#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3r n VAL 3 N 0.00 0.14 0.00 0.44 0.31 -1.25 -2.06 118.33 115.91 2w3r n VAL 3 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2w3r n VAL 3 Cb 0.00 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.27 2w3r n VAL 3 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2w3r n GLY 4 N 3.68 2.81 3.74 2.92 0.00 0.45 -5.02 105.19 113.78 2w3r n GLY 4 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2w3r n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s LYS 5 N -0.36 4.51 -0.77 1.61 1.02 -0.87 -4.40 119.74 120.48 2w3r s LYS 5 Ca 0.00 1.89 -0.07 0.00 0.02 0.00 0.00 55.97 57.81 2w3r s LYS 5 Cb 0.00 -3.22 -0.14 0.00 -0.52 0.00 0.00 37.83 33.95 2w3r s LYS 5 CO 0.00 -0.04 2.84 -0.35 -0.92 0.00 0.00 175.35 176.87 2w3r n PRO 6 N 2.15 2.47 -1.98 -1.68 -0.04 -1.26 -4.54 135.00 130.11 2w3r n PRO 6 Ca 0.03 -1.44 -0.33 0.00 -0.04 0.00 0.00 63.50 61.72 2w3r n PRO 6 Cb 0.44 -2.34 0.02 0.00 -0.04 0.00 0.00 33.50 31.58 2w3r n PRO 6 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2w3r s LEU 7 N 0.08 3.47 0.95 1.53 1.43 -1.26 -4.78 118.68 120.10 2w3r s LEU 7 Ca 0.57 1.84 -0.13 0.00 -1.03 0.00 0.00 54.13 55.38 2w3r s LEU 7 Cb 0.20 -4.54 0.16 0.00 0.03 0.00 0.00 46.19 42.05 2w3r s LEU 7 CO -0.03 -1.25 1.14 -2.16 0.23 0.00 0.00 176.35 174.28 2w3r s PRO 8 N -4.10 0.79 0.57 1.29 0.04 -1.26 -4.67 135.00 127.67 2w3r s PRO 8 Ca 0.64 0.26 -0.20 0.00 0.04 0.00 0.00 61.00 61.74 2w3r s PRO 8 Cb -0.17 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2w3r s PRO 8 CO 0.38 -2.43 1.28 -1.58 0.04 0.00 0.00 177.00 174.70 2w3r s HIS 9 N -3.23 2.33 0.58 0.56 5.65 -1.26 -4.90 115.29 115.01 2w3r s HIS 9 Ca 0.65 1.46 0.32 0.00 0.25 0.00 0.00 55.06 57.73 2w3r s HIS 9 Cb -0.15 -3.65 1.87 0.00 -1.18 0.00 0.00 32.58 29.48 2w3r s HIS 9 CO 0.54 -2.57 2.26 0.38 -0.65 0.00 0.00 174.74 174.69 2w3r h ASP 10 N 1.15 0.00 0.00 9.88 2.03 -1.93 -2.21 116.42 125.34 2w3r h ASP 10 Ca -0.51 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 55.79 2w3r h ASP 10 Cb 1.30 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.80 2w3r h ASP 10 CO 0.56 0.01 -0.06 -1.20 -1.03 0.00 0.00 179.24 177.53 2w3r n SER 11 N -3.72 2.13 -0.26 4.15 7.64 -1.26 -4.85 113.62 117.45 2w3r n SER 11 Ca -0.03 -3.02 0.05 0.00 1.01 0.00 0.00 58.87 56.89 2w3r n SER 11 Cb 0.10 -0.41 0.16 0.00 -1.01 0.00 0.00 64.21 63.05 2w3r n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w3r h ALA 12 N 0.03 0.81 -0.23 -0.43 0.00 -1.77 0.30 119.26 117.98 2w3r h ALA 12 Ca -0.00 0.23 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 2w3r h ALA 12 Cb 1.04 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 2w3r h ALA 12 CO 0.00 -0.42 -0.25 -0.09 0.00 0.00 0.00 179.25 178.49 2w3r h ARG 13 N 0.12 0.57 -0.46 0.00 2.43 -1.89 -1.96 114.38 113.19 2w3r h ARG 13 Ca 0.42 -0.31 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2w3r h ARG 13 Cb 0.73 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 2w3r h ARG 13 CO -0.65 0.91 0.31 0.00 -1.51 0.00 0.00 179.97 179.03 2w3r h ALA 14 N 0.65 1.71 -0.01 2.80 0.00 -1.54 0.23 119.26 123.10 2w3r h ALA 14 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2w3r h ALA 14 Cb 0.82 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2w3r h ALA 14 CO 0.06 0.25 0.00 0.45 0.00 0.00 0.00 179.25 180.02 2w3r h HIS 15 N 0.59 0.02 -0.04 0.00 3.86 -0.36 0.93 115.15 120.14 2w3r h HIS 15 Ca 0.18 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.28 2w3r h HIS 15 Cb -0.01 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 2w3r h HIS 15 CO -0.00 0.22 -0.48 0.28 0.86 0.00 0.00 177.93 178.81 2w3r h VAL 16 N -0.19 1.34 0.00 2.45 2.07 -0.45 -2.75 116.25 118.72 2w3r h VAL 16 Ca 0.00 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.85 2w3r h VAL 16 Cb 0.21 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2w3r h VAL 16 CO -0.00 0.48 -0.49 0.35 0.02 0.00 0.00 177.57 177.94 2w3r n THR 17 N -3.97 0.30 -1.84 2.57 -2.24 0.69 -4.95 114.28 104.83 2w3r n THR 17 Ca -0.02 -0.21 -0.03 0.00 -2.27 0.00 0.00 64.05 61.53 2w3r n THR 17 Cb 0.51 -0.14 -0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2w3r n THR 17 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3r n GLY 18 N 1.37 0.33 0.33 3.38 0.00 -0.91 -4.95 105.19 104.74 2w3r n GLY 18 Ca 0.04 -0.81 0.08 0.00 0.00 0.00 0.00 46.02 45.33 2w3r n GLY 18 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2w3r n GLN 19 N -1.64 1.74 -2.43 1.61 6.02 0.23 -4.93 117.38 117.97 2w3r n GLN 19 Ca -0.03 -0.74 -0.42 0.00 -0.01 0.00 0.00 57.00 55.79 2w3r n GLN 19 Cb 0.43 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.41 2w3r n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2w3r s ALA 20 N -1.88 3.48 -0.07 -1.58 0.00 -0.65 -4.99 121.76 116.08 2w3r s ALA 20 Ca 0.12 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 52.56 2w3r s ALA 20 Cb 0.12 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2w3r s ALA 20 CO 0.40 -0.71 0.62 1.03 0.00 0.00 0.00 175.76 177.11 2w3r s ARG 21 N 1.99 4.39 0.44 0.00 0.52 -1.26 -4.99 118.95 120.05 2w3r s ARG 21 Ca 0.57 0.74 0.07 0.00 -0.52 0.00 0.00 55.73 56.59 2w3r s ARG 21 Cb -0.26 -3.42 -0.02 0.00 0.52 0.00 0.00 34.95 31.77 2w3r s ARG 21 CO 0.24 0.15 0.33 0.71 0.02 0.00 0.00 175.30 176.75 2w3r s TYR 22 N 0.54 2.45 0.18 -0.53 1.51 -1.26 -4.69 117.35 115.55 2w3r s TYR 22 Ca 0.33 -0.59 -0.23 0.00 -1.01 0.00 0.00 57.07 55.57 2w3r s TYR 22 Cb -0.17 -2.06 0.09 0.00 -0.11 0.00 0.00 41.96 39.71 2w3r s TYR 22 CO 0.16 -0.11 1.57 1.25 -1.11 0.00 0.00 175.55 177.31 2w3r h LEU 23 N 1.08 -1.35 -0.63 -1.29 5.85 -1.95 0.16 115.31 117.19 2w3r h LEU 23 Ca -0.41 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2w3r h LEU 23 Cb 1.27 0.65 0.00 0.00 0.37 0.00 0.00 40.66 42.95 2w3r h LEU 23 CO 0.61 -0.32 0.00 -0.67 -0.34 0.00 0.00 178.44 177.72 2w3r n ASP 24 N -5.42 0.41 0.15 1.25 4.64 -1.26 -1.50 116.55 114.82 2w3r n ASP 24 Ca 0.03 0.63 0.07 0.00 -1.38 0.00 0.00 54.79 54.14 2w3r n ASP 24 Cb 0.36 -0.71 0.06 0.00 -1.04 0.00 0.00 41.12 39.79 2w3r n ASP 24 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2w3r h ASP 25 N 0.00 0.00 -3.58 1.67 3.32 -1.06 -3.47 116.42 113.30 2w3r h ASP 25 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2w3r h ASP 25 Cb 0.21 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.84 2w3r h ASP 25 CO 0.00 0.25 0.80 -0.76 -1.72 0.00 0.00 179.24 177.82 2w3r s LEU 26 N -6.12 4.35 0.36 1.55 1.43 -0.56 -4.93 118.68 114.77 2w3r s LEU 26 Ca 0.03 2.89 -0.27 0.00 -1.03 0.00 0.00 54.13 55.76 2w3r s LEU 26 Cb 0.07 -3.64 -0.09 0.00 0.03 0.00 0.00 46.19 42.56 2w3r s LEU 26 CO 0.73 -0.82 1.18 -2.84 0.23 0.00 0.00 176.35 174.84 2w3r s PRO 27 N -1.08 4.23 0.08 1.29 0.02 -1.26 -5.06 135.00 133.22 2w3r s PRO 27 Ca 0.58 1.90 -0.17 0.00 0.02 0.00 0.00 61.00 63.33 2w3r s PRO 27 Cb -0.45 -2.85 0.03 0.00 0.02 0.00 0.00 34.50 31.26 2w3r s PRO 27 CO 0.52 -0.19 0.40 0.00 -0.33 0.00 0.00 177.00 177.40 2w3r n PRO 29 N 0.15 0.59 0.09 0.00 -0.02 -1.26 -4.84 135.00 129.72 2w3r n PRO 29 Ca -0.17 0.24 0.18 0.00 -2.02 0.00 0.00 63.50 61.73 2w3r n PRO 29 Cb 0.62 -1.89 0.72 0.00 -0.02 0.00 0.00 33.50 32.93 2w3r n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3r h ALA 30 N 0.19 2.25 -0.38 3.55 0.00 -2.01 -1.05 119.26 121.80 2w3r h ALA 30 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2w3r h ALA 30 Cb 1.38 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2w3r h ALA 30 CO 0.47 -0.49 0.00 0.27 0.00 0.00 0.00 179.25 179.50 2w3r n ASN 31 N -4.21 3.66 -4.62 0.00 6.94 -1.26 -4.92 115.26 110.86 2w3r n ASN 31 Ca 0.06 -2.46 -0.43 0.00 -0.02 0.00 0.00 54.58 51.73 2w3r n ASN 31 Cb 0.48 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 37.32 2w3r n ASN 31 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2w3r s THR 32 N -1.96 3.27 0.73 5.53 2.01 -0.40 -4.47 115.64 120.35 2w3r s THR 32 Ca 0.33 0.30 -0.11 0.00 0.31 0.00 0.00 61.69 62.52 2w3r s THR 32 Cb 0.24 -3.30 0.03 0.00 0.01 0.00 0.00 72.50 69.48 2w3r s THR 32 CO 0.12 -0.14 1.09 -0.76 -0.69 0.00 0.00 174.62 174.24 2w3r s LEU 33 N 6.38 2.85 0.02 4.42 1.43 -0.35 -4.86 118.68 128.58 2w3r s LEU 33 Ca 0.87 1.28 0.05 0.00 -1.03 0.00 0.00 54.13 55.30 2w3r s LEU 33 Cb -0.31 -4.04 -0.02 0.00 0.03 0.00 0.00 46.19 41.85 2w3r s LEU 33 CO 0.35 -1.53 -0.16 -1.00 0.23 0.00 0.00 176.35 174.24 2w3r s HIS 34 N -3.23 1.41 0.12 0.29 3.76 0.73 -1.40 115.29 116.97 2w3r s HIS 34 Ca 0.59 -0.32 0.11 0.00 -0.15 0.00 0.00 55.06 55.29 2w3r s HIS 34 Cb -0.13 -0.87 -0.04 0.00 1.11 0.00 0.00 32.58 32.66 2w3r s HIS 34 CO 0.53 0.02 -0.26 -0.51 -0.85 0.00 0.00 174.74 173.68 2w3r s LEU 35 N -0.81 2.36 -0.08 0.89 1.43 -0.66 -1.17 118.68 120.63 2w3r s LEU 35 Ca 0.05 -0.71 -0.15 0.00 -1.03 0.00 0.00 54.13 52.29 2w3r s LEU 35 Cb -0.07 -1.27 0.03 0.00 0.03 0.00 0.00 46.19 44.91 2w3r s LEU 35 CO 0.01 0.19 0.37 0.00 0.23 0.00 0.00 176.35 177.15 2w3r s ALA 36 N -1.05 -0.94 0.23 4.21 0.00 -0.97 -4.48 121.76 118.76 2w3r s ALA 36 Ca 0.14 0.78 -0.13 0.00 0.00 0.00 0.00 51.96 52.75 2w3r s ALA 36 Cb -0.10 -0.29 -0.08 0.00 0.00 0.00 0.00 23.12 22.65 2w3r s ALA 36 CO 0.06 -0.23 0.61 -0.06 0.00 0.00 0.00 175.76 176.15 2w3r s PHE 37 N -0.55 3.49 -0.33 0.00 2.99 -1.26 -1.21 117.98 121.12 2w3r s PHE 37 Ca -0.07 1.07 -0.12 0.00 0.00 0.00 0.00 56.93 57.81 2w3r s PHE 37 Cb -0.04 -2.40 -0.02 0.00 0.00 0.00 0.00 43.02 40.57 2w3r s PHE 37 CO 0.03 0.28 0.21 0.20 -0.00 0.00 0.00 175.22 175.94 2w3r s GLY 38 N -2.07 1.94 0.12 4.36 0.00 0.38 -4.87 107.32 107.18 2w3r s GLY 38 Ca 0.46 -1.35 -0.03 0.00 0.00 0.00 0.00 44.72 43.79 2w3r s GLY 38 CO 0.20 0.74 0.33 1.08 0.00 0.00 0.00 173.10 175.44 2w3r s LEU 39 N 1.70 4.30 0.26 0.66 1.43 -1.26 0.01 118.68 125.78 2w3r s LEU 39 Ca 0.06 0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 2w3r s LEU 39 Cb -0.17 -3.20 -0.10 0.00 0.03 0.00 0.00 46.19 42.76 2w3r s LEU 39 CO 0.09 0.09 1.35 -0.55 0.23 0.00 0.00 176.35 177.57 2w3r s SER 40 N -2.44 6.77 -0.05 2.29 0.15 0.61 -4.83 113.70 116.20 2w3r s SER 40 Ca 0.39 2.59 0.21 0.00 0.70 0.00 0.00 55.95 59.84 2w3r s SER 40 Cb -0.12 -2.63 0.68 0.00 -1.71 0.00 0.00 66.02 62.24 2w3r s SER 40 CO 0.25 -0.59 1.58 0.35 1.20 0.00 0.00 173.24 176.04 2w3r n THR 41 N 1.91 1.34 -4.52 6.45 -2.24 -1.26 -0.45 114.28 115.51 2w3r n THR 41 Ca 0.04 -1.06 -0.21 0.00 -2.27 0.00 0.00 64.05 60.55 2w3r n THR 41 Cb 0.41 0.33 -0.15 0.00 -2.10 0.00 0.00 70.33 68.83 2w3r n THR 41 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w3r s GLU 42 N -1.38 1.01 0.17 -0.78 0.41 -1.26 -4.93 118.70 111.94 2w3r s GLU 42 Ca 0.50 -0.52 0.12 0.00 -0.41 0.00 0.00 54.97 54.66 2w3r s GLU 42 Cb 0.29 -0.98 -0.08 0.00 -1.78 0.00 0.00 34.13 31.57 2w3r s GLU 42 CO 0.30 0.26 1.26 0.00 -0.49 0.00 0.00 175.26 176.59 2w3r h ALA 43 N 5.62 0.55 -1.04 5.21 0.00 -1.81 -3.18 119.26 124.62 2w3r h ALA 43 Ca -0.34 -0.74 0.05 0.00 0.00 0.00 0.00 54.91 53.87 2w3r h ALA 43 Cb 1.17 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.71 2w3r h ALA 43 CO 0.48 0.96 -0.33 0.45 0.00 0.00 0.00 179.25 180.81 2w3r s SER 44 N -6.46 -1.43 0.05 0.00 0.15 -1.26 -2.43 113.70 102.33 2w3r s SER 44 Ca 0.01 0.51 -0.27 0.00 0.70 0.00 0.00 55.95 56.91 2w3r s SER 44 Cb 0.09 2.06 0.08 0.00 -1.71 0.00 0.00 66.02 66.53 2w3r s SER 44 CO 0.79 -0.28 0.69 0.00 1.20 0.00 0.00 173.24 175.64 2w3r s ALA 45 N 2.83 -1.71 0.10 5.45 0.00 -1.02 0.12 121.76 127.53 2w3r s ALA 45 Ca 0.15 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 52.87 2w3r s ALA 45 Cb -0.13 0.44 -0.06 0.00 0.00 0.00 0.00 23.12 23.37 2w3r s ALA 45 CO -0.23 -0.60 0.49 0.00 0.00 0.00 0.00 175.76 175.41 2w3r s ALA 46 N -2.70 3.63 -0.33 0.00 0.00 -0.98 -0.62 121.76 120.76 2w3r s ALA 46 Ca -0.02 -0.19 -0.22 0.00 0.00 0.00 0.00 51.96 51.52 2w3r s ALA 46 Cb -0.01 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 20.67 2w3r s ALA 46 CO -0.04 0.48 0.73 0.42 0.00 0.00 0.00 175.76 177.35 2w3r s ILE 47 N -1.36 4.82 -0.14 0.00 1.01 0.11 0.07 121.20 125.71 2w3r s ILE 47 Ca 0.34 0.93 0.06 0.00 0.00 0.00 0.00 60.65 61.97 2w3r s ILE 47 Cb -0.15 -4.12 -0.23 0.00 0.01 0.00 0.00 42.46 37.96 2w3r s ILE 47 CO 0.18 -0.29 0.28 0.41 0.00 0.00 0.00 174.94 175.52 2w3r n THR 48 N 5.59 1.60 -3.81 2.92 -1.04 0.11 -4.88 114.28 114.77 2w3r n THR 48 Ca 0.02 -0.72 -0.13 0.00 -2.04 0.00 0.00 64.05 61.17 2w3r n THR 48 Cb 0.48 -1.21 -0.14 0.00 -1.82 0.00 0.00 70.33 67.64 2w3r n THR 48 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2w3r s GLY 49 N -5.60 0.00 -0.33 3.41 0.00 -1.05 -4.96 107.32 98.80 2w3r s GLY 49 Ca -0.17 0.28 -0.01 0.00 0.00 0.00 0.00 44.72 44.82 2w3r s GLY 49 CO 0.77 0.44 0.14 -2.27 0.00 0.00 0.00 173.10 172.17 2w3r s LEU 50 N 0.53 1.79 -0.46 0.66 2.96 -1.26 -1.20 118.68 121.70 2w3r s LEU 50 Ca -0.04 -1.76 -0.12 0.00 -0.22 0.00 0.00 54.13 51.98 2w3r s LEU 50 Cb -0.06 -0.72 0.09 0.00 0.50 0.00 0.00 46.19 46.00 2w3r s LEU 50 CO -0.02 -0.39 0.35 -0.62 -1.32 0.00 0.00 176.35 174.35 2w3r s ASP 51 N 1.48 5.86 -0.16 3.68 2.15 0.05 -4.92 116.67 124.81 2w3r s ASP 51 Ca 0.12 -1.58 0.15 0.00 0.43 0.00 0.00 52.55 51.67 2w3r s ASP 51 Cb -0.19 -2.08 0.73 0.00 -0.30 0.00 0.00 42.92 41.09 2w3r s ASP 51 CO -0.21 -0.64 1.63 0.18 -0.17 0.00 0.00 175.17 175.95 2w3r n LEU 52 N 5.04 4.98 -0.09 -1.34 4.77 -1.26 -2.27 117.00 126.83 2w3r n LEU 52 Ca -0.11 -2.52 -0.10 0.00 -0.03 0.00 0.00 56.01 53.25 2w3r n LEU 52 Cb 0.42 -0.62 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 2w3r n LEU 52 CO 0.44 0.70 0.91 -0.08 -1.33 0.00 0.00 177.39 178.03 2w3r h GLU 53 N 3.84 0.43 0.00 3.23 4.57 -1.91 -1.56 114.58 123.18 2w3r h GLU 53 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2w3r h GLU 53 Cb 1.63 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 30.14 2w3r h GLU 53 CO 0.34 0.41 0.00 -1.35 -1.18 0.00 0.00 179.01 177.23 2w3r h PRO 54 N 0.34 0.00 0.11 0.92 0.11 -1.80 -1.94 132.00 129.74 2w3r h PRO 54 Ca 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 2w3r h PRO 54 Cb 0.