w3r n ASP 427 Cb 0.53 0.00 0.59 0.00 -1.03 0.00 0.00 41.12 41.21 2w3r n ASP 427 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w3r h MET 428 N 0.00 0.00 0.12 0.11 -0.00 -2.02 -3.17 114.93 109.97 2w3r h MET 428 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 59.70 59.42 2w3r h MET 428 Cb 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 31.60 31.63 2w3r h MET 428 CO 0.00 0.17 -1.19 0.00 -0.00 0.00 0.00 176.91 175.90 2w3r h ARG 429 N 0.00 0.59 -2.16 -0.10 3.08 -2.00 -3.48 114.38 110.32 2w3r h ARG 429 Ca -0.00 -0.80 -0.02 0.00 0.07 0.00 0.00 59.98 59.23 2w3r h ARG 429 Cb 0.56 0.26 -0.18 0.00 0.08 0.00 0.00 29.97 30.69 2w3r h ARG 429 CO 0.02 1.36 0.27 0.00 -1.07 0.00 0.00 179.97 180.55 2w3r s ALA 430 N -2.95 -1.76 0.68 0.04 0.00 -1.20 -4.84 121.76 111.74 2w3r s ALA 430 Ca -0.10 1.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.92 2w3r s ALA 430 Cb 0.05 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.27 2w3r s ALA 430 CO 0.92 -0.46 1.08 -1.54 0.00 0.00 0.00 175.76 175.76 2w3r s SER 431 N -1.58 5.64 0.15 0.00 1.04 -1.26 -1.49 113.70 116.20 2w3r s SER 431 Ca -0.06 1.20 -0.13 0.00 0.48 0.00 0.00 55.95 57.44 2w3r s SER 431 Cb -0.00 -2.06 0.03 0.00 0.10 0.00 0.00 66.02 64.09 2w3r s SER 431 CO 0.03 -1.22 1.67 0.00 0.98 0.00 0.00 173.24 174.70 2w3r h ALA 432 N -0.57 0.66 -0.68 5.32 0.00 -1.80 -2.07 119.26 120.13 2w3r h ALA 432 Ca -0.45 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.35 2w3r h ALA 432 Cb 1.24 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2w3r h ALA 432 CO 0.63 0.33 0.35 0.00 0.00 0.00 0.00 179.25 180.56 2w3r h ALA 433 N 1.01 0.92 -0.43 0.00 0.00 -1.91 -1.42 119.26 117.43 2w3r h ALA 433 Ca 0.16 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2w3r h ALA 433 Cb 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2w3r h ALA 433 CO -0.00 -0.02 0.12 -0.92 0.00 0.00 0.00 179.25 178.43 2w3r h TYR 434 N 0.62 0.71 -0.38 0.00 3.20 -1.89 -1.75 116.97 117.48 2w3r h TYR 434 Ca 0.32 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2w3r h TYR 434 Cb 0.29 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2w3r h TYR 434 CO -0.10 0.65 0.21 0.00 -1.64 0.00 0.00 178.16 177.28 2w3r h ARG 435 N 0.56 0.53 0.12 1.82 3.08 -0.95 0.16 114.38 119.70 2w3r h ARG 435 Ca 0.14 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2w3r h ARG 435 Cb 0.29 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2w3r h ARG 435 CO -0.00 0.43 -0.06 1.98 -1.07 0.00 0.00 179.97 181.25 2w3r h MET 436 N 0.48 -0.15 -0.98 0.04 4.05 -1.25 -1.91 114.93 115.21 2w3r h MET 436 Ca 0.13 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.60 2w3r h MET 436 Cb 0.06 0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 30.84 2w3r h MET 436 CO -0.02 0.01 0.64 -0.97 0.23 0.00 0.00 176.91 176.81 2w3r h ASN 437 N -0.29 1.08 -0.70 1.39 -0.73 -1.23 -2.74 115.58 112.36 2w3r h ASN 437 Ca -0.02 -0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.08 2w3r h ASN 437 Cb 0.24 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.55 2w3r h ASN 437 CO 0.03 0.74 0.21 0.00 -0.37 0.00 0.00 177.43 178.04 2w3r h ALA 438 N 1.42 0.92 -0.57 1.57 0.00 -0.51 -0.11 119.26 121.98 2w3r h ALA 438 Ca 0.39 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2w3r h ALA 438 Cb -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2w3r h ALA 438 CO -0.12 