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.24 2w3r h PRO 54 CO -0.01 0.00 -0.05 0.28 -0.21 0.00 0.00 178.00 178.00 2w3r h VAL 55 N 0.00 1.07 -0.54 3.15 2.07 -1.57 -2.91 116.25 117.53 2w3r h VAL 55 Ca 0.00 -1.20 0.03 0.00 0.82 0.00 0.00 66.70 66.35 2w3r h VAL 55 Cb 0.50 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 2w3r h VAL 55 CO 0.00 0.27 0.36 0.03 0.02 0.00 0.00 177.57 178.25 2w3r h ARG 56 N -0.76 0.62 -0.01 1.57 3.08 -1.14 -2.16 114.38 115.58 2w3r h ARG 56 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2w3r h ARG 56 Cb 0.55 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2w3r h ARG 56 CO 0.03 0.41 -0.09 0.39 -1.07 0.00 0.00 179.97 179.63 2w3r n GLU 57 N -4.47 1.07 -2.32 0.04 1.02 -0.74 -4.75 120.64 110.49 2w3r n GLU 57 Ca 0.06 -0.50 -0.38 0.00 -0.02 0.00 0.00 57.16 56.32 2w3r n GLU 57 Cb 0.13 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.04 2w3r n GLU 57 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2w3r s SER 58 N -2.27 6.57 0.32 1.62 0.15 -0.81 -4.95 113.70 114.32 2w3r s SER 58 Ca 0.33 2.32 -0.28 0.00 0.70 0.00 0.00 55.95 59.02 2w3r s SER 58 Cb 0.20 -2.61 -0.13 0.00 -1.71 0.00 0.00 66.02 61.77 2w3r s SER 58 CO 0.43 -0.64 1.12 -2.65 1.20 0.00 0.00 173.24 172.69 2w3r n PRO 59 N 0.11 1.65 -0.33 5.44 -0.02 -1.26 -2.89 135.00 137.70 2w3r n PRO 59 Ca 0.04 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2w3r n PRO 59 Cb 0.47 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2w3r n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w3r n GLY 60 N 1.04 1.58 3.69 -1.23 0.00 -1.26 -4.82 105.19 104.20 2w3r n GLY 60 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2w3r n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w3r s VAL 61 N -2.69 4.04 -0.21 1.61 1.01 -1.14 -0.41 120.40 122.60 2w3r s VAL 61 Ca 0.00 1.40 0.07 0.00 0.00 0.00 0.00 61.98 63.45 2w3r s VAL 61 Cb 0.00 -3.90 -0.17 0.00 0.00 0.00 0.00 36.38 32.31 2w3r s VAL 61 CO 0.00 0.02 -0.11 -0.38 0.00 0.00 0.00 175.10 174.62 2w3r n ILE 62 N 4.51 1.28 -3.83 2.22 2.08 0.26 -4.95 119.36 120.93 2w3r n ILE 62 Ca 0.11 -0.59 -0.12 0.00 0.56 0.00 0.00 62.75 62.72 2w3r n ILE 62 Cb 0.45 -1.04 -0.10 0.00 -0.75 0.00 0.00 39.64 38.20 2w3r n ILE 62 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2w3r s ALA 63 N -2.45 -0.50 -0.05 -1.39 0.00 -0.53 -5.01 121.76 111.83 2w3r s ALA 63 Ca -0.23 0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.83 2w3r s ALA 63 Cb 0.07 0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.26 2w3r s ALA 63 CO 0.60 -0.22 -0.13 0.08 0.00 0.00 0.00 175.76 176.08 2w3r s VAL 64 N -1.27 1.16 -0.01 0.00 1.01 -1.26 0.10 120.40 120.13 2w3r s VAL 64 Ca -0.13 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 61.39 2w3r s VAL 64 Cb -0.06 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 2w3r s VAL 64 CO 0.02 0.35 -0.23 -0.36 0.00 0.00 0.00 175.10 174.89 2w3r s PHE 65 N 0.39 2.05 0.23 5.22 0.40 0.14 -4.97 117.98 121.43 2w3r s PHE 65 Ca -0.09 -0.39 0.08 0.00 -0.60 0.00 0.00 56.93 55.93 2w3r s PHE 65 Cb -0.13 -1.31 -0.05 0.00 0.51 0.00 0.00 43.02 42.04 2w3r s PHE 65 CO 0.03 -0.02 -0.12 0.99 0.70 0.00 0.00 175.22 176.79 2w3r s THR 66 N -0.56 1.74 0.39 0.64 2.01 -1.26 -0.57 115.64 118.03 2w3r s THR 66 Ca 0.09 -2.20 0.19 0.00 0.31 0.00 0.00 61.69 60.08 2w3r s THR 66 Cb -0.09 -2.17 0.39 0.00 0.01 0.00 0.00 72.50 70.64 2w3r s THR 66 CO -0.01 -0.50 1.71 0.00 -0.69 0.00 0.00 174.62 175.13 2w3r h ALA 67 N 2.47 2.23 -0.41 7.40 0.00 -1.80 0.35 119.26 129.50 2w3r h ALA 67 Ca -0.39 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2w3r h ALA 67 Cb 1.23 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2w3r h ALA 67 CO 0.63 -0.74 0.21 0.00 0.00 0.00 0.00 179.25 179.35 2w3r h ALA 68 N 1.68 1.59 0.00 0.00 0.00 -1.96 -2.60 119.26 117.97 2w3r h ALA 68 Ca 0.68 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.51 2w3r h ALA 68 Cb 1.75 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2w3r h ALA 68 CO -0.41 0.34 0.00 -0.44 0.00 0.00 0.00 179.25 178.74 2w3r h ASP 69 N 0.58 0.00 -2.56 0.00 3.32 -0.69 -3.45 116.42 113.62 2w3r h ASP 69 Ca 0.15 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.66 2w3r h ASP 69 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2w3r h ASP 69 CO -0.02 0.00 1.11 -0.76 -1.72 0.00 0.00 179.24 177.85 2w3r s LEU 70 N -5.15 4.36 0.41 1.55 1.43 -0.98 -4.90 118.68 115.39 2w3r s LEU 70 Ca 0.06 2.39 0.09 0.00 -1.03 0.00 0.00 54.13 55.63 2w3r s LEU 70 Cb 0.09 -3.54 0.86 0.00 0.03 0.00 0.00 46.19 43.64 2w3r s LEU 70 CO 0.53 -0.95 2.00 1.55 0.23 0.00 0.00 176.35 179.70 2w3r h PRO 71 N 9.63 0.34 0.00 1.29 0.13 -1.87 -3.46 132.00 138.06 2w3r h PRO 71 Ca -0.42 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2w3r h PRO 71 Cb 1.20 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2w3r h PRO 71 CO 0.95 0.33 0.00 0.72 -0.23 0.00 0.00 178.00 179.77 2w3r n HIS 72 N -4.39 0.00 -1.68 1.56 8.25 -1.22 -5.00 115.22 112.74 2w3r n HIS 72 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2w3r n HIS 72 Cb 0.16 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.28 2w3r n HIS 72 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2w3r n ASP 73 N 0.00 2.33 -2.69 0.41 9.92 -1.13 -4.96 116.55 120.44 2w3r n ASP 73 Ca 0.00 1.11 -0.24 0.00 -0.53 0.00 0.00 54.79 55.13 2w3r n ASP 73 Cb 0.00 -1.47 -0.01 0.00 -0.64 0.00 0.00 41.12 39.00 2w3r n ASP 73 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2w3r n ASN 74 N 0.33 3.93 -3.79 -2.24 5.15 -1.26 -4.57 115.26 112.81 2w3r n ASN 74 Ca 0.07 -3.52 -0.18 0.00 -0.60 0.00 0.00 54.58 50.35 2w3r n ASN 74 Cb 0.39 -0.51 -0.16 0.00 -0.53 0.00 0.00 39.78 38.97 2w3r n ASN 74 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2w3r s ASP 75 N -3.39 0.59 -0.00 1.20 2.15 -1.26 -3.35 116.67 112.62 2w3r s ASP 75 Ca 0.45 -0.02 0.04 0.00 0.43 0.00 0.00 52.55 53.45 2w3r s ASP 75 Cb 0.37 -0.22 -0.05 0.00 -0.30 0.00 0.00 42.92 42.72 2w3r s ASP 75 CO -0.14 -0.13 0.13 0.00 -0.17 0.00 0.00 175.17 174.87 2w3r n ALA 76 N 4.36 2.38 -1.74 3.66 0.00 0.31 -4.88 120.51 124.61 2w3r n ALA 76 Ca -0.22 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.72 2w3r n ALA 76 Cb 0.50 -0.13 0.02 0.00 0.00 0.00 0.00 19.45 19.84 2w3r n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3r n SER 77 N -1.25 2.98 0.15 0.00 2.88 -1.26 -4.85 113.62 112.28 2w3r n SER 77 Ca 0.00 1.11 0.13 0.00 -1.33 0.00 0.00 58.87 58.78 2w3r n SER 77 Cb 0.07 -1.56 0.40 0.00 -0.75 0.00 0.00 64.21 62.37 2w3r n SER 77 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2w3r h PRO 78 N 2.16 0.00 -7.38 -1.46 0.13 -1.90 -3.46 132.00 120.08 2w3r h PRO 78 Ca -0.50 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.13 2w3r h PRO 78 Cb 1.28 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.50 2w3r h PRO 78 CO 0.60 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.76 2w3r s ALA 79 N -3.23 2.73 -0.28 -0.56 0.00 -1.24 -4.96 121.76 114.22 2w3r s ALA 79 Ca 0.08 -0.09 0.24 0.00 0.00 0.00 0.00 51.96 52.18 2w3r s ALA 79 Cb 0.10 -3.11 1.14 0.00 0.00 0.00 0.00 23.12 21.25 2w3r s ALA 79 CO 0.57 -1.18 1.73 -1.35 0.00 0.00 0.00 175.76 175.52 2w3r h PRO 80 N -0.69 0.00 -5.56 0.00 0.11 -1.92 -3.42 132.00 120.52 2w3r h PRO 80 Ca -0.45 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.07 2w3r h PRO 80 Cb 1.22 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.23 2w3r h PRO 80 CO 0.60 0.00 -0.12 -1.54 -0.21 0.00 0.00 178.00 176.72 2w3r s SER 81 N -4.25 6.55 0.58 -2.05 1.04 -1.26 -5.06 113.70 109.26 2w3r s SER 81 Ca 0.01 0.66 -0.20 0.00 0.48 0.00 0.00 55.95 56.90 2w3r s SER 81 Cb 0.08 -2.27 -0.04 0.00 0.10 0.00 0.00 66.02 63.89 2w3r s SER 81 CO 0.31 -0.09 1.26 -2.16 0.98 0.00 0.00 173.24 173.54 2w3r s PRO 82 N 1.22 3.00 -0.14 4.02 0.04 -1.26 -4.72 135.00 137.17 2w3r s PRO 82 Ca 0.23 1.97 -0.04 0.00 0.04 0.00 0.00 61.00 63.20 2w3r s PRO 82 Cb -0.15 -2.04 0.05 0.00 0.04 0.00 0.00 34.50 32.41 2w3r s PRO 82 CO 0.09 -1.22 0.07 -2.00 0.04 0.00 0.00 177.00 173.98 2w3r s GLU 83 N -3.18 0.10 0.37 4.56 2.12 -1.26 -4.94 118.70 116.47 2w3r s GLU 83 Ca 0.76 0.01 -0.28 0.00 0.36 0.00 0.00 54.97 55.82 2w3r s GLU 83 Cb -0.34 -1.50 -0.10 0.00 0.26 0.00 0.00 34.13 32.45 2w3r s GLU 83 CO 0.38 -0.57 1.35 -1.25 -0.54 0.00 0.00 175.26 174.63 2w3r s PRO 84 N 2.12 4.15 0.01 4.30 0.04 -1.23 -0.53 135.00 143.86 2w3r s PRO 84 Ca 0.03 2.29 -0.19 0.00 0.04 0.00 0.00 61.00 63.16 2w3r s PRO 84 Cb -0.15 -2.93 -0.24 0.00 0.04 0.00 0.00 34.50 31.22 2w3r s PRO 84 CO -0.07 -0.38 1.10 0.28 0.04 0.00 0.00 177.00 177.96 2w3r h VAL 85 N 2.81 1.42 -3.83 -0.36 2.07 -1.89 -3.44 116.25 113.03 2w3r h VAL 85 Ca -0.50 -2.11 -0.68 0.00 0.82 0.00 0.00 66.70 64.23 2w3r h VAL 85 Cb 1.24 2.60 -0.25 0.00 -1.52 0.00 0.00 31.29 33.36 2w3r h VAL 85 CO 0.64 0.62 -0.78 -0.76 0.02 0.00 0.00 177.57 177.31 2w3r s LEU 86 N -8.30 2.68 0.22 2.57 1.43 -1.26 -4.61 118.68 111.42 2w3r s LEU 86 Ca -0.13 -0.26 -0.31 0.00 -1.03 0.00 0.00 54.13 52.40 2w3r s LEU 86 Cb 0.04 -1.56 -0.14 0.00 0.03 0.00 0.00 46.19 44.56 2w3r s LEU 86 CO 0.83 0.29 1.27 0.00 0.23 0.00 0.00 176.35 178.96 2w3r n ALA 87 N 2.71 0.27 -3.59 4.21 0.00 -0.05 -4.72 120.51 119.34 2w3r n ALA 87 Ca -0.17 0.43 -0.38 0.00 0.00 0.00 0.00 53.44 53.31 2w3r n ALA 87 Cb 0.52 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.77 2w3r n ALA 87 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3r s THR 88 N -0.27 4.65 0.00 0.00 -4.23 -1.26 -4.54 115.64 109.99 2w3r s THR 88 Ca 0.68 -3.79 0.00 0.00 -1.18 0.00 0.00 61.69 57.41 2w3r s THR 88 Cb -0.73 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 69.25 2w3r s THR 88 CO 0.52 -1.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 2w3r n GLY 89 N 2.40 2.61 3.29 3.99 0.00 -1.26 -4.92 105.19 111.30 2w3r n GLY 89 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 2w3r n GLY 89 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2w3r s GLU 90 N 0.00 0.74 0.06 1.61 -1.05 -1.26 0.08 118.70 118.88 2w3r s GLU 90 Ca 0.00 -0.11 0.06 0.00 -0.15 0.00 0.00 54.97 54.77 2w3r s GLU 90 Cb 0.00 0.33 -0.04 0.00 -0.44 0.00 0.00 34.13 33.99 2w3r s GLU 90 CO 0.00 -0.21 -0.10 0.14 0.95 0.00 0.00 175.26 176.04 2w3r s VAL 91 N -1.30 3.38 0.00 1.83 -7.23 0.21 -4.84 120.40 112.45 2w3r s VAL 91 Ca -0.13 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2w3r s VAL 91 Cb -0.04 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2w3r s VAL 91 CO 0.05 0.24 0.37 1.41 -0.31 0.00 0.00 175.10 176.85 2w3r n HIS 92 N 1.10 0.00 -3.52 2.82 -0.00 -1.26 -2.44 115.22 111.92 2w3r n HIS 92 Ca -0.14 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.50 2w3r n HIS 92 Cb 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.49 2w3r n HIS 92 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 2w3r s PHE 93 N -0.15 -0.31 -0.50 4.41 -0.12 -1.02 -4.17 117.98 116.12 2w3r s PHE 93 Ca 0.00 0.19 -0.28 0.00 -0.05 0.00 0.00 56.93 56.79 2w3r s PHE 93 Cb 0.00 0.54 -0.00 0.00 -0.63 0.00 0.00 43.02 42.93 2w3r s PHE 93 CO 0.00 -0.50 1.59 0.08 -0.05 0.00 0.00 175.22 176.34 2w3r s VAL 94 N -3.02 3.65 0.00 -2.49 1.01 -1.20 -2.56 120.40 115.78 2w3r s VAL 94 Ca 0.06 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2w3r s VAL 94 Cb -0.01 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.23 2w3r s VAL 94 CO -0.08 -0.90 0.00 0.61 0.00 0.00 0.00 175.10 174.72 2w3r n GLY 95 N 5.36 0.58 3.68 4.51 0.00 0.40 -4.82 105.19 114.90 2w3r n GLY 95 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2w3r n GLY 95 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3r s GLN 96 N 0.00 4.18 0.08 1.61 0.74 -1.06 -4.39 119.66 120.82 2w3r s GLN 96 Ca 0.00 2.35 -0.31 0.00 0.05 0.00 0.00 55.36 57.46 2w3r s GLN 96 Cb 0.00 -3.77 -0.09 0.00 1.10 0.00 0.00 33.01 30.25 2w3r s GLN 96 CO 0.00 -0.80 1.87 -2.14 -0.55 0.00 0.00 175.29 173.67 2w3r s PRO 97 N 3.22 4.14 -0.25 1.67 0.02 -1.26 -0.29 135.00 142.26 2w3r s PRO 97 Ca 0.76 2.57 -0.03 0.00 0.02 0.00 0.00 61.00 64.32 2w3r s PRO 97 Cb -0.39 -3.85 -0.14 0.00 0.02 0.00 0.00 34.50 30.14 2w3r s PRO 97 CO 0.33 -0.88 -0.25 -0.89 -0.33 0.00 0.00 177.00 174.97 2w3r n ILE 98 N 5.10 1.39 -4.14 2.83 5.41 0.10 -0.87 119.36 129.18 2w3r n ILE 98 Ca 0.18 -0.47 -0.09 0.00 1.00 0.00 0.00 62.75 63.37 2w3r n ILE 98 Cb 0.40 -1.52 -0.10 0.00 -0.71 0.00 0.00 39.64 37.71 2w3r n ILE 98 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2w3r s PHE 99 N -2.48 0.77 -0.04 1.39 -0.12 -1.19 -3.97 117.98 112.34 2w3r s PHE 99 Ca -0.34 -0.98 0.03 0.00 -0.05 0.00 0.00 56.93 55.60 2w3r s PHE 99 Cb 0.10 -0.48 -0.03 0.00 -0.63 0.00 0.00 43.02 41.99 2w3r s PHE 99 CO 0.52 -0.24 -0.13 -1.17 -0.05 0.00 0.00 175.22 174.15 2w3r s LEU 100 N -3.00 2.81 -0.13 -1.99 2.96 0.27 -0.47 118.68 119.13 2w3r s LEU 100 Ca 0.11 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 2w3r s LEU 100 Cb 0.06 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.16 2w3r s LEU 100 CO -0.06 0.34 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.44 2w3r s VAL 101 N -0.77 2.60 -0.36 1.68 1.01 -0.35 0.25 120.40 124.45 2w3r s VAL 101 Ca 0.12 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 2w3r s VAL 101 Cb -0.11 -2.06 0.06 0.00 0.00 0.00 0.00 36.38 34.28 2w3r s VAL 101 CO 0.01 0.54 0.14 0.00 0.00 0.00 0.00 175.10 175.79 2w3r s ALA 102 N 0.46 3.09 0.21 5.51 0.00 0.12 -2.29 121.76 128.85 2w3r s ALA 102 Ca -0.12 -1.98 0.07 0.00 0.00 0.00 0.00 51.96 49.93 2w3r s ALA 102 Cb -0.16 -2.33 -0.05 0.00 0.00 0.00 0.00 23.12 20.57 2w3r s ALA 102 CO 0.05 -1.48 -0.12 0.00 0.00 0.00 0.00 175.76 174.21 2w3r s ALA 103 N 1.34 2.03 -1.44 0.00 0.00 -0.32 0.91 121.76 124.28 2w3r s ALA 103 Ca 0.01 -1.70 0.16 0.00 0.00 0.00 0.00 51.96 50.43 2w3r s ALA 103 Cb -0.21 -0.01 0.79 0.00 0.00 0.00 0.00 23.12 23.70 2w3r s ALA 103 CO 0.01 0.02 1.44 0.25 0.00 0.00 0.00 175.76 177.48 2w3r n THR 104 N -0.41 0.54 -3.77 0.00 -2.24 0.45 -0.19 114.28 108.66 2w3r n THR 104 Ca -0.08 0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.74 2w3r n THR 104 Cb 0.61 -0.88 -0.07 0.00 -2.10 0.00 0.00 70.33 67.90 2w3r n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2w3r s SER 105 N -2.56 -0.04 0.21 3.42 1.04 -1.26 -4.76 113.70 109.74 2w3r s SER 105 Ca 0.15 -0.44 -0.11 0.00 0.48 0.00 0.00 55.95 56.03 2w3r s SER 105 Cb 0.11 0.38 0.15 0.00 0.10 0.00 0.00 66.02 66.75 2w3r s SER 105 CO 0.24 -0.73 1.88 -0.74 0.98 0.00 0.00 173.24 174.86 2w3r h HIS 106 N 2.77 0.93 0.47 5.02 2.76 -1.88 -2.12 115.15 123.09 2w3r h HIS 106 Ca -0.33 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 57.83 2w3r h HIS 106 Cb 1.22 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.87 2w3r h HIS 106 CO 0.41 0.59 -0.22 0.00 -1.30 0.00 0.00 177.93 177.40 2w3r h ARG 107 N 1.00 -0.60 -0.52 5.26 2.47 -1.97 -2.63 114.38 117.38 2w3r h ARG 107 Ca 0.27 0.04 0.10 0.00 -1.26 0.00 0.00 59.98 59.13 2w3r h ARG 107 Cb -0.11 0.14 -0.11 0.00 -1.65 0.00 0.00 29.97 28.24 2w3r h ARG 107 CO -0.06 -0.37 -0.24 0.00 0.56 0.00 0.00 179.97 179.86 2w3r h ALA 108 N -0.17 0.13 -0.31 0.04 0.00 -1.85 0.97 119.26 118.08 2w3r h ALA 108 Ca -0.06 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2w3r h ALA 108 Cb 0.51 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2w3r h ALA 108 CO 0.10 -0.57 0.13 0.00 0.00 0.00 0.00 179.25 178.91 2w3r h ALA 109 N 1.21 0.36 -0.32 0.00 0.00 -1.41 0.19 119.26 119.29 2w3r h ALA 109 Ca 0.24 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.21 2w3r h ALA 109 Cb 0.49 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2w3r h ALA 109 CO -0.60 -0.26 0.08 0.00 0.00 0.00 0.00 179.25 178.47 2w3r h ARG 110 N 0.28 0.20 -0.29 0.00 2.47 -0.89 -0.71 114.38 115.43 2w3r h ARG 110 Ca 0.13 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2w3r h ARG 110 Cb 0.07 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 2w3r h ARG 110 CO -0.11 0.13 0.19 0.82 0.56 0.00 0.00 179.97 181.55 2w3r h ILE 111 N 0.20 1.09 0.00 2.04 2.04 -0.53 -2.83 117.51 119.51 2w3r h ILE 111 Ca 0.15 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 2w3r h ILE 111 Cb 0.15 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2w3r h ILE 111 CO -0.18 0.09 -0.16 0.00 0.00 0.00 0.00 178.15 177.89 2w3r h ALA 112 N 1.09 1.49 0.00 1.87 0.00 -0.57 -2.88 119.26 120.26 2w3r h ALA 112 Ca 0.11 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 112 Cb -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2w3r h ALA 112 CO -0.02 0.20 -0.26 0.00 0.00 0.00 0.00 179.25 179.17 2w3r h ALA 113 N 1.84 1.42 0.00 0.00 0.00 -0.87 -2.86 119.26 118.78 2w3r h ALA 113 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2w3r h ALA 113 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2w3r h ALA 113 CO 0.02 0.32 -0.62 0.54 0.00 0.00 0.00 179.25 179.52 2w3r n ARG 114 N -4.01 0.26 -0.09 0.00 1.74 -1.09 -4.04 116.66 109.43 2w3r n ARG 114 Ca -0.02 0.07 -0.01 0.00 -0.77 0.00 0.00 57.85 57.13 2w3r n ARG 114 Cb 0.33 -1.66 0.02 0.00 -1.02 0.00 0.00 32.46 30.13 2w3r n ARG 114 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2w3r n LYS 115 N -2.03 1.21 -2.82 5.56 5.02 -1.08 -4.90 118.16 119.11 2w3r n LYS 115 Ca 0.03 -0.26 -0.34 0.00 -2.02 0.00 0.00 58.31 55.73 2w3r n LYS 115 Cb 0.43 -1.32 -0.07 0.00 -0.02 0.00 0.00 35.03 34.05 2w3r n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2w3r s ALA 116 N -0.68 3.08 -0.43 7.82 0.00 -1.26 -3.85 121.76 126.45 2w3r s ALA 116 Ca 0.05 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.45 2w3r s ALA 116 Cb 0.04 -3.15 0.12 0.00 0.00 0.00 0.00 23.12 20.13 2w3r s ALA 116 CO 0.01 0.15 0.17 1.03 0.00 0.00 0.00 175.76 177.12 2w3r s ARG 117 N -2.94 1.81 -0.10 0.00 0.52 -0.96 -5.04 118.95 112.24 2w3r s ARG 117 Ca 0.59 -2.17 0.04 0.00 -0.52 0.00 0.00 55.73 53.67 2w3r s ARG 117 Cb -0.11 -3.35 -0.00 0.00 0.52 0.00 0.00 34.95 32.01 2w3r s ARG 117 CO 0.15 -1.03 -0.22 0.42 0.02 0.00 0.00 175.30 174.64 2w3r s ILE 118 N 0.46 2.23 -0.08 1.52 1.01 -1.26 -0.77 121.20 124.31 2w3r s ILE 118 Ca 0.13 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.82 2w3r s ILE 118 Cb -0.22 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.37 2w3r s ILE 118 CO -0.05 0.56 -0.08 0.42 0.00 0.00 0.00 174.94 175.79 2w3r s THR 119 N 0.25 3.59 0.18 2.92 -4.23 -0.34 -4.97 115.64 113.04 2w3r s THR 119 Ca -0.15 -0.51 0.11 0.00 -1.18 0.00 0.00 61.69 59.96 2w3r s THR 119 Cb -0.17 -2.47 -0.04 0.00 1.34 0.00 0.00 72.50 71.16 2w3r s THR 119 CO 0.08 0.58 -0.24 -0.31 -0.54 0.00 0.00 174.62 174.19 2w3r s TYR 120 N -0.59 2.32 -0.88 3.99 1.51 -1.26 -0.71 117.35 121.73 2w3r s TYR 120 Ca 0.09 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.77 2w3r s TYR 120 Cb -0.12 -1.18 0.22 0.00 -0.11 0.00 0.00 41.96 40.77 2w3r s TYR 120 CO 0.02 0.46 0.76 0.00 -1.11 0.00 0.00 175.55 175.68 2w3r s ALA 121 N -1.51 4.21 0.29 3.71 0.00 0.11 -4.83 121.76 123.74 2w3r s ALA 121 Ca 0.19 -3.78 -0.30 0.00 0.00 0.00 0.00 51.96 48.07 2w3r s ALA 121 Cb -0.09 -2.85 -0.12 0.00 0.00 0.00 0.00 23.12 20.06 2w3r s ALA 121 CO 0.09 -2.15 1.43 -2.30 0.00 0.00 0.00 175.76 172.83 2w3r n PRO 122 N 2.47 2.27 -4.25 0.00 -0.02 -1.26 -2.32 135.00 131.89 2w3r n PRO 122 Ca 0.20 0.80 -0.24 0.00 -2.02 0.00 0.00 63.50 62.25 2w3r n PRO 122 Cb 0.37 -2.47 -0.08 0.00 -0.02 0.00 0.00 33.50 31.30 2w3r n PRO 122 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2w3r s ARG 123 N -0.96 2.20 0.22 -0.52 0.52 0.12 -4.92 118.95 115.60 2w3r s ARG 123 Ca 0.63 -1.67 -0.31 0.00 -0.52 0.00 0.00 55.73 53.86 2w3r s ARG 123 Cb -0.58 -2.03 -0.10 0.00 0.52 0.00 0.00 34.95 32.77 2w3r s ARG 123 CO 0.54 0.13 1.49 -2.14 0.02 0.00 0.00 175.30 175.34 2w3r s PRO 124 N -3.77 4.24 0.59 3.54 0.02 -1.26 -4.59 135.00 133.78 2w3r s PRO 124 Ca 0.36 2.33 -0.09 0.00 0.02 0.00 0.00 61.00 63.62 2w3r s PRO 124 Cb -0.01 -3.12 -0.02 0.00 0.02 0.00 0.00 34.50 31.37 2w3r s PRO 124 CO 0.21 -0.50 0.95 0.00 -0.33 0.00 0.00 177.00 177.33 2w3r s ALA 125 N 0.42 3.18 -0.39 -1.55 0.00 -1.26 -4.88 121.76 117.28 2w3r s ALA 125 Ca 0.63 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 52.25 2w3r s ALA 125 Cb -0.43 -2.85 0.11 0.00 0.00 0.00 0.00 23.12 19.96 2w3r s ALA 125 CO 0.39 -0.70 0.15 0.42 0.00 0.00 0.00 175.76 176.02 2w3r s ILE 126 N -3.06 1.78 -0.18 0.00 1.01 -1.26 -4.99 121.20 114.50 2w3r s ILE 126 Ca 0.53 -2.36 -0.04 0.00 0.00 0.00 0.00 60.65 58.78 2w3r s ILE 126 Cb -0.11 -2.29 -0.10 0.00 0.01 0.00 0.00 42.46 39.98 2w3r s ILE 126 CO 0.49 -0.73 -0.20 0.18 0.00 0.00 0.00 174.94 174.68 2w3r n LEU 127 N 3.99 2.08 -4.93 2.97 4.77 -1.26 0.34 117.00 124.97 2w3r n LEU 127 Ca 0.04 0.08 -0.26 0.00 -0.03 0.00 0.00 56.01 55.84 2w3r n LEU 127 Cb 0.38 -0.57 0.03 0.00 -2.33 0.00 0.00 43.42 40.93 2w3r n LEU 127 CO 0.22 0.57 0.50 0.42 -1.33 0.00 0.00 177.39 177.78 2w3r s THR 128 N -2.34 3.44 0.22 -5.08 -4.23 -1.26 -4.87 115.64 101.51 2w3r s THR 128 Ca -0.25 -0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.13 2w3r s THR 128 Cb 0.08 -3.36 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 2w3r s THR 128 CO 0.36 -0.35 1.55 -0.07 -0.54 0.00 0.00 174.62 175.57 2w3r h LEU 129 N -0.15 0.45 -0.93 4.79 4.07 -1.98 -3.13 115.31 118.44 2w3r h LEU 129 Ca -0.45 -0.24 -0.02 0.00 0.08 0.00 0.00 57.88 57.25 2w3r h LEU 129 Cb 1.27 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.84 2w3r h LEU 129 CO 0.60 0.91 0.43 0.44 -1.08 0.00 0.00 178.44 179.74 2w3r h ASP 130 N 0.31 1.08 0.00 -0.43 3.32 -1.98 0.78 116.42 119.51 2w3r h ASP 130 Ca 0.01 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2w3r h ASP 130 Cb 1.06 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2w3r h ASP 130 CO 0.09 0.89 -0.00 1.56 -1.72 0.00 0.00 179.24 180.06 2w3r h GLN 131 N 1.20 -0.00 -0.69 3.56 4.20 -1.96 0.81 115.11 122.22 2w3r h GLN 131 Ca 0.29 0.00 0.02 0.00 0.06 0.00 0.00 58.65 59.03 2w3r h GLN 131 Cb 0.07 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2w3r h GLN 131 CO -0.04 0.12 0.44 0.00 -0.67 0.00 0.00 178.83 178.68 2w3r h ALA 132 N 0.87 0.89 -0.53 3.87 0.00 -1.45 0.37 119.26 123.28 2w3r h ALA 132 Ca -0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2w3r h ALA 132 Cb 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2w3r h ALA 132 CO 0.00 0.22 -0.00 1.25 0.00 0.00 0.00 179.25 180.72 2w3r h LEU 133 N 0.86 0.88 -0.04 0.00 5.85 -0.68 0.84 115.31 123.02 2w3r h LEU 133 Ca 0.27 -0.23 -0.15 0.00 0.84 0.00 0.00 57.88 58.61 2w3r h LEU 133 Cb -0.01 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 40.80 2w3r h LEU 133 CO -0.10 0.94 -0.55 0.00 -0.34 0.00 0.00 178.44 178.39 2w3r h ALA 134 N 1.15 0.12 -0.01 1.25 0.00 -0.43 -3.26 119.26 118.09 2w3r h ALA 134 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2w3r h ALA 134 Cb 0.50 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2w3r h ALA 134 CO 0.02 0.35 -0.04 0.00 0.00 0.00 0.00 179.25 179.58 2w3r n ALA 135 N -2.57 2.68 -3.35 0.00 0.00 0.13 -4.93 120.51 112.47 2w3r n ALA 135 Ca -0.09 -0.34 -0.21 0.00 0.00 0.00 0.00 53.44 52.81 2w3r n ALA 135 Cb 0.64 -1.30 0.06 0.00 0.00 0.00 0.00 19.45 18.85 2w3r n ALA 135 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2w3r n ASP 136 N -0.46 -5.78 -4.49 0.00 2.03 0.16 -4.95 116.55 103.07 2w3r n ASP 136 Ca 0.19 -0.43 -0.43 0.00 0.52 0.00 0.00 54.79 54.65 2w3r n ASP 136 Cb 0.27 -4.43 -0.03 0.00 -0.72 0.00 0.00 41.12 36.21 2w3r n ASP 136 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2w3r s SER 137 N -3.17 6.39 0.32 1.67 0.15 0.24 -4.95 113.70 114.34 2w3r s SER 137 Ca 0.46 -1.34 -0.03 0.00 0.70 0.00 0.00 55.95 55.74 2w3r s SER 137 Cb -0.20 -2.47 -0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2w3r s SER 137 CO 0.57 -1.40 0.43 0.00 1.20 0.00 0.00 173.24 174.05 2w3r s ARG 138 N 4.08 1.80 0.31 5.44 1.70 -1.26 -0.03 118.95 130.99 2w3r s ARG 138 Ca 0.33 -1.70 0.10 0.00 -0.47 0.00 0.00 55.73 54.00 2w3r s ARG 138 Cb -0.08 0.43 -0.05 0.00 -0.57 0.00 0.00 34.95 34.67 2w3r s ARG 138 CO 0.00 -0.73 -0.11 -0.06 -1.08 0.00 0.00 175.30 173.32 2w3r s PHE 139 N -3.30 2.42 -0.25 5.89 0.40 0.15 -4.51 117.98 118.78 2w3r s PHE 139 Ca 0.31 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 56.25 2w3r s PHE 139 Cb 0.00 -1.22 0.00 0.00 0.51 0.00 0.00 43.02 42.32 2w3r s PHE 139 CO 0.19 0.63 0.00 0.39 0.70 0.00 0.00 175.22 177.12 2w3r n GLU 140 N -0.76 -0.92 -3.30 0.44 1.02 -1.26 -4.17 120.64 111.69 2w3r n GLU 140 Ca -0.05 0.39 -0.10 0.00 -0.02 0.00 0.00 57.16 57.38 2w3r n GLU 140 Cb 0.61 -4.16 0.00 0.00 -0.02 0.00 0.00 31.44 27.87 2w3r n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3r n GLY 141 N -1.20 -1.22 0.00 0.62 0.00 -1.26 -4.84 105.19 97.28 2w3r n GLY 141 Ca -0.02 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.59 2w3r n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 142 N -1.57 2.04 3.79 -0.02 0.00 -1.26 -5.05 105.19 103.11 2w3r n GLY 142 Ca -0.10 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 43.69 2w3r n GLY 142 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w3r s PRO 143 N -2.74 2.21 -0.20 1.61 0.04 -1.26 -4.88 135.00 129.77 2w3r s PRO 143 Ca 0.00 0.80 -0.09 0.00 0.04 0.00 0.00 61.00 61.75 2w3r s PRO 143 Cb 0.00 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 2w3r s PRO 143 CO 0.00 -1.57 0.12 0.08 0.04 0.00 0.00 177.00 175.66 2w3r s VAL 144 N -3.07 5.25 -0.11 -0.36 1.01 -0.57 -4.92 120.40 117.62 2w3r s VAL 144 Ca 0.60 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.74 2w3r s VAL 144 Cb -0.15 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.84 2w3r s VAL 144 CO 0.55 0.43 -0.16 -0.63 0.00 0.00 0.00 175.10 175.29 2w3r s ILE 145 N 0.50 1.54 0.06 2.22 1.01 -1.26 -0.03 121.20 125.24 2w3r s ILE 145 Ca 0.07 -0.67 0.09 0.00 0.00 0.00 0.00 60.65 60.14 2w3r s ILE 145 Cb -0.12 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 2w3r s ILE 145 CO -0.00 0.45 -0.26 0.26 0.00 0.00 0.00 174.94 175.39 2w3r s TRP 146 N 0.95 2.35 -0.07 3.97 0.51 -0.79 -4.95 118.94 120.90 2w3r s TRP 146 Ca -0.07 -0.39 -0.08 0.00 -2.12 0.00 0.00 56.10 53.44 2w3r s TRP 146 Cb -0.15 -1.38 0.02 0.00 -0.81 0.00 0.00 33.47 31.15 2w3r s TRP 146 CO -0.01 0.17 0.21 0.00 -0.51 0.00 0.00 176.95 176.81 2w3r s ALA 147 N -0.86 -0.51 -0.13 0.98 0.00 -1.26 -1.27 121.76 118.70 2w3r s ALA 147 Ca 0.12 0.54 -0.00 0.00 0.00 0.00 0.00 51.96 52.62 2w3r s ALA 147 Cb -0.10 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.74 2w3r s ALA 147 CO 0.03 -0.11 -0.08 0.50 0.00 0.00 0.00 175.76 176.09 2w3r s ARG 148 N -0.03 1.67 3.52 0.00 3.52 0.83 -4.99 118.95 123.47 2w3r s ARG 148 Ca -0.01 -0.39 0.00 0.00 -0.13 0.00 0.00 55.73 55.19 2w3r s ARG 148 Cb -0.02 -1.81 0.00 0.00 -1.56 0.00 0.00 34.95 31.56 2w3r s ARG 148 CO 0.00 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 2w3r n GLY 149 N 4.89 0.23 2.71 8.12 0.00 -1.26 -0.74 105.19 119.14 2w3r n GLY 149 Ca -0.13 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 2w3r n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w3r s ASP 150 N -4.00 3.86 0.18 1.61 -1.08 -1.26 -4.88 116.67 111.10 2w3r s ASP 150 Ca 0.00 -1.97 -0.14 0.00 -0.52 0.00 0.00 52.55 49.93 2w3r s ASP 150 Cb 0.00 -0.89 0.07 0.00 -1.46 0.00 0.00 42.92 40.64 2w3r s ASP 150 CO 0.00 -0.37 1.84 -0.37 0.52 0.00 0.00 175.17 176.80 2w3r h VAL 151 N 6.04 1.14 -0.81 1.11 -1.51 -1.87 -2.70 116.25 117.66 2w3r h VAL 151 Ca -0.09 -0.25 -0.03 0.00 -1.23 0.00 0.00 66.70 65.10 2w3r h VAL 151 Cb 0.99 0.33 -0.04 0.00 -2.13 0.00 0.00 31.29 30.44 2w3r h VAL 151 CO 0.46 0.14 0.40 -0.08 -1.23 0.00 0.00 177.57 177.25 2w3r h GLU 152 N 0.74 1.15 -0.17 5.19 4.57 -1.98 0.12 114.58 124.20 2w3r h GLU 152 Ca 0.20 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 2w3r h GLU 152 Cb -0.08 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.29 2w3r h GLU 152 CO -0.04 0.88 0.01 1.15 -1.18 0.00 0.00 179.01 