0.60 0.13 0.00 0.00 0.00 0.00 179.25 179.87 2w3r h ALA 439 N 1.10 1.16 0.00 0.00 0.00 -1.06 -1.19 119.26 119.27 2w3r h ALA 439 Ca 0.22 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2w3r h ALA 439 Cb 0.31 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2w3r h ALA 439 CO -0.01 0.57 -0.66 1.96 0.00 0.00 0.00 179.25 181.12 2w3r h GLN 440 N 0.84 0.00 -0.20 0.00 4.20 -1.25 -3.05 115.11 115.65 2w3r h GLN 440 Ca 0.18 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.78 2w3r h GLN 440 Cb 0.32 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 2w3r h GLN 440 CO 0.00 0.66 -0.34 0.00 -0.67 0.00 0.00 178.83 178.48 2w3r h ALA 441 N 1.34 1.05 0.00 3.87 0.00 -0.46 -2.77 119.26 122.29 2w3r h ALA 441 Ca -0.01 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2w3r h ALA 441 Cb 1.29 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2w3r h ALA 441 CO 0.09 0.59 -0.25 0.52 0.00 0.00 0.00 179.25 180.19 2w3r h MET 442 N 0.36 0.00 0.22 0.00 2.86 -1.14 -1.25 114.93 115.99 2w3r h MET 442 Ca 0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2w3r h MET 442 Cb 0.77 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2w3r h MET 442 CO 0.06 0.25 -0.10 0.00 1.06 0.00 0.00 176.91 178.18 2w3r h ALA 443 N 1.75 -0.29 -0.99 6.32 0.00 -1.40 -2.67 119.26 121.98 2w3r h ALA 443 Ca -0.00 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.77 2w3r h ALA 443 Cb 0.61 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 2w3r h ALA 443 CO 0.03 -0.48 0.64 -0.07 0.00 0.00 0.00 179.25 179.37 2w3r h LEU 444 N -0.66 1.06 -1.31 0.00 3.38 -1.44 -2.51 115.31 113.84 2w3r h LEU 444 Ca -0.03 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.97 2w3r h LEU 444 Cb 0.47 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2w3r h LEU 444 CO 0.05 0.71 0.49 -0.09 0.09 0.00 0.00 178.44 179.69 2w3r h ARG 445 N 1.23 0.87 -0.23 1.13 2.43 -1.22 -2.44 114.38 116.15 2w3r h ARG 445 Ca 0.40 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.39 2w3r h ARG 445 Cb 0.05 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2w3r h ARG 445 CO -0.14 0.58 -0.42 -0.92 -1.51 0.00 0.00 179.97 177.56 2w3r h TYR 446 N 0.90 0.65 0.22 2.20 3.20 -1.09 -1.65 116.97 121.40 2w3r h TYR 446 Ca 0.30 -0.19 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2w3r h TYR 446 Cb 0.07 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.21 2w3r h TYR 446 CO -0.00 0.88 -0.11 0.28 -1.64 0.00 0.00 178.16 177.57 2w3r h VAL 447 N 0.45 0.85 -0.90 1.81 2.07 -1.41 -2.76 116.25 116.37 2w3r h VAL 447 Ca 0.04 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2w3r h VAL 447 Cb 0.92 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.85 2w3r h VAL 447 CO 0.08 0.13 0.54 0.03 0.02 0.00 0.00 177.57 178.38 2w3r h ARG 448 N -0.62 1.22 -0.56 1.57 3.08 -1.42 -0.77 114.38 116.89 2w3r h ARG 448 Ca -0.03 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 2w3r h ARG 448 Cb 0.45 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2w3r h ARG 448 CO 0.05 0.86 0.05 1.49 -1.07 0.00 0.00 179.97 181.35 2w3r h GLU 449 N 1.24 0.96 0.00 0.04 4.81 -1.38 0.21 114.58 120.45 2w3r h GLU 449 Ca 0.32 -0.28 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 2w3r h GLU 449 Cb -0.05 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2w3r h GLU 449 CO -0.06 0.94 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.66 