179.83 2w3r h THR 153 N 1.14 1.25 -0.62 0.32 2.02 -1.98 -1.90 112.91 113.14 2w3r h THR 153 Ca 0.28 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 2w3r h THR 153 Cb 0.10 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 2w3r h THR 153 CO -0.04 0.25 0.32 0.00 0.37 0.00 0.00 175.52 176.42 2w3r h ALA 154 N 0.78 0.79 0.00 6.16 0.00 -1.14 -2.78 119.26 123.07 2w3r h ALA 154 Ca 0.05 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2w3r h ALA 154 Cb 0.37 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2w3r h ALA 154 CO 0.01 0.33 -0.43 -0.07 0.00 0.00 0.00 179.25 179.10 2w3r h LEU 155 N 0.84 0.00 -0.75 0.00 3.38 -0.98 -3.03 115.31 114.77 2w3r h LEU 155 Ca 0.21 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 2w3r h LEU 155 Cb 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2w3r h LEU 155 CO -0.03 0.43 0.29 0.00 0.09 0.00 0.00 178.44 179.22 2w3r h ALA 156 N 1.57 0.98 -1.08 1.53 0.00 -1.06 -3.15 119.26 118.05 2w3r h ALA 156 Ca -0.00 -0.19 -0.64 0.00 0.00 0.00 0.00 54.91 54.07 2w3r h ALA 156 Cb 0.89 -0.29 -0.36 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 156 CO 0.06 0.61 0.05 0.41 0.00 0.00 0.00 179.25 180.37 2w3r n GLY 157 N -0.85 5.96 3.59 0.00 0.00 -1.17 -5.02 105.19 107.71 2w3r n GLY 157 Ca 0.06 -2.57 -0.39 0.00 0.00 0.00 0.00 46.02 43.12 2w3r n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s ALA 158 N -3.75 3.55 0.45 4.61 0.00 -1.15 -4.96 121.76 120.49 2w3r s ALA 158 Ca 0.54 -0.89 0.19 0.00 0.00 0.00 0.00 51.96 51.80 2w3r s ALA 158 Cb 0.44 -2.74 1.15 0.00 0.00 0.00 0.00 23.12 21.97 2w3r s ALA 158 CO -0.15 -0.74 1.90 0.00 0.00 0.00 0.00 175.76 176.77 2w3r h ALA 159 N 8.23 2.27 -3.15 0.00 0.00 -1.81 -3.41 119.26 121.40 2w3r h ALA 159 Ca -0.31 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.41 2w3r h ALA 159 Cb 1.16 -0.02 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 2w3r h ALA 159 CO 0.65 -0.51 -0.71 -1.01 0.00 0.00 0.00 179.25 177.68 2w3r s HIS 160 N -5.33 0.26 -0.15 0.00 3.76 -1.11 -4.91 115.29 107.81 2w3r s HIS 160 Ca -0.07 -0.42 -0.13 0.00 -0.15 0.00 0.00 55.06 54.29 2w3r s HIS 160 Cb 0.22 -0.18 0.04 0.00 1.11 0.00 0.00 32.58 33.77 2w3r s HIS 160 CO 0.77 -0.14 0.40 -1.17 -0.85 0.00 0.00 174.74 173.75 2w3r s LEU 161 N -1.18 0.35 -0.08 0.89 0.20 -1.26 -0.08 118.68 117.52 2w3r s LEU 161 Ca -0.12 0.82 0.01 0.00 0.69 0.00 0.00 54.13 55.53 2w3r s LEU 161 Cb -0.08 1.36 0.02 0.00 -0.43 0.00 0.00 46.19 47.06 2w3r s LEU 161 CO -0.01 -0.15 -0.09 0.00 -0.29 0.00 0.00 176.35 175.81 2w3r s ALA 162 N 0.48 1.16 0.21 5.97 0.00 -0.14 -5.00 121.76 124.44 2w3r s ALA 162 Ca -0.02 -0.38 0.07 0.00 0.00 0.00 0.00 51.96 51.62 2w3r s ALA 162 Cb -0.04 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 2w3r s ALA 162 CO -0.02 -0.08 0.11 -1.21 0.00 0.00 0.00 175.76 174.55 2w3r s GLU 163 N 1.06 2.73 0.00 0.00 2.02 -1.26 -1.46 118.70 121.78 2w3r s GLU 163 Ca -0.08 -1.04 0.00 0.00 0.02 0.00 0.00 54.97 53.87 2w3r s GLU 163 Cb -0.14 -2.50 0.00 0.00 0.10 0.00 0.00 34.13 31.58 2w3r s GLU 163 CO -0.01 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.12 2w3r n GLY 164 N -0.63 -0.04 3.64 -1.39 0.00 -0.91 -5.02 105.19 100.84 2w3r n GLY 164 Ca -0.08 -0.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.91 2w3r n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s PHE 166 N 1.43 0.15 0.09 0.00 -0.00 -1.00 -5.02 117.98 113.63 2w3r s PHE 166 Ca -0.09 -0.52 -0.13 0.00 -0.00 0.00 0.00 56.93 56.19 2w3r s PHE 166 Cb -0.04 -0.07 -0.06 0.00 -0.00 0.00 0.00 43.02 42.84 2w3r s PHE 166 CO -0.16 -0.49 0.47 -1.21 -0.00 0.00 0.00 175.22 173.82 2w3r s GLU 167 N -3.44 3.91 -0.17 1.99 0.41 -1.26 -2.19 118.70 117.94 2w3r s GLU 167 Ca 0.02 0.39 0.00 0.00 -0.41 0.00 0.00 54.97 54.97 2w3r s GLU 167 Cb 0.03 -3.04 0.04 0.00 -1.78 0.00 0.00 34.13 29.38 2w3r s GLU 167 CO -0.09 0.56 -0.09 0.42 -0.49 0.00 0.00 175.26 175.57 2w3r s ILE 168 N -1.33 1.41 0.90 -1.63 1.01 0.10 -1.69 121.20 119.97 2w3r s ILE 168 Ca 0.32 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 2w3r s ILE 168 Cb -0.15 -1.47 0.13 0.00 0.01 0.00 0.00 42.46 40.97 2w3r s ILE 168 CO 0.18 0.24 1.11 -0.83 0.00 0.00 0.00 174.94 175.63 2w3r s GLY 169 N 1.52 1.59 0.00 6.18 0.00 -0.78 -1.02 107.32 114.82 2w3r s GLY 169 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.39 2w3r s GLY 169 CO -0.09 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.81 2w3r n GLY 170 N -1.79 -0.93 3.55 0.20 0.00 -1.26 -4.63 105.19 100.33 2w3r n GLY 170 Ca 0.06 -1.48 -0.01 0.00 0.00 0.00 0.00 46.02 44.59 2w3r n GLY 170 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3r s GLN 171 N 0.00 0.40 -0.09 1.61 0.74 -1.25 -4.75 119.66 116.32 2w3r s GLN 171 Ca 0.00 0.84 -0.23 0.00 0.05 0.00 0.00 55.36 56.01 2w3r s GLN 171 Cb 0.00 0.31 -0.03 0.00 1.10 0.00 0.00 33.01 34.39 2w3r s GLN 171 CO 0.00 -0.11 0.71 -2.00 -0.55 0.00 0.00 175.29 173.34 2w3r s GLU 172 N 1.97 4.40 0.17 1.67 2.56 -1.26 -1.33 118.70 126.87 2w3r s GLU 172 Ca -0.06 0.87 -0.21 0.00 0.00 0.00 0.00 54.97 55.57 2w3r s GLU 172 Cb -0.06 -3.47 0.08 0.00 2.00 0.00 0.00 34.13 32.68 2w3r s GLU 172 CO -0.17 -0.01 1.62 0.45 -0.56 0.00 0.00 175.26 176.59 2w3r h HIS 173 N 6.90 -0.64 -6.16 5.30 3.86 -1.96 -3.47 115.15 118.99 2w3r h HIS 173 Ca -0.39 0.05 -0.44 0.00 -1.16 0.00 0.00 60.37 58.43 2w3r h HIS 173 Cb 1.18 0.34 0.02 0.00 1.06 0.00 0.00 27.41 30.01 2w3r h HIS 173 CO 0.66 -0.32 -0.77 0.34 0.86 0.00 0.00 177.93 178.70 2w3r n PHE 174 N -5.39 -2.24 -1.70 2.45 7.35 -1.26 -4.96 117.46 111.72 2w3r n PHE 174 Ca 0.01 0.90 -0.43 0.00 -0.76 0.00 0.00 57.45 57.17 2w3r n PHE 174 Cb 0.31 -4.28 -0.01 0.00 0.35 0.00 0.00 39.48 35.85 2w3r n PHE 174 CO 0.00 0.00 0.00 2.48 -0.76 0.00 0.00 176.76 178.48 2w3r n TYR 175 N -4.57 2.30 -0.13 -5.13 0.18 -1.26 -4.94 117.16 103.62 2w3r n TYR 175 Ca -0.09 0.50 -0.09 0.00 1.88 0.00 0.00 57.90 60.10 2w3r n TYR 175 Cb 0.59 -2.44 -0.01 0.00 -0.38 0.00 0.00 39.34 37.10 2w3r n TYR 175 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 2w3r h LEU 176 N 3.09 0.56 -9.40 -3.48 -0.00 -1.85 -3.39 115.31 100.84 2w3r h LEU 176 Ca -0.46 -0.20 -0.55 0.00 -0.00 0.00 0.00 57.88 56.68 2w3r h LEU 176 Cb 1.28 -0.15 -0.03 0.00 -0.00 0.00 0.00 40.66 41.76 2w3r h LEU 176 CO 0.67 0.61 0.27 -0.70 -0.00 0.00 0.00 178.44 179.29 2w3r s GLU 177 N -5.43 4.52 0.81 1.13 2.12 -0.47 -5.06 118.70 116.32 2w3r s GLU 177 Ca -0.13 1.24 -0.14 0.00 0.36 0.00 0.00 54.97 56.30 2w3r s GLU 177 Cb 0.10 -3.45 0.19 0.00 0.26 0.00 0.00 34.13 31.23 2w3r s GLU 177 CO 0.76 -0.00 0.92 0.41 -0.54 0.00 0.00 175.26 176.80 2w3r n GLY 178 N 2.94 -1.96 3.75 -1.50 0.00 -1.26 -4.77 105.19 102.38 2w3r n GLY 178 Ca 0.03 -1.61 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 2w3r n GLY 178 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3r s GLN 179 N -5.03 4.37 -0.27 1.61 -1.52 -1.26 -4.95 119.66 112.60 2w3r s GLN 179 Ca 0.55 2.13 -0.24 0.00 -1.95 0.00 0.00 55.36 55.85 2w3r s GLN 179 Cb -0.03 -3.14 0.09 0.00 -0.22 0.00 0.00 33.01 29.71 2w3r s GLN 179 CO 0.40 -0.23 0.81 0.00 -0.25 0.00 0.00 175.29 176.02 2w3r s ALA 180 N -0.40 -1.85 0.07 6.09 0.00 -1.26 -2.47 121.76 121.94 2w3r s ALA 180 Ca 0.54 2.02 -0.10 0.00 0.00 0.00 0.00 51.96 54.41 2w3r s ALA 180 Cb -0.38 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.47 2w3r s ALA 180 CO 0.44 -0.31 0.22 0.00 0.00 0.00 0.00 175.76 176.11 2w3r s ALA 181 N 0.44 -0.40 -0.03 0.00 0.00 -0.25 -0.28 121.76 121.25 2w3r s ALA 181 Ca 0.00 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.60 2w3r s ALA 181 Cb -0.05 0.40 0.03 0.00 0.00 0.00 0.00 23.12 23.50 2w3r s ALA 181 CO -0.03 -0.45 0.04 -1.17 0.00 0.00 0.00 175.76 174.15 2w3r s LEU 182 N -2.44 0.83 -0.17 0.00 2.96 0.36 -1.06 118.68 119.16 2w3r s LEU 182 Ca -0.01 0.04 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2w3r s LEU 182 Cb 0.02 -0.11 -0.02 0.00 0.50 0.00 0.00 46.19 46.58 2w3r s LEU 182 CO -0.07 -0.16 -0.05 0.00 -1.32 0.00 0.00 176.35 174.75 2w3r s ALA 183 N 1.37 2.91 -0.31 5.97 0.00 0.77 -0.75 121.76 131.72 2w3r s ALA 183 Ca -0.05 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.02 2w3r s ALA 183 Cb -0.13 -1.55 0.08 0.00 0.00 0.00 0.00 23.12 21.52 2w3r s ALA 183 CO -0.03 0.07 -0.01 -0.51 0.00 0.00 0.00 175.76 175.28 2w3r s LEU 184 N 0.62 4.11 0.07 0.00 1.43 0.52 -1.76 118.68 123.66 2w3r s LEU 184 Ca -0.03 -1.68 -0.33 0.00 -1.03 0.00 0.00 54.13 51.06 2w3r s LEU 184 Cb -0.15 -1.63 -0.12 0.00 0.03 0.00 0.00 46.19 44.33 2w3r s LEU 184 CO 0.02 -0.29 1.76 -0.81 0.23 0.00 0.00 176.35 177.26 2w3r n PRO 185 N 4.42 2.38 -3.45 1.29 -0.04 -1.26 -0.80 135.00 137.53 2w3r n PRO 185 Ca -0.07 0.86 -0.28 0.00 -0.04 0.00 0.00 63.50 63.97 2w3r n PRO 185 Cb 0.42 -2.70 -0.11 0.00 -0.04 0.00 0.00 33.50 31.07 2w3r n PRO 185 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3r s ALA 186 N 2.46 1.16 -0.43 0.55 0.00 0.12 -4.92 121.76 120.71 2w3r s ALA 186 Ca 0.84 -2.11 -0.33 0.00 0.00 0.00 0.00 51.96 50.36 2w3r s ALA 186 Cb -0.62 -1.61 0.05 0.00 0.00 0.00 0.00 23.12 20.94 2w3r s ALA 186 CO 0.42 -2.06 0.62 0.39 0.00 0.00 0.00 175.76 175.13 2w3r n GLU 187 N 3.58 -1.98 0.00 0.00 1.02 -1.26 -2.33 120.64 119.66 2w3r n GLU 187 Ca 0.18 1.56 0.00 0.00 -0.02 0.00 0.00 57.16 58.88 2w3r n GLU 187 Cb 0.41 -2.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.06 2w3r n GLU 187 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3r n GLY 188 N -0.14 2.49 3.38 0.62 0.00 -1.26 -4.95 105.19 105.33 2w3r n GLY 188 Ca -0.04 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 2w3r n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 189 N 0.00 3.44 3.32 -0.02 0.00 -0.99 -5.05 105.19 105.89 2w3r n GLY 189 Ca 0.00 -2.25 -0.21 0.00 0.00 0.00 0.00 46.02 43.56 2w3r n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w3r s VAL 190 N -2.88 1.72 -0.16 1.61 -7.23 -0.80 0.16 120.40 112.81 2w3r s VAL 190 Ca 0.09 -1.90 -0.01 0.00 -1.81 0.00 0.00 61.98 58.35 2w3r s VAL 190 Cb 0.00 -1.80 -0.01 0.00 0.56 0.00 0.00 36.38 35.13 2w3r s VAL 190 CO 0.06 -0.36 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.69 2w3r s VAL 191 N -2.15 3.07 -0.23 1.32 1.01 0.02 -2.30 120.40 121.14 2w3r s VAL 191 Ca 0.15 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 2w3r s VAL 191 Cb -0.05 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2w3r s VAL 191 CO 0.06 0.50 -0.02 -0.63 0.00 0.00 0.00 175.10 175.01 2w3r s ILE 192 N 0.68 3.54 -0.21 2.22 -1.09 0.10 -0.36 121.20 126.09 2w3r s ILE 192 Ca -0.06 -0.45 -0.10 0.00 -2.23 0.00 0.00 60.65 57.82 2w3r s ILE 192 Cb -0.15 -2.63 -0.05 0.00 -1.58 0.00 0.00 42.46 38.05 2w3r s ILE 192 CO 0.02 0.40 0.12 -1.00 -1.23 0.00 0.00 174.94 173.25 2w3r s HIS 193 N 1.50 3.35 0.09 3.97 3.76 0.07 -1.01 115.29 127.01 2w3r s HIS 193 Ca 0.06 0.24 -0.19 0.00 -0.15 0.00 0.00 55.06 55.02 2w3r s HIS 193 Cb -0.14 -2.18 0.04 0.00 1.11 0.00 0.00 32.58 31.41 2w3r s HIS 193 CO -0.02 0.19 0.45 0.00 -0.85 0.00 0.00 174.74 174.51 2w3r n SER 195 N 0.10 5.27 -4.30 0.00 2.88 0.62 -4.69 113.62 113.50 2w3r n SER 195 Ca -0.17 -3.06 -0.20 0.00 -1.33 0.00 0.00 58.87 54.11 2w3r n SER 195 Cb 0.62 -1.50 -0.11 0.00 -0.75 0.00 0.00 64.21 62.47 2w3r n SER 195 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2w3r s SER 196 N 1.69 2.38 0.01 -3.46 0.15 -1.26 -4.62 113.70 108.60 2w3r s SER 196 Ca 0.40 -0.88 0.24 0.00 0.70 0.00 0.00 55.95 56.41 2w3r s SER 196 Cb 0.02 -0.12 0.27 0.00 -1.71 0.00 0.00 66.02 64.48 2w3r s SER 196 CO 0.00 -0.11 1.24 0.00 1.20 0.00 0.00 173.24 175.57 2w3r n GLN 197 N 0.25 0.06 -3.44 5.44 6.02 0.91 -4.68 117.38 121.94 2w3r n GLN 197 Ca -0.13 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.59 2w3r n GLN 197 Cb 0.58 -1.52 -0.10 0.00 1.02 0.00 0.00 30.24 30.21 2w3r n GLN 197 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2w3r s HIS 198 N -3.04 1.31 0.45 1.08 2.46 -1.25 -1.67 115.29 114.62 2w3r s HIS 198 Ca 0.09 -2.40 0.15 0.00 0.47 0.00 0.00 55.06 53.37 2w3r s HIS 198 Cb 0.16 -1.09 1.03 0.00 -0.13 0.00 0.00 32.58 32.56 2w3r s HIS 198 CO 0.75 -0.80 2.00 -1.35 -2.47 0.00 0.00 174.74 172.87 2w3r h PRO 199 N 5.67 0.00 -0.06 2.88 0.11 -1.88 -2.71 132.00 136.01 2w3r h PRO 199 Ca 0.25 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.25 2w3r h PRO 199 Cb 0.90 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.99 2w3r h PRO 199 CO 0.40 0.18 -0.45 0.77 -0.21 0.00 0.00 178.00 178.69 2w3r h SER 200 N 0.00 0.15 0.57 -2.05 0.02 -1.88 -1.98 113.55 108.38 2w3r h SER 200 Ca -0.00 -0.06 -0.26 0.00 -0.84 0.00 0.00 61.79 60.63 2w3r h SER 200 Cb 0.33 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2w3r h SER 200 CO 0.02 0.58 -1.15 -0.08 -1.14 0.00 0.00 176.83 175.07 2w3r h GLU 201 N 0.11 0.29 -0.39 3.45 4.81 -1.79 -2.85 114.58 118.21 2w3r h GLU 201 Ca 0.01 -0.44 0.03 0.00 -0.13 0.00 0.00 59.36 58.83 2w3r h GLU 201 Cb 0.85 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.35 2w3r h GLU 201 CO 0.07 1.17 0.19 0.82 -0.73 0.00 0.00 179.01 180.53 2w3r h ILE 202 N 0.11 0.96 0.15 2.32 1.08 -1.25 0.36 117.51 121.25 2w3r h ILE 202 Ca -0.11 -0.13 0.02 0.00 -0.39 0.00 0.00 64.86 64.24 2w3r h ILE 202 Cb 1.85 0.55 -0.04 0.00 -3.07 0.00 0.00 36.82 36.11 2w3r h ILE 202 CO 0.19 0.07 -0.37 -0.61 -0.69 0.00 0.00 178.15 176.74 2w3r h GLN 203 N 0.38 -0.60 -0.34 2.37 4.15 -1.43 -0.29 115.11 119.37 2w3r h GLN 203 Ca 0.17 0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.70 2w3r h GLN 203 Cb 0.09 0.14 -0.08 0.00 0.21 0.00 0.00 27.48 27.83 2w3r h GLN 203 CO -0.12 -0.40 -0.32 1.25 -1.93 0.00 0.00 178.83 177.31 2w3r h HIS 204 N -0.62 -0.87 -0.20 3.99 2.76 -1.20 0.74 115.15 119.75 2w3r h HIS 204 Ca 0.02 0.05 -0.13 0.00 -2.20 0.00 0.00 60.37 58.11 2w3r h HIS 204 Cb 0.64 0.43 -0.01 0.00 1.55 0.00 0.00 27.41 30.02 2w3r h HIS 204 CO -0.31 -0.38 -0.45 0.87 -1.30 0.00 0.00 177.93 176.36 2w3r h LYS 205 N -0.28 0.49 -0.41 5.26 1.79 -0.77 -2.52 116.57 120.13 2w3r h LYS 205 Ca 0.16 -0.26 -0.14 0.00 -2.18 0.00 0.00 60.65 58.22 2w3r h LYS 205 Cb 0.53 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 2w3r h LYS 205 CO -0.49 0.84 -0.30 0.28 -1.08 0.00 0.00 179.45 178.70 2w3r h VAL 206 N 0.40 1.27 -0.38 0.50 2.07 -0.71 -2.10 116.25 117.30 2w3r h VAL 206 Ca 0.03 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.08 2w3r h VAL 206 Cb 0.94 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2w3r h VAL 206 CO 0.08 0.49 0.23 0.00 0.02 0.00 0.00 177.57 178.40 2w3r h ALA 207 N 0.80 0.49 -0.50 1.67 0.00 -0.69 -1.05 119.26 119.98 2w3r h ALA 207 Ca 0.08 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 207 Cb 0.88 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2w3r h ALA 207 CO 0.08 -0.01 -0.02 0.45 0.00 0.00 0.00 179.25 179.74 2w3r h HIS 208 N 0.50 0.93 -0.66 0.00 -0.00 -1.47 0.11 115.15 114.56 2w3r h HIS 208 Ca 0.14 -0.14 -0.01 0.00 -0.00 0.00 0.00 60.37 60.35 2w3r h HIS 208 Cb 0.01 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.14 2w3r h HIS 208 CO -0.04 0.85 0.37 0.00 -0.00 0.00 0.00 177.93 179.12 2w3r h ALA 209 N 1.18 1.41 -0.02 2.45 0.00 -0.90 -2.96 119.26 120.43 2w3r h ALA 209 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2w3r h ALA 209 Cb 0.51 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 209 CO 0.03 0.49 -0.37 1.28 0.00 0.00 0.00 179.25 180.68 2w3r n LEU 210 N -4.38 2.04 -1.41 0.00 4.77 -0.44 -3.41 117.00 114.17 2w3r n LEU 210 Ca 0.06 -0.73 -0.12 0.00 -0.03 0.00 0.00 56.01 55.20 2w3r n LEU 210 Cb 0.09 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2w3r n LEU 210 CO 0.37 0.37 -0.11 0.61 -1.33 0.00 0.00 177.39 177.30 2w3r n GLY 211 N 1.39 -0.08 3.62 -0.72 0.00 0.16 -4.96 105.19 104.61 2w3r n GLY 211 Ca 0.11 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 2w3r n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w3r s LEU 212 N -3.42 3.26 0.68 0.99 1.43 0.15 -5.02 118.68 116.75 2w3r s LEU 212 Ca 0.04 -0.13 -0.17 0.00 -1.03 0.00 0.00 54.13 52.84 2w3r s LEU 212 Cb -0.02 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.32 2w3r s LEU 212 CO 0.05 0.27 1.24 0.00 0.23 0.00 0.00 176.35 178.13 2w3r s ALA 213 N -1.06 2.28 0.43 4.21 0.00 -1.26 -4.36 121.76 121.99 2w3r s ALA 213 Ca 0.19 1.02 0.15 0.00 0.00 0.00 0.00 51.96 53.31 2w3r s ALA 213 Cb -0.11 -3.50 1.03 0.00 0.00 0.00 0.00 23.12 20.54 2w3r s ALA 213 CO 0.09 -1.65 1.94 0.74 0.00 0.00 0.00 175.76 176.88 2w3r h PHE 214 N 0.20 0.48 0.00 0.00 -1.00 -1.94 -0.99 116.94 113.70 2w3r h PHE 214 Ca -0.49 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.30 2w3r h PHE 214 Cb 1.31 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.72 2w3r h PHE 214 CO 0.45 0.20 0.00 -2.39 -1.61 0.00 0.00 178.31 174.96 2w3r n HIS 215 N -4.48 0.00 0.22 -0.55 1.44 -1.26 -2.18 115.22 108.42 2w3r n HIS 215 Ca 0.13 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.89 2w3r n HIS 215 Cb 0.46 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.66 2w3r n HIS 215 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2w3r n ASP 216 N -0.74 2.26 -4.00 4.39 8.00 -0.37 -4.96 116.55 121.12 2w3r n ASP 216 Ca 0.05 -1.65 -0.24 0.00 0.71 0.00 0.00 54.79 53.66 2w3r n ASP 216 Cb 0.02 -0.08 -0.17 0.00 -0.02 0.00 0.00 41.12 40.88 2w3r n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w3r s VAL 217 N -0.93 1.06 -0.09 2.53 1.01 -0.93 -1.91 120.40 121.13 2w3r s VAL 217 Ca 0.16 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2w3r s VAL 217 Cb 0.10 -0.98 0.02 0.00 0.00 0.00 0.00 36.38 35.52 2w3r s VAL 217 CO 0.14 0.34 -0.09 -0.60 0.00 0.00 0.00 175.10 174.89 2w3r s ARG 218 N 0.77 1.58 -0.21 2.72 3.52 -0.97 -4.92 118.95 121.43 2w3r s ARG 218 Ca -0.13 -0.32 -0.05 0.00 -0.13 0.00 0.00 55.73 55.11 2w3r s ARG 218 Cb -0.15 -1.48 -0.02 0.00 -1.56 0.00 0.00 34.95 31.74 2w3r s ARG 218 CO 0.02 -0.13 -0.02 0.08 -0.81 0.00 0.00 175.30 174.45 2w3r s VAL 219 N 1.22 3.70 -0.07 7.11 1.01 -1.26 0.01 120.40 132.13 2w3r s VAL 219 Ca -0.04 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.55 2w3r s VAL 219 Cb -0.14 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 2w3r s VAL 219 CO -0.03 0.42 -0.07 -1.61 0.00 0.00 0.00 175.10 173.82 2w3r s GLU 220 N 1.24 2.78 -0.26 2.72 2.02 -0.18 -2.18 118.70 124.83 2w3r s GLU 220 Ca 0.03 -0.54 -0.02 0.00 0.02 0.00 0.00 54.97 54.46 2w3r s GLU 220 Cb -0.15 -2.61 0.15 0.00 0.10 0.00 0.00 34.13 31.63 2w3r s GLU 220 CO 0.00 0.65 0.45 1.41 0.02 0.00 0.00 175.26 177.80 2w3r s MET 221 N -0.78 0.42 -0.23 1.61 -2.45 0.32 -3.37 119.30 114.82 2w3r s MET 221 Ca 0.12 0.69 -0.17 0.00 -1.25 0.00 0.00 55.69 55.08 2w3r s MET 221 Cb -0.11 -0.14 -0.13 0.00 1.25 0.00 0.00 34.83 35.70 2w3r s MET 221 CO 0.01 -0.64 -0.14 -2.13 1.05 0.00 0.00 175.02 173.18 2w3r n ARG 222 N 5.39 0.56 -3.68 4.11 3.00 -1.26 -0.77 116.66 124.00 2w3r n ARG 222 Ca -0.03 0.39 -0.13 0.00 -0.00 0.00 0.00 57.85 58.08 2w3r n ARG 222 Cb 0.50 -1.59 -0.07 0.00 0.00 0.00 0.00 32.46 31.30 2w3r n ARG 222 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2w3r s ARG 223 N -2.48 0.86 0.02 -0.14 1.70 -1.26 -4.49 118.95 113.17 2w3r s ARG 223 Ca -0.32 -0.29 0.05 0.00 -0.47 0.00 0.00 55.73 54.70 2w3r s ARG 223 Cb 0.09 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.83 2w3r s ARG 223 CO 0.49 -0.28 -0.10 -1.64 -1.08 0.00 0.00 175.30 172.69 2w3r s MET 224 N -2.12 2.37 -1.39 3.89 -1.94 -0.28 -4.72 119.30 115.13 2w3r s MET 224 Ca -0.08 -0.83 -0.10 0.00 -1.71 0.00 0.00 55.69 52.98 2w3r s MET 224 Cb -0.02 -2.39 0.09 0.00 2.01 0.00 0.00 34.83 34.52 2w3r s MET 224 CO 0.00 0.57 2.26 0.41 -0.01 0.00 0.00 175.02 178.25 2w3r n GLY 225 N 1.47 4.71 0.00 -0.03 0.00 -1.26 -4.45 105.19 105.64 2w3r n GLY 225 Ca -0.15 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2w3r n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 226 N 2.96 -0.91 2.04 -0.02 0.00 -1.24 -1.37 105.19 106.66 2w3r n GLY 226 Ca 0.54 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2w3r n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 227 N -0.19 -0.54 2.26 -0.02 0.00 -1.26 -4.84 105.19 100.60 2w3r n GLY 227 Ca 0.00 0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 2w3r n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2w3r n PHE 228 N -3.12 -0.31 0.00 1.61 3.01 -1.26 -0.37 117.46 117.02 2w3r n PHE 228 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2w3r n PHE 228 Cb 0.00 -2.97 0.00 0.00 -0.01 0.00 0.00 39.48 36.50 2w3r n PHE 228 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2w3r n GLY 229 N -0.35 2.84 0.07 1.37 0.00 -1.26 -1.37 105.19 106.48 2w3r n GLY 229 Ca -0.17 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 45.87 2w3r n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 230 N 0.00 -0.78 0.49 -0.02 0.00 0.50 -1.44 105.19 103.94 2w3r n GLY 230 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.17 2w3r n GLY 230 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w3r n LYS 231 N -1.84 2.39 0.09 1.61 5.02 -1.22 -3.97 118.16 120.23 2w3r n LYS 231 Ca 0.00 -2.50 -0.09 0.00 -2.02 0.00 0.00 58.31 53.70 2w3r n LYS 231 Cb 0.06 -1.56 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2w3r n LYS 231 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2w3r h GLU 232 N 1.04 0.15 0.00 1.97 4.81 -1.58 0.26 114.58 121.23 2w3r h GLU 232 Ca 0.00 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 2w3r h GLU 232 Cb 1.10 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2w3r h GLU 232 CO 0.10 0.97 -0.16 -1.13 -0.73 0.00 0.00 179.01 178.06 2w3r n SER 233 N -3.59 0.75 0.22 1.04 3.41 -1.26 -4.49 113.62 109.70 2w3r n SER 233 Ca -0.03 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.73 2w3r n SER 233 Cb 0.85 0.06 0.79 0.00 -0.26 0.00 0.00 64.21 65.65 2w3r n SER 233 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2w3r h GLN 234 N 0.00 0.00 0.00 4.33 1.08 -1.82 -1.06 115.11 117.64 2w3r h GLN 234 Ca 0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 2w3r h GLN 234 Cb 0.16 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.58 2w3r h GLN 234 CO 0.00 0.00 -0.16 0.78 -0.95 0.00 0.00 178.83 178.50 2w3r h GLY 235 N 0.19 0.00 0.17 3.46 0.00 -1.81 -3.32 103.07 101.75 2w3r h GLY 235 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.48 2w3r h GLY 235 CO 0.00 0.00 0.39 3.43 0.00 0.00 0.00 176.54 180.36 2w3r h ASN 236 N 0.00 0.44 -0.85 0.19 -0.26 -1.52 -2.50 115.58 111.09 2w3r h ASN 236 Ca -0.00 0.10 -0.00 0.00 -0.56 0.00 0.00 56.30 55.84 2w3r h ASN 236 Cb 0.60 0.04 -0.04 0.00 -1.06 0.00 0.00 38.32 37.86 2w3r h ASN 236 CO 0.02 0.17 0.52 0.45 -1.06 0.00 0.00 177.43 177.53 2w3r h HIS 237 N 0.55 1.12 -0.00 1.19 3.86 -1.81 -1.04 115.15 119.01 2w3r h HIS 237 Ca 0.46 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.58 2w3r h HIS 237 Cb 0.68 -0.37 0.01 0.00 1.06 0.00 0.00 27.41 28.79 2w3r h HIS 237 CO -0.12 0.74 -0.37 -0.07 0.86 0.00 0.00 177.93 178.97 2w3r h LEU 238 N 1.18 0.33 -1.18 2.43 4.07 -1.70 -2.26 115.31 118.18 2w3r h LEU 238 Ca 0.31 -0.77 -0.02 0.00 0.08 0.00 0.00 57.88 57.48 2w3r h LEU 238 Cb -0.06 -0.10 -0.03 0.00 1.08 0.00 0.00 40.66 41.55 2w3r h LEU 238 CO -0.06 1.05 0.30 0.00 -1.08 0.00 0.00 178.44 178.66 2w3r h ALA 239 N 0.28 1.37 -0.41 1.53 0.00 -1.41 -0.07 119.26 120.55 2w3r h ALA 239 Ca -0.04 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2w3r h ALA 239 Cb 1.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2w3r h ALA 239 CO 0.07 0.50 0.04 0.82 0.00 0.00 0.00 179.25 180.68 2w3r h ILE 240 N 0.87 1.25 -0.56 0.00 2.04 -1.27 -1.65 117.51 118.20 2w3r h ILE 240 Ca 0.22 -0.94 0.01 0.00 1.00 0.00 0.00 64.86 65.15 2w3r h ILE 240 Cb 0.08 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2w3r h ILE 240 CO -0.03 0.32 0.37 0.00 0.00 0.00 0.00 178.15 178.81 2w3r h ALA 241 N 0.91 0.72 -0.27 1.87 0.00 -0.68 -0.24 119.26 121.57 2w3r h ALA 241 Ca 0.12 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 241 Cb 0.42 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2w3r h ALA 241 CO 0.01 0.13 -0.41 0.00 0.00 0.00 0.00 179.25 178.98 2w3r h ALA 243 N 0.67 0.80 -0.14 0.00 0.00 -1.05 0.40 119.26 119.94 2w3r h ALA 243 Ca 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2w3r h ALA 243 Cb 1.01 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2w3r h ALA 243 CO 0.09 0.20 -0.28 0.28 0.00 0.00 0.00 179.25 179.54 2w3r h VAL 244 N 0.82 1.37 -0.56 0.00 2.07 -1.00 -2.21 116.25 116.73 2w3r h VAL 244 Ca 0.24 -1.55 -0.11 0.00 0.82 0.00 0.00 66.70 66.10 2w3r h VAL 244 Cb -0.06 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2w3r h VAL 244 CO -0.07 0.46 -0.07 0.00 0.02 0.00 0.00 177.57 177.91 2w3r h ALA 245 N 0.55 0.80 -0.51 1.67 0.00 -1.12 -2.57 119.26 118.08 2w3r h ALA 245 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2w3r h ALA 245 Cb 0.87 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2w3r h ALA 245 CO 0.06 0.67 0.24 0.00 0.00 0.00 0.00 179.25 180.22 2w3r h ALA 246 N 0.97 0.66 -0.93 0.00 0.00 -0.95 0.86 119.26 119.87 2w3r h ALA 246 Ca 0.15 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 246 Cb 0.64 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2w3r h ALA 246 CO 0.04 0.23 0.60 -0.09 0.00 0.00 0.00 179.25 180.03 2w3r h ARG 247 N 0.68 1.03 0.12 0.00 2.43 -1.25 -0.31 114.38 117.08 2w3r h ARG 247 Ca 0.17 -0.06 -0.21 0.00 -0.81 0.00 0.00 59.98 59.07 2w3r h ARG 247 Cb 0.13 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2w3r h ARG 247 CO -0.02 0.68 -0.99 0.00 -1.51 0.00 0.00 179.97 178.14 2w3r h ALA 248 N 1.50 0.01 0.00 2.80 0.00 -1.16 -3.37 119.26 119.04 2w3r h ALA 248 Ca 0.40 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2w3r h ALA 248 Cb 0.20 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2w3r h ALA 248 CO -0.16 0.52 -0.43 1.79 0.00 0.00 0.00 179.25 180.97 2w3r h THR 249 N -0.41 0.00 0.00 0.00 1.35 -0.79 -3.47 112.91 109.59 2w3r h THR 249 Ca -0.20 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.68 2w3r h THR 249 Cb 1.64 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 2w3r h THR 249 CO 0.10 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 2w3r n GLY 250 N 1.14 2.15 3.82 5.82 0.00 -0.13 -5.02 105.19 112.97 2w3r n GLY 250 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2w3r n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3r s ARG 251 N -0.14 2.92 0.34 1.61 0.52 -1.25 -4.94 118.95 118.02 2w3r s ARG 251 Ca 0.00 -1.05 -0.29 0.00 -0.52 0.00 0.00 55.73 53.87 2w3r s ARG 251 Cb 0.00 -2.56 -0.11 0.00 0.52 0.00 0.00 34.95 32.80 2w3r s ARG 251 CO 0.00 0.40 1.39 -2.14 0.02 0.00 0.00 175.30 174.97 2w3r s PRO 252 N -3.82 4.25 -0.02 3.54 0.02 -1.26 -4.34 135.00 133.36 2w3r s PRO 252 Ca 0.33 2.37 0.08 0.00 0.02 0.00 0.00 61.00 63.79 2w3r s PRO 252 Cb -0.08 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.39 2w3r s PRO 252 CO 0.25 -0.34 -0.25 0.00 -0.33 0.00 0.00 177.00 176.32 2w3r s LYS 254 N -0.54 1.30 -0.04 0.00 2.20 -0.49 -0.16 119.74 122.01 2w3r s LYS 254 Ca 0.08 -0.41 0.01 0.00 -0.36 0.00 0.00 55.97 55.30 2w3r s LYS 254 Cb -0.10 -1.16 0.02 0.00 -1.51 0.00 0.00 37.83 35.08 2w3r s LYS 254 CO -0.01 0.14 -0.04 1.41 -0.36 0.00 0.00 175.35 176.49 2w3r s MET 255 N 0.22 0.75 -0.02 4.03 1.75 -0.22 -1.66 119.30 124.14 2w3r s MET 255 Ca -0.05 -0.11 0.00 0.00 -1.25 0.00 0.00 55.69 54.28 2w3r s MET 255 Cb -0.10 -0.76 0.02 0.00 2.84 0.00 0.00 34.83 36.83 2w3r s MET 255 CO 0.01 -0.05 0.01 -0.98 -0.65 0.00 0.00 175.02 173.36 2w3r s ARG 256 N 0.76 0.17 0.24 4.11 1.70 -1.26 -1.09 118.95 123.58 2w3r s ARG 256 Ca -0.10 0.09 -0.30 0.00 -0.47 0.00 0.00 55.73 54.95 2w3r s ARG 256 Cb -0.13 -0.36 -0.10 0.00 -0.57 0.00 0.00 34.95 33.79 2w3r s ARG 256 CO 0.00 -0.12 1.40 0.71 -1.08 0.00 0.00 175.30 176.21 2w3r s TYR 257 N 0.90 3.08 0.56 5.89 4.12 -1.03 -5.01 117.35 125.86 2w3r s TYR 257 Ca -0.08 1.09 -0.19 0.00 0.02 0.00 0.00 57.07 57.91 2w3r s TYR 257 Cb -0.12 -3.76 -0.05 0.00 -1.52 0.00 0.00 