2w3r h LEU 450 N 0.85 0.00 -0.05 1.64 3.38 -1.13 -2.18 115.31 117.81 2w3r h LEU 450 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2w3r h LEU 450 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2w3r h LEU 450 CO 0.02 0.43 -0.02 -1.54 0.09 0.00 0.00 178.44 177.42 2w3r n SER 451 N -3.72 0.10 0.00 -0.43 3.41 -0.34 -4.91 113.62 107.73 2w3r n SER 451 Ca -0.01 -0.39 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 2w3r n SER 451 Cb 0.50 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2w3r n SER 451 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w3r n GLY 452 N 1.23 0.77 3.88 5.00 0.00 -0.82 -5.07 105.19 110.18 2w3r n GLY 452 Ca 0.16 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 2w3r n GLY 452 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2w3r s GLU 453 N -0.94 3.75 -0.08 1.61 2.12 0.69 -5.00 118.70 120.84 2w3r s GLU 453 Ca 0.00 0.29 -0.30 0.00 0.36 0.00 0.00 54.97 55.32 2w3r s GLU 453 Cb 0.00 -2.52 -0.03 0.00 0.26 0.00 0.00 34.13 31.84 2w3r s GLU 453 CO 0.00 0.12 1.18 0.00 -0.54 0.00 0.00 175.26 176.01 2w3r s ALA 454 N -2.16 3.51 0.00 6.30 0.00 -1.26 -4.29 121.76 123.86 2w3r s ALA 454 Ca 0.48 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2w3r s ALA 454 Cb -0.11 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2w3r s ALA 454 CO 0.28 -0.80 0.00 0.28 0.00 0.00 0.00 175.76 175.52 2w3r n VAL 455 N 4.72 0.00 -2.30 0.00 0.31 -1.26 -5.01 118.33 114.79 2w3r n VAL 455 Ca 0.11 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.02 2w3r n VAL 455 Cb 0.46 -0.32 -0.03 0.00 -0.91 0.00 0.00 33.84 33.04 2w3r n VAL 455 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2w3r s ALA 456 N -1.50 3.52 0.01 3.52 0.00 -1.26 -4.92 121.76 121.13 2w3r s ALA 456 Ca 0.00 0.89 0.16 0.00 0.00 0.00 0.00 51.96 53.01 2w3r s ALA 456 Cb 0.00 -3.53 0.29 0.00 0.00 0.00 0.00 23.12 19.88 2w3r s ALA 456 CO 0.00 -0.70 1.55 0.28 0.00 0.00 0.00 175.76 176.89 2w3r h VAL 457 N 4.67 0.97 -0.00 0.00 2.07 -2.00 -3.23 116.25 118.72 2w3r h VAL 457 Ca -0.39 -2.06 0.00 0.00 0.82 0.00 0.00 66.70 65.06 2w3r h VAL 457 Cb 1.19 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 2w3r h VAL 457 CO 0.87 0.50 -0.12 0.18 0.02 0.00 0.00 177.57 179.02 2w3r n LEU 458 N -3.37 0.19 -1.56 2.57 4.77 -1.26 -3.57 117.00 114.77 2w3r n LEU 458 Ca 0.01 0.27 0.08 0.00 -0.03 0.00 0.00 56.01 56.34 2w3r n LEU 458 Cb 0.66 -0.36 0.36 0.00 -2.33 0.00 0.00 43.42 41.75 2w3r n LEU 458 CO 0.40 0.04 0.82 -0.62 -1.33 0.00 0.00 177.39 176.70 2w3r n GLU 459 N -1.36 4.19 -3.65 3.23 1.02 -1.22 -4.98 120.64 117.87 2w3r n GLU 459 Ca 0.09 -3.02 -0.36 0.00 -0.02 0.00 0.00 57.16 53.85 2w3r n GLU 459 Cb 0.31 -2.09 -0.07 0.00 -0.02 0.00 0.00 31.44 29.57 2w3r n GLU 459 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2w3r s VAL 460 N -2.62 5.35 0.29 2.62 1.01 -1.23 -5.07 120.40 120.75 2w3r s VAL 460 Ca 0.50 0.40 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 2w3r s VAL 460 Cb 0.38 -3.55 -0.11 0.00 0.00 0.00 0.00 36.38 33.10 2w3r s VAL 460 CO 0.15 0.45 1.56 -0.04 0.00 0.00 0.00 175.10 177.23 2w3r s MET 461 N 0.10 4.14 0.00 2.72 -1.94 -1.26 -5.14 119.30 117.92 2w3r s MET 461 Ca 0.14 2.53 0.13 0.00 -1.71 0.00 0.00 55.69 56.79 2w3r s MET 461 Cb -0.12 -3.03 0.80 0.00 2.01 0.00 0.00 34.83 34.48 2w3r s MET 461 CO 0.03 -0.59 1.23 -2.30 -0.01 0.00 0.00 175.02 173.37