41.96 36.51 2w3r s TYR 257 CO -0.02 -2.43 1.11 0.34 0.02 0.00 0.00 175.55 174.57 2w3r s ASP 258 N 0.33 5.71 0.28 2.29 -1.08 -1.26 -4.73 116.67 118.21 2w3r s ASP 258 Ca 0.58 2.11 0.02 0.00 -0.52 0.00 0.00 52.55 54.74 2w3r s ASP 258 Cb -0.40 -2.57 0.66 0.00 -1.46 0.00 0.00 42.92 39.14 2w3r s ASP 258 CO 0.42 -1.22 1.73 -0.09 0.52 0.00 0.00 175.17 176.53 2w3r h ARG 259 N 1.04 0.53 -0.54 4.34 9.65 -1.95 0.28 114.38 127.73 2w3r h ARG 259 Ca -0.49 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.27 2w3r h ARG 259 Cb 1.25 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.69 2w3r h ARG 259 CO 0.57 0.35 0.01 -0.44 2.80 0.00 0.00 179.97 183.26 2w3r h ASP 260 N 0.55 0.93 -0.63 -3.80 3.45 -1.93 -1.80 116.42 113.19 2w3r h ASP 260 Ca 0.53 -0.30 -0.04 0.00 0.43 0.00 0.00 57.03 57.65 2w3r h ASP 260 Cb 0.88 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 39.38 2w3r h ASP 260 CO -0.44 1.00 0.24 0.44 -1.57 0.00 0.00 179.24 178.91 2w3r h ASP 261 N 0.83 0.88 -0.70 6.45 5.19 -1.24 -2.51 116.42 125.31 2w3r h ASP 261 Ca 0.15 -0.18 -0.00 0.00 -0.62 0.00 0.00 57.03 56.38 2w3r h ASP 261 Cb 0.52 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 2w3r h ASP 261 CO 0.03 0.82 0.42 -0.78 -3.12 0.00 0.00 179.24 176.61 2w3r h ASP 262 N 0.88 0.84 0.95 6.45 -0.00 -0.32 0.13 116.42 125.35 2w3r h ASP 262 Ca 0.21 -0.06 -0.17 0.00 -0.00 0.00 0.00 57.03 57.01 2w3r h ASP 262 Cb 0.23 -0.21 -0.02 0.00 -0.00 0.00 0.00 39.33 39.32 2w3r h ASP 262 CO -0.01 0.65 -0.80 0.24 -0.00 0.00 0.00 179.24 179.32 2w3r h MET 263 N 0.96 0.00 0.01 0.28 2.86 -1.31 -2.50 114.93 115.24 2w3r h MET 263 Ca 0.25 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.84 2w3r h MET 263 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2w3r h MET 263 CO -0.05 0.80 -0.19 0.28 1.06 0.00 0.00 176.91 178.81 2w3r h VAL 264 N 0.00 1.62 0.37 -2.22 2.07 -1.21 -3.40 116.25 113.48 2w3r h VAL 264 Ca -0.01 -2.06 -0.02 0.00 0.82 0.00 0.00 66.70 65.43 2w3r h VAL 264 Cb 1.49 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 34.23 2w3r h VAL 264 CO 0.10 0.55 -0.18 0.40 0.02 0.00 0.00 177.57 178.47 2w3r h ILE 265 N -0.66 0.23 -4.21 4.57 2.04 -1.06 -3.46 117.51 114.96 2w3r h ILE 265 Ca -0.03 -0.69 -0.52 0.00 1.00 0.00 0.00 64.86 64.63 2w3r h ILE 265 Cb 1.01 0.37 0.12 0.00 -0.74 0.00 0.00 36.82 37.59 2w3r h ILE 265 CO 0.04 0.05 0.36 0.42 0.00 0.00 0.00 178.15 179.03 2w3r s THR 266 N -3.55 2.97 0.90 -0.27 -4.23 -0.94 -4.74 115.64 105.78 2w3r s THR 266 Ca -0.10 0.43 -0.15 0.00 -1.18 0.00 0.00 61.69 60.69 2w3r s THR 266 Cb 0.01 -2.93 0.21 0.00 1.34 0.00 0.00 72.50 71.13 2w3r s THR 266 CO 0.33 -0.30 1.17 0.61 -0.54 0.00 0.00 174.62 175.89 2w3r n GLY 267 N -0.34 -1.60 0.00 3.99 0.00 -1.25 -4.85 105.19 101.14 2w3r n GLY 267 Ca 0.11 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2w3r n GLY 267 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w3r n LYS 268 N -3.62 0.03 -2.25 1.61 4.01 -1.26 -4.79 118.16 111.89 2w3r n LYS 268 Ca 0.15 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.53 2w3r n LYS 268 Cb 0.52 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 35.01 2w3r n LYS 268 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 2w3r s ARG 269 N -1.82 4.40 -0.09 1.97 3.52 -0.44 -1.44 118.95 125.04 2w3r s ARG 269 Ca 0.00 2.01 -0.31 0.00 -0.13 0.00 0.00 55.73 57.30 2w3r s ARG 269 Cb 0.00 -3.22 -0.09 0.00 -1.56 0.00 0.00 34.95 30.08 2w3r s ARG 269 CO 0.00 -0.25 2.02 0.72 -0.81 0.00 0.00 175.30 176.98 2w3r n HIS 270 N 2.83 2.26 -2.65 5.12 8.25 -1.26 -3.77 115.22 125.99 2w3r n HIS 270 Ca 0.07 -0.15 -0.38 0.00 -0.26 0.00 0.00 57.72 57.00 2w3r n HIS 270 Cb 0.43 -2.72 -0.05 0.00 1.12 0.00 0.00 29.99 28.77 2w3r n HIS 270 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2w3r s ASP 271 N 5.44 7.16 0.07 0.41 -4.77 -1.26 -4.76 116.67 118.95 2w3r s ASP 271 Ca 0.95 1.98 0.07 0.00 -3.30 0.00 0.00 52.55 52.25 2w3r s ASP 271 Cb -0.53 -2.59 -0.03 0.00 -1.09 0.00 0.00 42.92 38.68 2w3r s ASP 271 CO 0.44 -0.20 -0.20 -0.36 0.70 0.00 0.00 175.17 175.55 2w3r s PHE 272 N -1.53 1.71 -0.16 2.11 0.08 -0.18 -1.95 117.98 118.06 2w3r s PHE 272 Ca 0.51 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 57.14 2w3r s PHE 272 Cb -0.22 -0.98 -0.02 0.00 -0.57 0.00 0.00 43.02 41.23 2w3r s PHE 272 CO 0.28 0.13 -0.08 0.50 -0.10 0.00 0.00 175.22 175.96 2w3r s ARG 273 N -1.51 3.47 -0.16 0.44 3.52 -0.09 0.01 118.95 124.63 2w3r s ARG 273 Ca 0.06 -0.62 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 2w3r s ARG 273 Cb -0.09 -2.82 0.02 0.00 -1.56 0.00 0.00 34.95 30.49 2w3r s ARG 273 CO 0.03 0.11 -0.20 0.42 -0.81 0.00 0.00 175.30 174.85 2w3r s ILE 274 N 0.66 2.03 -0.16 4.11 1.01 -0.93 -0.89 121.20 127.02 2w3r s ILE 274 Ca -0.04 -0.93 -0.08 0.00 0.00 0.00 0.00 60.65 59.59 2w3r s ILE 274 Cb -0.15 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 2w3r s ILE 274 CO 0.02 0.54 0.13 -0.60 0.00 0.00 0.00 174.94 175.03 2w3r s ARG 275 N 1.14 3.77 0.04 2.79 3.52 -0.69 -2.37 118.95 127.15 2w3r s ARG 275 Ca 0.01 -0.19 0.03 0.00 -0.13 0.00 0.00 55.73 55.45 2w3r s ARG 275 Cb -0.14 -3.27 -0.02 0.00 -1.56 0.00 0.00 34.95 29.96 2w3r s ARG 275 CO -0.09 0.54 -0.09 1.52 -0.81 0.00 0.00 175.30 176.37 2w3r s TYR 276 N -0.36 0.79 -0.15 5.12 -0.85 -0.09 -0.84 117.35 120.97 2w3r s TYR 276 Ca 0.11 -0.46 -0.02 0.00 -0.52 0.00 0.00 57.07 56.18 2w3r s TYR 276 Cb -0.12 -0.46 0.05 0.00 0.38 0.00 0.00 41.96 41.81 2w3r s TYR 276 CO 0.01 -0.05 0.03 1.03 -1.52 0.00 0.00 175.55 175.05 2w3r s ARG 277 N -1.50 0.60 -0.05 -3.49 0.52 -0.08 -2.13 118.95 112.82 2w3r s ARG 277 Ca -0.07 -0.20 0.05 0.00 -0.52 0.00 0.00 55.73 54.99 2w3r s ARG 277 Cb -0.09 -1.66 -0.00 0.00 0.52 0.00 0.00 34.95 33.71 2w3r s ARG 277 CO 0.01 -0.51 -0.19 -1.50 0.02 0.00 0.00 175.30 173.12 2w3r s ILE 278 N 1.92 1.60 0.08 1.52 2.07 -0.54 -0.11 121.20 127.74 2w3r s ILE 278 Ca 0.02 -0.80 0.09 0.00 -1.41 0.00 0.00 60.65 58.54 2w3r s ILE 278 Cb -0.15 -1.37 -0.03 0.00 0.13 0.00 0.00 42.46 41.04 2w3r s ILE 278 CO -0.07 0.45 -0.23 -0.83 -1.91 0.00 0.00 174.94 172.35 2w3r s GLY 279 N 0.05 1.32 0.40 1.50 0.00 -0.21 -0.97 107.32 109.42 2w3r s GLY 279 Ca -0.06 -1.25 0.04 0.00 0.00 0.00 0.00 44.72 43.45 2w3r s GLY 279 CO 0.03 -1.21 0.08 0.00 0.00 0.00 0.00 173.10 172.00 2w3r s ALA 280 N -0.97 2.95 0.65 3.20 0.00 0.89 -0.43 121.76 128.06 2w3r s ALA 280 Ca 0.10 -1.44 -0.03 0.00 0.00 0.00 0.00 51.96 50.58 2w3r s ALA 280 Cb -0.10 0.56 0.06 0.00 0.00 0.00 0.00 23.12 23.64 2w3r s ALA 280 CO 0.04 -0.26 0.93 0.34 0.00 0.00 0.00 175.76 176.80 2w3r s ASP 281 N -3.62 4.93 0.25 0.00 -1.08 0.23 -2.59 116.67 114.79 2w3r s ASP 281 Ca 0.26 0.22 0.02 0.00 -0.52 0.00 0.00 52.55 52.53 2w3r s ASP 281 Cb 0.05 -0.93 0.31 0.00 -1.46 0.00 0.00 42.92 40.89 2w3r s ASP 281 CO 0.13 -1.46 1.63 0.00 0.52 0.00 0.00 175.17 175.99 2w3r h ALA 282 N -0.36 0.95 0.00 3.66 0.00 -1.90 -2.91 119.26 118.70 2w3r h ALA 282 Ca -0.43 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 53.91 2w3r h ALA 282 Cb 1.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2w3r h ALA 282 CO 0.56 0.63 -0.61 0.66 0.00 0.00 0.00 179.25 180.49 2w3r h SER 283 N 0.33 0.00 0.00 0.00 4.64 -2.02 -3.48 113.55 113.02 2w3r h SER 283 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2w3r h SER 283 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2w3r h SER 283 CO 0.08 0.61 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 2w3r n GLY 284 N 0.32 1.01 3.76 -0.77 0.00 -1.10 -5.11 105.19 103.30 2w3r n GLY 284 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2w3r n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s LYS 285 N -0.19 4.47 0.22 1.61 -0.14 -1.26 -4.51 119.74 119.94 2w3r s LYS 285 Ca 0.00 2.04 -0.30 0.00 -1.36 0.00 0.00 55.97 56.35 2w3r s LYS 285 Cb 0.00 -3.13 -0.09 0.00 -1.68 0.00 0.00 37.83 32.92 2w3r s LYS 285 CO 0.00 -0.05 1.36 -0.51 -0.76 0.00 0.00 175.35 175.39 2w3r s LEU 286 N -1.41 4.40 -0.22 3.17 1.43 -1.26 0.77 118.68 125.56 2w3r s LEU 286 Ca 0.48 2.52 -0.17 0.00 -1.03 0.00 0.00 54.13 55.94 2w3r s LEU 286 Cb -0.36 -3.62 -0.13 0.00 0.03 0.00 0.00 46.19 42.11 2w3r s LEU 286 CO 0.46 -0.60 -0.12 0.18 0.23 0.00 0.00 176.35 176.51 2w3r n LEU 287 N 2.44 1.90 -3.51 1.79 4.77 0.43 -4.46 117.00 120.37 2w3r n LEU 287 Ca 0.06 0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 56.33 2w3r n LEU 287 Cb 0.42 -0.87 -0.03 0.00 -2.33 0.00 0.00 43.42 40.60 2w3r n LEU 287 CO 0.59 0.24 0.32 -0.83 -1.33 0.00 0.00 177.39 176.37 2w3r s GLY 288 N -5.04 -0.49 -0.06 -0.72 0.00 -1.21 -3.01 107.32 96.80 2w3r s GLY 288 Ca -0.31 0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.78 2w3r s GLY 288 CO 0.49 0.08 0.08 0.00 0.00 0.00 0.00 173.10 173.75 2w3r s ALA 289 N -3.46 0.19 -0.28 3.20 0.00 -0.88 -1.04 121.76 119.48 2w3r s ALA 289 Ca 0.00 0.21 -0.08 0.00 0.00 0.00 0.00 51.96 52.09 2w3r s ALA 289 Cb -0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 2w3r s ALA 289 CO -0.10 -0.55 0.11 0.34 0.00 0.00 0.00 175.76 175.56 2w3r s ASP 290 N 2.19 5.31 0.05 0.00 2.15 0.84 -1.64 116.67 125.57 2w3r s ASP 290 Ca 0.05 -0.44 0.07 0.00 0.43 0.00 0.00 52.55 52.65 2w3r s ASP 290 Cb -0.12 -1.95 -0.03 0.00 -0.30 0.00 0.00 42.92 40.51 2w3r s ASP 290 CO -0.04 -0.13 -0.17 -0.36 -0.17 0.00 0.00 175.17 174.30 2w3r s PHE 291 N 1.59 2.59 -0.15 -5.34 0.40 0.11 -0.90 117.98 116.29 2w3r s PHE 291 Ca 0.05 -0.23 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 2w3r s PHE 291 Cb -0.16 -1.46 0.04 0.00 0.51 0.00 0.00 43.02 41.95 2w3r s PHE 291 CO 0.05 0.29 -0.04 0.08 0.70 0.00 0.00 175.22 176.30 2w3r s VAL 292 N -0.98 0.96 -0.32 -0.44 1.01 -0.02 -1.08 120.40 119.53 2w3r s VAL 292 Ca 0.16 -0.49 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 2w3r s VAL 292 Cb -0.11 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 2w3r s VAL 292 CO 0.07 0.15 0.26 -1.00 0.00 0.00 0.00 175.10 174.57 2w3r s HIS 293 N 1.70 3.22 -0.41 5.22 3.76 0.10 -1.71 115.29 127.18 2w3r s HIS 293 Ca 0.02 -0.06 -0.10 0.00 -0.15 0.00 0.00 55.06 54.77 2w3r s HIS 293 Cb -0.15 -2.49 0.07 0.00 1.11 0.00 0.00 32.58 31.12 2w3r s HIS 293 CO -0.08 -0.31 0.26 -0.51 -0.85 0.00 0.00 174.74 173.25 2w3r s LEU 294 N 1.80 5.09 -0.11 0.89 1.43 -0.07 -0.39 118.68 127.32 2w3r s LEU 294 Ca 0.08 -1.37 -0.01 0.00 -1.03 0.00 0.00 54.13 51.80 2w3r s LEU 294 Cb -0.17 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 2w3r s LEU 294 CO 0.11 -0.51 -0.08 0.00 0.23 0.00 0.00 176.35 176.10 2w3r s ALA 295 N 1.47 2.89 -0.34 4.21 0.00 -0.57 -0.91 121.76 128.50 2w3r s ALA 295 Ca 0.03 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 50.93 2w3r s ALA 295 Cb -0.22 -1.31 -0.00 0.00 0.00 0.00 0.00 23.12 21.58 2w3r s ALA 295 CO 0.04 0.39 0.52 0.50 0.00 0.00 0.00 175.76 177.21 2w3r s ARG 296 N -0.19 3.66 -0.01 0.00 3.52 -0.82 -1.60 118.95 123.51 2w3r s ARG 296 Ca 0.02 -0.12 0.19 0.00 -0.13 0.00 0.00 55.73 55.69 2w3r s ARG 296 Cb -0.13 -3.80 -0.24 0.00 -1.56 0.00 0.00 34.95 29.23 2w3r s ARG 296 CO 0.03 -0.63 0.64 0.00 -0.81 0.00 0.00 175.30 174.53 2w3r n GLY 298 N 1.43 -1.94 0.00 0.00 0.00 -1.26 -1.76 105.19 101.66 2w3r n GLY 298 Ca 0.01 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.67 2w3r n GLY 298 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2w3r n TRP 299 N 0.00 0.00 -3.67 1.61 4.27 0.08 -2.43 117.44 117.30 2w3r n TRP 299 Ca 0.00 0.00 -0.14 0.00 -3.89 0.00 0.00 57.50 53.47 2w3r n TRP 299 Cb 0.00 -0.07 -0.07 0.00 -1.36 0.00 0.00 31.31 29.81 2w3r n TRP 299 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2w3r s SER 300 N -2.15 -0.32 0.08 -0.67 0.15 -1.26 -4.99 113.70 104.54 2w3r s SER 300 Ca 0.33 0.12 -0.36 0.00 0.70 0.00 0.00 55.95 56.74 2w3r s SER 300 Cb 0.16 0.41 -0.18 0.00 -1.71 0.00 0.00 66.02 64.71 2w3r s SER 300 CO 0.30 -0.60 1.58 0.00 1.20 0.00 0.00 173.24 175.71 2w3r h ALA 301 N 3.22 -1.13 -0.69 5.45 0.00 -1.87 -3.42 119.26 120.82 2w3r h ALA 301 Ca -0.30 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2w3r h ALA 301 Cb 1.19 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2w3r h ALA 301 CO 0.42 -1.16 0.00 -3.47 0.00 0.00 0.00 179.25 175.04 2w3r n ASP 302 N -5.58 0.00 -0.61 0.00 -0.08 -1.26 -1.63 116.55 107.39 2w3r n ASP 302 Ca -0.13 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.20 2w3r n ASP 302 Cb 0.46 0.00 0.20 0.00 2.34 0.00 0.00 41.12 44.12 2w3r n ASP 302 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2w3r n LEU 303 N 0.00 2.99 -0.20 -2.67 4.77 -1.26 -3.67 117.00 116.95 2w3r n LEU 303 Ca 0.00 -3.64 -0.09 0.00 -0.03 0.00 0.00 56.01 52.25 2w3r n LEU 303 Cb 0.00 -0.53 0.02 0.00 -2.33 0.00 0.00 43.42 40.58 2w3r n LEU 303 CO 0.00 1.18 0.87 0.28 -1.33 0.00 0.00 177.39 178.39 2w3r h SER 304 N 0.82 0.93 0.13 -1.43 0.02 -1.54 -2.55 113.55 109.92 2w3r h SER 304 Ca 0.04 -0.26 0.02 0.00 -0.84 0.00 0.00 61.79 60.75 2w3r h SER 304 Cb 1.16 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.41 2w3r h SER 304 CO 0.09 0.96 -0.40 0.25 -1.14 0.00 0.00 176.83 176.59 2w3r h LEU 305 N 0.86 -1.17 -1.12 5.07 6.46 -1.86 -0.55 115.31 123.00 2w3r h LEU 305 Ca 0.18 0.13 -0.05 0.00 -0.12 0.00 0.00 57.88 58.01 2w3r h LEU 305 Cb 0.43 0.44 -0.01 0.00 -0.73 0.00 0.00 40.66 40.79 2w3r h LEU 305 CO 0.01 -0.48 -0.25 1.55 -0.62 0.00 0.00 178.44 178.65 2w3r h PRO 306 N -0.64 0.00 0.05 5.25 0.13 -1.95 -2.62 132.00 132.23 2w3r h PRO 306 Ca 0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2w3r h PRO 306 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2w3r h PRO 306 CO -0.23 0.25 -0.02 0.28 -0.23 0.00 0.00 178.00 178.05 2w3r h VAL 307 N 0.00 1.02 0.00 1.56 2.07 -0.92 -2.44 116.25 117.55 2w3r h VAL 307 Ca -0.00 -0.23 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 2w3r h VAL 307 Cb 0.75 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2w3r h VAL 307 CO 0.03 0.06 -0.36 0.00 0.02 0.00 0.00 177.57 177.32 2w3r h ASP 309 N 0.00 0.62 1.31 0.00 5.19 -1.30 -2.31 116.42 119.93 2w3r h ASP 309 Ca -0.00 -0.05 -0.12 0.00 -0.62 0.00 0.00 57.03 56.24 2w3r h ASP 309 Cb 0.90 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.24 2w3r h ASP 309 CO 0.05 0.52 -0.71 -0.09 -3.12 0.00 0.00 179.24 175.89 2w3r h ARG 310 N 0.70 0.00 -0.57 3.56 2.43 -1.03 -2.19 114.38 117.29 2w3r h ARG 310 Ca 0.18 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 2w3r h ARG 310 Cb 0.06 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2w3r h ARG 310 CO -0.03 0.47 0.24 0.00 -1.51 0.00 0.00 179.97 179.14 2w3r h ALA 311 N 1.47 0.74 0.21 2.80 0.00 -1.11 -2.22 119.26 121.15 2w3r h ALA 311 Ca -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2w3r h ALA 311 Cb 1.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2w3r h ALA 311 CO 0.06 0.34 -0.10 0.52 0.00 0.00 0.00 179.25 180.07 2w3r h MET 312 N 0.78 -0.27 -1.10 0.00 2.86 -1.42 -2.64 114.93 113.14 2w3r h MET 312 Ca 0.19 0.02 0.31 0.00 -2.06 0.00 0.00 59.70 58.16 2w3r h MET 312 Cb 0.18 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.85 2w3r h MET 312 CO -0.02 0.07 0.78 -0.07 1.06 0.00 0.00 176.91 178.73 2w3r h LEU 313 N -0.66 0.07 -2.63 1.22 4.07 -1.36 -0.39 115.31 115.62 2w3r h LEU 313 Ca -0.03 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2w3r h LEU 313 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 2w3r h LEU 313 CO 0.05 0.01 0.00 1.41 -1.08 0.00 0.00 178.44 178.83 2w3r n HIS 314 N -4.26 0.62 1.44 1.13 8.25 -0.84 -4.45 115.22 117.11 2w3r n HIS 314 Ca 0.24 -0.42 0.10 0.00 -0.26 0.00 0.00 57.72 57.38 2w3r n HIS 314 Cb 1.13 -0.01 0.61 0.00 1.12 0.00 0.00 29.99 32.84 2w3r n HIS 314 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2w3r n ALA 315 N 1.11 2.34 0.67 -1.41 0.00 -0.16 -1.99 120.51 121.07 2w3r n ALA 315 Ca 0.17 -0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2w3r n ALA 315 Cb 0.52 -1.33 0.23 0.00 0.00 0.00 0.00 19.45 18.87 2w3r n ALA 315 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3r n ASP 316 N -0.95 0.64 0.00 0.00 5.75 -1.26 -4.55 116.55 116.19 2w3r n ASP 316 Ca 0.15 0.13 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 2w3r n ASP 316 Cb 0.07 0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2w3r n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w3r n GLY 317 N 1.37 3.76 1.32 6.12 0.00 -0.84 -1.90 105.19 115.01 2w3r n GLY 317 Ca 0.04 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.09 2w3r n GLY 317 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2w3r n SER 318 N 5.70 4.63 -4.28 1.61 7.64 -1.26 -4.56 113.62 123.10 2w3r n SER 318 Ca 0.00 -2.90 -0.28 0.00 1.01 0.00 0.00 58.87 56.71 2w3r n SER 318 Cb 0.00 -0.59 -0.15 0.00 -1.01 0.00 0.00 64.21 62.46 2w3r n SER 318 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2w3r s TYR 319 N -2.65 2.01 -0.32 1.43 1.51 -0.80 -2.93 117.35 115.60 2w3r s TYR 319 Ca 0.47 -0.39 -0.28 0.00 -1.01 0.00 0.00 57.07 55.86 2w3r s TYR 319 Cb 0.36 -1.23 0.01 0.00 -0.11 0.00 0.00 41.96 41.00 2w3r s TYR 319 CO 0.13 0.06 1.02 0.12 -1.11 0.00 0.00 175.55 175.77 2w3r s PHE 320 N -0.72 3.15 -0.19 2.71 5.36 -1.13 -4.88 117.98 122.28 2w3r s PHE 320 Ca 0.09 1.10 -0.01 0.00 -0.96 0.00 0.00 56.93 57.15 2w3r s PHE 320 Cb -0.09 -3.61 0.01 0.00 -0.34 0.00 0.00 43.02 38.99 2w3r s PHE 320 CO 0.01 -0.74 -0.15 0.08 -1.46 0.00 0.00 175.22 172.96 2w3r s VAL 321 N 3.53 2.49 0.48 3.12 1.01 -1.26 -4.76 120.40 125.01 2w3r s VAL 321 Ca 0.43 -0.79 0.23 0.00 0.00 0.00 0.00 61.98 61.84 2w3r s VAL 321 Cb -0.12 -2.08 0.27 0.00 0.00 0.00 0.00 36.38 34.45 2w3r s VAL 321 CO 0.15 0.50 2.10 -0.65 0.00 0.00 0.00 175.10 177.20 2w3r h PRO 322 N 7.98 0.00 -3.36 2.72 0.11 -1.78 -3.41 132.00 134.26 2w3r h PRO 322 Ca -0.44 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.41 2w3r h PRO 322 Cb 1.15 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.94 2w3r h PRO 322 CO 0.63 0.10 -0.64 0.00 -0.21 0.00 0.00 178.00 177.87 2w3r s ALA 323 N -4.52 -0.15 -0.15 -0.75 0.00 -1.16 -4.53 121.76 110.50 2w3r s ALA 323 Ca -0.04 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 2w3r s ALA 323 Cb 0.15 -0.37 0.04 0.00 0.00 0.00 0.00 23.12 22.94 2w3r s ALA 323 CO 0.62 -0.13 0.39 -1.17 0.00 0.00 0.00 175.76 175.46 2w3r s LEU 324 N 1.06 0.40 -0.00 0.00 0.20 0.08 -2.07 118.68 118.35 2w3r s LEU 324 Ca -0.08 0.79 0.02 0.00 0.69 0.00 0.00 54.13 55.55 2w3r s LEU 324 Cb -0.11 1.31 -0.01 0.00 -0.43 0.00 0.00 46.19 46.95 2w3r s LEU 324 CO -0.05 -0.15 -0.07 -0.60 -0.29 0.00 0.00 176.35 175.20 2w3r s ARG 325 N 0.47 0.55 -0.04 1.98 3.52 -0.65 -0.12 118.95 124.65 2w3r s ARG 325 Ca -0.02 -0.25 0.04 0.00 -0.13 0.00 0.00 55.73 55.36 2w3r s ARG 325 Cb -0.04 -0.53 -0.00 0.00 -1.56 0.00 0.00 34.95 32.82 2w3r s ARG 325 CO -0.02 0.14 -0.15 0.42 -0.81 0.00 0.00 175.30 174.88 2w3r s ILE 326 N -0.19 1.24 -0.27 4.11 1.01 -0.40 0.08 121.20 126.78 2w3r s ILE 326 Ca 0.02 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.07 2w3r s ILE 326 Cb -0.03 -1.07 0.05 0.00 0.01 0.00 0.00 42.46 41.43 2w3r s ILE 326 CO -0.00 0.36 -0.07 -0.70 0.00 0.00 0.00 174.94 174.53 2w3r s GLU 327 N 0.08 2.35 -0.37 2.79 2.12 -0.24 -1.89 118.70 123.54 2w3r s GLU 327 Ca -0.03 -1.29 -0.05 0.00 0.36 0.00 0.00 54.97 53.95 2w3r s GLU 327 Cb -0.11 -3.00 0.07 0.00 0.26 0.00 0.00 34.13 31.35 2w3r s GLU 327 CO 0.02 -0.57 0.14 0.45 -0.54 0.00 0.00 175.26 174.76 2w3r s SER 328 N 1.17 5.29 -0.41 -1.70 0.15 0.96 0.02 113.70 119.19 2w3r s SER 328 Ca -0.07 -1.46 -0.15 0.00 0.70 0.00 0.00 55.95 54.97 2w3r s SER 328 Cb -0.20 -1.86 0.02 0.00 -1.71 0.00 0.00 66.02 62.27 2w3r s SER 328 CO -0.04 -0.41 0.32 -1.00 1.20 0.00 0.00 173.24 173.31 2w3r s HIS 329 N 1.32 3.22 -1.14 3.44 3.76 0.47 -1.52 115.29 124.84 2w3r s HIS 329 Ca 0.01 -0.51 -0.13 0.00 -0.15 0.00 0.00 55.06 54.28 2w3r s HIS 329 Cb -0.21 -2.64 0.20 0.00 1.11 0.00 0.00 32.58 31.03 2w3r s HIS 329 CO 0.00 -0.59 1.30 -0.98 -0.85 0.00 0.00 174.74 173.62 2w3r s ARG 330 N 1.78 4.05 0.17 1.40 3.03 -1.26 -1.52 118.95 126.61 2w3r s ARG 330 Ca 0.07 -2.66 -0.30 0.00 2.03 0.00 0.00 55.73 54.86 2w3r s ARG 330 Cb -0.18 -4.90 -0.07 0.00 -1.03 0.00 0.00 34.95 28.77 2w3r s ARG 330 CO 0.11 -1.62 0.95 -0.51 -1.13 0.00 0.00 175.30 173.10 2w3r s LEU 331 N 0.91 4.57 -0.06 -1.89 1.43 -0.63 0.35 118.68 123.36 2w3r s LEU 331 Ca 0.38 1.87 -0.21 0.00 -1.03 0.00 0.00 54.13 55.13 2w3r s LEU 331 Cb -0.05 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2w3r s LEU 331 CO -0.03 0.04 0.62 -0.60 0.23 0.00 0.00 176.35 176.61 2w3r s ARG 332 N -0.57 4.39 0.10 1.70 3.52 0.96 -1.23 118.95 127.82 2w3r s ARG 332 Ca 0.44 0.75 0.05 0.00 -0.13 0.00 0.00 55.73 56.83 2w3r s ARG 332 Cb -0.25 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.69 2w3r s ARG 332 CO 0.31 0.17 -0.12 0.95 -0.81 0.00 0.00 175.30 175.80 2w3r s THR 333 N 0.48 1.08 0.00 4.11 -4.23 -1.02 -4.51 115.64 111.55 2w3r s THR 333 Ca 0.33 -1.61 -0.02 0.00 -1.18 0.00 0.00 61.69 59.21 2w3r s THR 333 Cb -0.17 -1.36 -0.09 0.00 1.34 0.00 0.00 72.50 72.22 2w3r s THR 333 CO 0.16 -0.46 2.07 0.59 -0.54 0.00 0.00 174.62 176.44 2w3r n ASN 334 N 0.67 3.80 -4.48 3.99 5.03 0.15 -0.74 115.26 123.68 2w3r n ASN 334 Ca -0.17 -2.10 -0.29 0.00 0.87 0.00 0.00 54.58 52.89 2w3r n ASN 334 Cb 0.57 -0.91 -0.08 0.00 -1.02 0.00 0.00 39.78 38.33 2w3r n ASN 334 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2w3r s THR 335 N 1.05 1.02 0.23 3.41 -4.23 -1.26 -4.38 115.64 111.48 2w3r s THR 335 Ca 0.23 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.44 2w3r s THR 335 Cb 0.11 -2.36 -0.15 0.00 1.34 0.00 0.00 72.50 71.44 2w3r s THR 335 CO 0.00 0.00 1.07 0.00 -0.54 0.00 0.00 174.62 175.15 2w3r n GLN 336 N -1.06 1.20 -2.10 3.99 3.00 -1.26 -1.07 117.38 120.08 2w3r n GLN 336 Ca -0.12 0.42 -0.41 0.00 -0.01 0.00 0.00 57.00 56.89 2w3r n GLN 336 Cb 0.66 -1.84 -0.03 0.00 0.00 0.00 0.00 30.24 29.03 2w3r n GLN 336 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2w3r s SER 337 N -0.29 5.77 0.67 1.08 0.15 -1.26 -4.06 113.70 115.75 2w3r s SER 337 Ca 0.66 0.80 -0.16 0.00 0.70 0.00 0.00 55.95 57.95 2w3r s SER 337 Cb -0.79 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 61.00 2w3r s SER 337 CO 0.56 -1.90 1.18 0.20 1.20 0.00 0.00 173.24 174.48 2w3r s ASN 338 N 6.29 4.74 0.00 5.45 0.01 -0.73 -3.77 114.94 126.95 2w3r s ASN 338 Ca 0.70 2.26 0.00 0.00 -0.71 0.00 0.00 52.86 55.11 2w3r s ASN 338 Cb -0.17 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.91 2w3r s ASN 338 CO 0.28 -1.89 0.00 1.07 -1.51 0.00 0.00 177.10 175.05 2w3r n THR 339 N -2.30 0.00 -2.38 1.60 5.66 -0.52 -4.28 114.28 112.06 2w3r n THR 339 Ca 0.13 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.75 2w3r n THR 339 Cb 0.51 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.26 2w3r n THR 339 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2w3r s ALA 340 N -2.00 3.09 -0.28 1.79 0.00 -1.26 -4.54 121.76 118.56 2w3r s ALA 340 Ca 0.00 0.86 -0.07 0.00 0.00 0.00 0.00 51.96 52.75 2w3r s ALA 340 Cb 0.00 -3.34 0.13 0.00 0.00 0.00 0.00 23.12 19.91 2w3r s ALA 340 CO 0.00 -0.44 0.58 0.12 0.00 0.00 0.00 175.76 176.02 2w3r s PHE 341 N -1.53 -1.26 0.00 0.00 5.99 -1.26 -3.45 117.98 116.48 2w3r s PHE 341 Ca 0.59 1.97 0.00 0.00 0.00 0.00 0.00 56.93 59.49 2w3r s PHE 341 Cb -0.27 0.62 0.00 0.00 0.00 0.00 0.00 43.02 43.37 2w3r s PHE 341 CO 0.34 -0.67 0.00 -2.13 -0.00 0.00 0.00 175.22 172.75 2w3r n ARG 342 N 5.43 0.00 0.00 10.12 0.63 -0.47 -0.48 116.66 131.89 2w3r n ARG 342 Ca -0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.84 2w3r n ARG 342 Cb 0.50 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.41 2w3r n ARG 342 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w3r n GLY 343 N 0.00 1.41 3.48 5.14 0.00 -1.26 -4.91 105.19 109.06 2w3r n GLY 343 Ca 0.00 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 2w3r n GLY 343 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2w3r n PHE 344 N 0.00 -2.17 0.00 1.61 7.35 0.37 -1.29 117.46 123.34 2w3r n PHE 344 Ca 0.00 0.76 0.00 0.00 -0.76 0.00 0.00 57.45 57.45 2w3r n PHE 344 Cb 0.00 -4.12 0.00 0.00 0.35 0.00 0.00 39.48 35.71 2w3r n PHE 344 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2w3r n GLY 345 N -1.41 3.01 0.14 7.13 0.00 -1.26 -4.53 105.19 108.27 2w3r n GLY 345 Ca -0.15 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 2w3r n GLY 345 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2w3r h GLY 346 N 0.00 0.32 2.00 -0.02 0.00 -1.37 -2.87 103.07 101.14 2w3r h GLY 346 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 2w3r h GLY 346 CO 0.00 -0.04 -0.12 -2.55 0.00 0.00 0.00 176.54 173.83 2w3r h PRO 347 N 0.13 0.00 -0.03 4.80 0.11 -1.90 -1.81 132.00 133.29 2w3r h PRO 347 Ca 0.14 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 2w3r h PRO 347 Cb 0.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.28 2w3r h PRO 347 CO -0.22 0.12 -0.02 1.96 -0.21 0.00 0.00 178.00 179.63 2w3r h GLN 348 N 0.00 0.07 -0.93 1.05 7.50 -1.89 -1.59 115.11 119.32 2w3r h GLN 348 Ca -0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.11 2w3r h GLN 348 Cb 0.23 -0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.72 2w3r h GLN 348 CO 0.02 0.51 0.55 0.78 -1.50 0.00 0.00 178.83 179.18 2w3r h GLY 349 N -0.37 1.36 0.87 3.46 0.00 -1.34 -1.82 103.07 105.24 2w3r h GLY 349 Ca 0.01 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 46.72 2w3r h GLY 349 CO 0.01 0.56 0.01 0.00 0.00 0.00 0.00 176.54 177.12 2w3r h ALA 350 N 1.30 0.38 -0.39 3.60 0.00 -1.23 -2.87 119.26 120.05 2w3r h ALA 350 Ca 0.33 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2w3r h ALA 350 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2w3r h ALA 350 CO -0.06 0.10 0.07 1.25 0.00 0.00 0.00 179.25 180.61 2w3r h LEU 351 N 0.28 0.54 -0.23 0.00 5.85 -1.08 -0.20 115.31 120.48 2w3r h LEU 351 Ca 0.08 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.72 2w3r h LEU 351 Cb 0.40 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2w3r h LEU 351 CO 0.01 0.56 0.13 1.23 -0.34 0.00 0.00 178.44 180.03 2w3r h GLY 352 N 0.82 0.31 1.73 3.75 0.00 -1.26 0.28 103.07 108.70 2w3r h GLY 352 Ca 0.13 -0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2w3r h GLY 352 CO 0.00 0.09 -0.12 1.98 0.00 0.00 0.00 176.54 178.50 2w3r h MET 353 N 0.28 0.33 -0.01 4.80 1.85 -1.23 -2.32 114.93 118.62 2w3r h MET 353 Ca 0.09 -0.08 -0.22 0.00 -0.61 0.00 0.00 59.70 58.88 2w3r h MET 353 Cb -0.01 -0.04 0.02 0.00 0.43 0.00 0.00 31.60 32.00 2w3r h MET 353 CO -0.04 0.46 -0.83 0.93 -0.40 0.00 0.00 176.91 177.02 2w3r h GLU 354 N 0.31 0.59 -0.72 0.39 4.39 -0.52 -1.95 114.58 117.07 2w3r h GLU 354 Ca 0.06 -0.62 -0.05 0.00 0.34 0.00 0.00 59.36 59.10 2w3r h GLU 354 Cb 0.40 0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 2w3r h GLU 354 CO 0.02 1.23 0.26 -0.09 -1.16 0.00 0.00 179.01 179.27 2w3r h ARG 355 N 0.20 1.10 0.10 2.33 1.12 -0.43 -1.23 114.38 117.57 2w3r h ARG 355 Ca -0.10 -0.22 -0.00 0.00 -1.11 0.00 0.00 59.98 58.55 2w3r h ARG 355 Cb 1.51 -0.17 0.00 0.00 -0.01 0.00 0.00 29.97 31.30 2w3r h ARG 355 CO 0.16 0.92 -0.05 0.00 -3.11 0.00 0.00 179.97 177.90 2w3r h ALA 356 N 1.13 -0.13 0.00 2.80 0.00 -1.43 -0.99 119.26 120.64 2w3r h ALA 356 Ca 0.24 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2w3r h ALA 356 Cb 0.25 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2w3r h ALA 356 CO -0.01 -0.47 -0.30 0.97 0.00 0.00 0.00 179.25 179.43 2w3r h ILE 357 N -0.33 1.03 -0.21 0.00 2.10 -1.30 -0.21 117.51 118.59 2w3r h ILE 357 Ca -0.01 -1.10 -0.05 0.00 1.08 0.00 0.00 64.86 64.78 2w3r h ILE 357 Cb 0.28 1.62 -0.01 0.00 -1.09 0.00 0.00 36.82 37.63 2w3r h ILE 357 CO 0.02 0.29 -0.05 -0.08 -1.08 0.00 0.00 178.15 177.26 2w3r h GLU 358 N 0.00 0.41 -0.46 2.19 4.57 -1.11 -2.03 114.58 118.14 2w3r h GLU 358 Ca -0.00 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.01 2w3r h GLU 358 Cb 0.60 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 2w3r h GLU 358 CO 0.04 0.65 0.24 1.25 -1.18 0.00 0.00 179.01 180.01 2w3r h HIS 359 N 0.13 0.65 -0.10 0.92 2.76 -0.54 -1.52 115.15 117.44 2w3r h HIS 359 Ca 0.05 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2w3r h HIS 359 Cb 0.50 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.23 2w3r h HIS 359 CO 0.05 0.50 -0.04 1.25 -1.30 0.00 0.00 177.93 178.39 2w3r h LEU 360 N 0.61 -0.15 -0.43 0.26 5.85 -1.07 0.81 115.31 121.19 2w3r h LEU 360 Ca 0.16 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.99 2w3r h LEU 360 Cb 0.08 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 2w3r h LEU 360 CO -0.02 -0.06 0.08 0.00 -0.34 0.00 0.00 178.44 178.09 2w3r h ALA 361 N 1.07 0.46 -0.40 1.25 0.00 -1.16 -1.86 119.26 118.63 2w3r h ALA 361 Ca 0.06 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2w3r h ALA 361 Cb 0.11 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2w3r h ALA 361 CO -0.12 -0.33 -0.04 0.00 0.00 0.00 0.00 179.25 178.76 2w3r h ARG 362 N 0.20 0.66 -0.37 0.00 2.47 -0.98 0.12 114.38 116.48 2w3r h ARG 362 Ca 0.21 -0.17 -0.06 0.00 -1.26 0.00 0.00 59.98 58.70 2w3r h ARG 362 Cb 0.26 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 2w3r h ARG 362 CO -0.28 0.71 -0.01 0.78 0.56 0.00 0.00 179.97 181.73 2w3r h GLY 363 N 0.94 0.63 -2.53 0.04 0.00 -0.05 -2.50 103.07 99.59 2w3r h GLY 363 Ca 0.12 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2w3r h GLY 363 CO 0.02 0.36 0.00 1.15 0.00 0.00 0.00 176.54 178.07 2w3r n MET 364 N -4.26 3.38 -3.72 4.80 0.00 -0.87 -4.97 117.12 111.47 2w3r n MET 364 Ca 0.02 -2.71 -0.24 0.00 0.00 0.00 0.00 57.70 54.77 2w3r n MET 364 Cb 0.26 -1.74 0.04 0.00 0.00 0.00 0.00 33.22 31.78 2w3r n MET 364 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w3r n GLY 365 N 0.89 -0.38 3.47 3.17 0.00 -0.82 -5.00 105.19 106.51 2w3r n GLY 365 Ca 0.23 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 46.11 2w3r n GLY 365 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3r s ARG 366 N -6.13 1.73 -0.07 1.61 3.52 0.34 -5.02 118.95 114.94 2w3r s ARG 366 Ca 0.25 -1.20 -0.29 0.00 -0.13 0.00 0.00 55.73 54.36 2w3r s ARG 366 Cb -0.12 -2.08 -0.07 0.00 -1.56 0.00 0.00 34.95 31.12 2w3r s ARG 366 CO 0.80 0.48 1.90 0.34 -0.81 0.00 0.00 175.30 178.01 2w3r s ASP 367 N -2.09 6.29 0.25 -2.12 2.15 -1.26 -4.36 116.67 115.53 2w3r s ASP 367 Ca 0.17 2.29 -0.05 0.00 0.43 0.00 0.00 52.55 55.39 2w3r s ASP 367 Cb -0.10 -2.53 0.34 0.00 -0.30 0.00 0.00 42.92 40.33 2w3r s ASP 367 CO 0.09 -1.23 1.87 -0.65 -0.17 0.00 0.00 175.17 175.08 2w3r h PRO 368 N 11.26 1.06 -0.19 4.34 0.11 -1.94 -1.73 132.00 144.91 2w3r h PRO 368 Ca -0.44 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.65 2w3r h PRO 368 Cb 1.21 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 32.05 2w3r h PRO 368 CO 0.96 0.70 -0.06 0.00 -0.21 0.00 0.00 178.00 179.38 2w3r h ALA 369 N 1.41 0.10 -0.71 -0.75 0.00 -1.90 -0.81 119.26 116.60 2w3r h ALA 369 Ca 0.39 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.40 2w3r h ALA 369 Cb 0.12 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2w3r h ALA 369 CO -0.16 -0.49 0.45 1.49 0.00 0.00 0.00 179.25 180.54 2w3r h GLU 370 N -0.03 0.87 -0.32 0.00 4.81 -1.75 0.21 114.58 118.37 2w3r h GLU 370 Ca 0.10 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2w3r h GLU 370 Cb 0.17 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2w3r h GLU 370 CO -0.21 0.58 0.10 1.25 -0.73 0.00 0.00 179.01 180.00 2w3r h LEU 371 N 0.90 0.46 -0.22 1.64 5.85 -0.96 0.09 115.31 123.07 2w3r h LEU 371 Ca 0.28 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2w3r h LEU 371 Cb -0.02 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2w3r h LEU 371 CO -0.10 0.54 0.14 0.03 -0.34 0.00 0.00 178.44 178.72 2w3r h ARG 372 N 0.36 0.30 -0.69 1.25 3.08 -0.96 -2.20 114.38 115.52 2w3r h ARG 372 Ca 0.10 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.23 2w3r h ARG 372 Cb 0.24 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 2w3r h ARG 372 CO -0.00 0.22 0.30 0.00 -1.07 0.00 0.00 179.97 179.42 2w3r h ALA 373 N 1.06 0.94 0.00 0.04 0.00 -0.73 0.59 119.26 121.16 2w3r h ALA 373 Ca 0.08 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2w3r h ALA 373 Cb -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2w3r h ALA 373 CO -0.02 -0.13 -0.10 1.25 0.00 0.00 0.00 179.25 180.25 2w3r h LEU 374 N 0.50 0.00 -3.07 0.00 5.85 -0.70 -3.23 115.31 114.67 2w3r h LEU 374 Ca 0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2w3r h LEU 374 Cb 0.43 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 2w3r h LEU 374 CO -0.31 0.10 0.00 0.59 -0.34 0.00 0.00 178.44 178.48 2w3r n ASN 375 N -4.20 3.28 -4.64 1.25 3.02 0.10 -4.97 115.26 109.10 2w3r n ASN 375 Ca -0.03 -2.52 -0.29 0.00 -0.03 0.00 0.00 54.58 51.72 2w3r n ASN 375 Cb 0.18 -0.37 0.18 0.00 -0.61 0.00 0.00 39.78 39.16 2w3r n ASN 375 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2w3r s PHE 376 N -1.92 1.94 0.71 3.10 2.99 -0.59 -2.84 117.98 121.37 2w3r s PHE 376 Ca 0.31 1.24 -0.13 0.00 0.00 0.00 0.00 56.93 58.35 2w3r s PHE 376 Cb 0.22 -3.19 0.02 0.00 0.00 0.00 0.00 43.02 40.08 2w3r s PHE 376 CO 0.11 -2.94 1.09 0.71 -0.00 0.00 0.00 175.22 174.20 2w3r s TYR 377 N -2.78 2.69 0.46 0.36 1.51 -1.15 -4.40 117.35 114.03 2w3r s TYR 377 Ca 0.65 1.53 -0.21 0.00 -1.01 0.00 0.00 57.07 58.04 2w3r s TYR 377 Cb -0.20 -3.07 -0.09 0.00 -0.11 0.00 0.00 41.96 38.48 2w3r s TYR 377 CO 0.59 -1.63 1.01 -0.51 -1.11 0.00 0.00 175.55 173.89 2w3r s ASP 378 N -3.09 6.58 0.83 2.29 1.01 -1.26 -4.76 116.67 118.27 2w3r s ASP 378 Ca 0.63 1.85 -0.12 0.00 0.71 0.00 0.00 52.55 55.63 2w3r s ASP 378 Cb -0.18 -2.55 0.10 0.00 1.01 0.00 0.00 42.92 41.29 2w3r s ASP 378 CO 0.49 -0.61 1.15 -2.84 0.21 0.00 0.00 175.17 173.57 2w3r s PRO 379 N -3.16 1.60 0.49 8.23 0.02 -1.25 -4.42 135.00 136.51 2w3r s PRO 379 Ca 0.65 1.54 -0.24 0.00 0.02 0.00 0.00 61.00 62.97 2w3r s PRO 379 Cb -0.14 -1.79 -0.07 0.00 0.02 0.00 0.00 34.50 32.52 2w3r s PRO 379 CO 0.18 -2.20 1.39 -2.14 -0.33 0.00 0.00 177.00 173.90 2w3r s PRO 380 N -4.47 3.45 0.08 5.54 0.02 -1.26 -4.95 135.00 133.41 2w3r s PRO 380 Ca 0.68 2.31 0.00 0.00 0.02 0.00 0.00 61.00 64.01 2w3r s PRO 380 Cb -0.24 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 31.81 2w3r s PRO 380 CO 0.54 -0.97 0.00 0.39 -0.33 0.00 0.00 177.00 176.63 2w3r n GLU 381 N -0.56 -4.03 -0.64 5.54 4.71 -1.26 -5.12 120.64 119.28 2w3r n GLU 381 Ca 0.07 2.88 0.05 0.00 -0.01 0.00 0.00 57.16 60.15 2w3r n GLU 381 Cb 0.43 -3.50 -0.03 0.00 -1.01 0.00 0.00 31.44 27.33 2w3r n GLU 381 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2w3r n LYS 398 N 1.88 -1.54 -3.14 3.49 4.01 -1.26 -5.17 118.16 116.42 2w3r n LYS 398 Ca 0.00 1.24 -0.36 0.00 -0.51 0.00 0.00 58.31 58.68 2w3r n LYS 398 Cb 0.00 -1.69 -0.06 0.00 -0.51 0.00 0.00 35.03 32.77 2w3r n LYS 398 CO 0.00 0.00 0.00 -1.59 -1.11 0.00 0.00 177.40 174.70 2w3r s LYS 399 N -3.91 4.20 0.35 1.97 0.00 -1.26 -5.04 119.74 116.04 2w3r s LYS 399 Ca 0.00 0.80 -0.27 0.00 0.00 0.00 0.00 55.97 56.50 2w3r s LYS 399 Cb 0.00 -2.87 -0.09 0.00 0.00 0.00 0.00 37.83 34.86 2w3r s LYS 399 CO 0.00 0.40 1.22 0.99 0.00 0.00 0.00 175.35 177.96 2w3r s THR 400 N -1.53 3.01 0.49 3.79 2.01 -1.26 -4.99 115.64 117.16 2w3r s THR 400 Ca 0.42 0.95 -0.24 0.00 0.31 0.00 0.00 61.69 63.14 2w3r s THR 400 Cb -0.16 -3.58 -0.07 0.00 0.01 0.00 0.00 72.50 68.70 2w3r s THR 400 CO 0.21 0.18 1.40 -1.10 -0.69 0.00 0.00 174.62 174.61 2w3r s GLN 401 N -1.93 3.46 0.28 4.92 -0.21 -1.26 -4.88 119.66 120.05 2w3r s GLN 401 Ca 0.51 2.35 0.09 0.00 0.02 0.00 0.00 55.36 58.33 2w3r s GLN 401 Cb -0.35 -2.49 -0.04 0.00 1.00 0.00 0.00 33.01 31.12 2w3r s GLN 401 CO 0.45 -0.97 0.02 0.95 -2.12 0.00 0.00 175.29 173.62 2w3r s THR 402 N -1.24 3.31 1.11 -0.19 -4.23 -1.26 -2.02 115.64 111.12 2w3r s THR 402 Ca 0.65 -1.89 -0.17 0.00 -1.18 0.00 0.00 61.69 59.10 2w3r s THR 402 Cb -0.42 -2.86 0.25 0.00 1.34 0.00 0.00 72.50 70.81 2w3r s THR 402 CO 0.53 -0.33 1.14 0.42 -0.54 0.00 0.00 174.62 175.84 2w3r s THR 403 N -2.36 1.75 0.31 3.99 -4.23 0.25 -4.82 115.64 110.53 2w3r s THR 403 Ca 0.33 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.13 2w3r s THR 403 Cb -0.05 -2.60 0.31 0.00 1.34 0.00 0.00 72.50 71.50 2w3r s THR 403 CO 0.20 0.00 2.02 1.12 -0.54 0.00 0.00 174.62 177.42 2w3r h HIS 404 N -2.25 0.00 -0.38 3.99 2.07 -1.91 -0.62 115.15 116.06 2w3r h HIS 404 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2w3r h HIS 404 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 2w3r h HIS 404 CO -1.44 0.12 0.00 2.48 -3.07 0.00 0.00 177.93 176.02 2w3r n TYR 405 N -3.42 0.50 -2.56 6.12 0.18 -1.26 -4.59 117.16 112.12 2w3r n TYR 405 Ca -0.01 -0.25 -0.05 0.00 1.88 0.00 0.00 57.90 59.47 2w3r n TYR 405 Cb 0.29 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.27 2w3r n TYR 405 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2w3r n GLY 406 N 1.28 0.46 3.33 -7.48 0.00 -0.24 -1.74 105.19 100.80 2w3r n GLY 406 Ca 0.17 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 2w3r n GLY 406 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3r s GLN 407 N -4.86 3.31 0.25 1.61 0.74 -1.25 -4.42 119.66 115.03 2w3r s GLN 407 Ca 0.08 -0.73 -0.30 0.00 0.05 0.00 0.00 55.36 54.46 2w3r s GLN 407 Cb -0.03 -2.57 -0.10 0.00 1.10 0.00 0.00 33.01 31.40 2w3r s GLN 407 CO 0.17 0.18 1.46 -1.21 -0.55 0.00 0.00 175.29 175.34 2w3r s GLU 408 N 0.41 4.25 -0.93 1.67 2.02 -1.26 -0.58 118.70 124.27 2w3r s GLU 408 Ca -0.12 2.33 -0.02 0.00 0.02 0.00 0.00 54.97 57.19 2w3r s GLU 408 Cb -0.16 -3.10 0.26 0.00 0.10 0.00 0.00 34.13 31.22 2w3r s GLU 408 CO 0.06 -0.45 1.01 0.28 0.02 0.00 0.00 175.26 176.17 2w3r n VAL 409 N 2.38 3.74 -0.39 2.63 0.31 -0.86 -4.87 118.33 121.27 2w3r n VAL 409 Ca 0.07 -5.39 0.01 0.00 -0.01 0.00 0.00 64.34 59.03 2w3r n VAL 409 Cb 0.40 -2.28 0.26 0.00 -0.91 0.00 0.00 33.84 31.31 2w3r n VAL 409 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2w3r n ALA 410 N 1.85 3.70 -2.01 3.52 0.00 -1.26 -4.12 120.51 122.19 2w3r n ALA 410 Ca 0.25 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 52.20 2w3r n ALA 410 Cb 0.37 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2w3r n ALA 410 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3r n ASP 411 N 0.27 0.01 -4.59 0.00 5.75 -1.26 -4.58 116.55 112.15 2w3r n ASP 411 Ca 0.24 -1.90 -0.43 0.00 -0.01 0.00 0.00 54.79 52.69 2w3r n ASP 411 Cb 1.00 -0.18 -0.03 0.00 -1.03 0.00 0.00 41.12 40.88 2w3r n ASP 411 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w3r n VAL 413 N 6.70 0.81 -0.10 0.00 0.24 -1.26 -3.88 118.33 120.84 2w3r n VAL 413 Ca 0.10 -0.90 -0.02 0.00 -2.04 0.00 0.00 64.34 61.48 2w3r n VAL 413 Cb 0.49 0.67 0.23 0.00 -1.47 0.00 0.00 33.84 33.76 2w3r n VAL 413 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2w3r h LEU 414 N 3.49 0.70 -0.06 1.34 3.38 -1.89 -1.17 115.31 121.10 2w3r h LEU 414 Ca 0.00 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2w3r h LEU 414 Cb 0.87 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 2w3r h LEU 414 CO 0.00 0.69 -0.23 1.23 0.09 0.00 0.00 178.44 180.22 2w3r h GLY 415 N 0.92 -0.30 0.78 0.83 0.00 -1.85 0.15 103.07 103.60 2w3r h GLY 415 Ca 0.16 0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.75 2w3r h GLY 415 CO -0.00 -0.20 -0.02 -2.09 0.00 0.00 0.00 176.54 174.23 2w3r h GLU 416 N -0.34 0.30 0.44 4.80 4.81 -1.86 -3.02 114.58 119.71 2w3r h GLU 416 Ca 0.08 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2w3r h GLU 416 Cb 0.45 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2w3r h GLU 416 CO -0.25 0.54 -0.27 1.25 -0.73 0.00 0.00 179.01 179.55 2w3r h LEU 417 N 0.02 -0.68 -0.74 1.64 6.46 -1.10 -2.15 115.31 118.75 2w3r h LEU 417 Ca 0.04 0.04 0.09 0.00 -0.12 0.00 0.00 57.88 57.94 2w3r h LEU 417 Cb 0.42 0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.48 2w3r h LEU 417 CO 0.01 -0.43 0.39 0.58 -0.62 0.00 0.00 178.44 178.37 2w3r h VAL 418 N -0.68 0.88 0.00 1.05 2.07 -1.06 -1.01 116.25 117.50 2w3r h VAL 418 Ca -0.05 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.27 2w3r h VAL 418 Cb 0.56 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2w3r h VAL 418 CO 0.05 0.12 -0.26 0.74 0.02 0.00 0.00 177.57 178.24 2w3r h THR 419 N 0.66 0.42 -0.44 2.57 2.02 -1.37 -0.93 112.91 115.84 2w3r h THR 419 Ca 0.36 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.63 2w3r h THR 419 Cb 0.35 0.42 -0.08 0.00 -1.74 0.00 0.00 68.15 67.10 2w3r h THR 419 CO -0.26 0.00 -0.06 -0.09 0.37 0.00 0.00 175.52 175.49 2w3r h ARG 420 N -0.40 0.05 -0.38 6.66 2.43 -0.66 -2.47 114.38 119.62 2w3r h ARG 420 Ca 0.06 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 2w3r h ARG 420 Cb 0.48 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2w3r h ARG 420 CO -0.22 0.03 0.01 1.25 -1.51 0.00 0.00 179.97 179.53 2w3r h LEU 421 N 0.05 0.56 -0.74 3.80 5.85 -0.80 -2.12 115.31 121.90 2w3r h LEU 421 Ca 0.21 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 2w3r h LEU 421 Cb 0.32 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2w3r h LEU 421 CO -0.41 0.62 -0.27 1.56 -0.34 0.00 0.00 178.44 179.60 2w3r h GLN 422 N 0.57 0.66 -0.06 1.25 4.20 -0.73 -1.47 115.11 119.53 2w3r h GLN 422 Ca 0.12 -0.28 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 2w3r h GLN 422 Cb 0.35 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.10 2w3r h GLN 422 CO 0.01 0.86 -0.21 0.87 -0.67 0.00 0.00 178.83 179.69 2w3r h LYS 423 N 0.58 0.26 -0.15 1.46 1.79 -1.25 0.14 116.57 119.39 2w3r h LYS 423 Ca 0.08 -0.19 -0.07 0.00 -2.18 0.00 0.00 60.65 58.29 2w3r h LYS 423 Cb 0.76 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.43 2w3r h LYS 423 CO 0.06 0.82 -0.21 0.66 -1.08 0.00 0.00 179.45 179.70 2w3r h SER 424 N -0.26 0.25 0.35 0.86 4.64 -1.38 -2.27 113.55 115.75 2w3r h SER 424 Ca -0.01 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2w3r h SER 424 Cb 0.84 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2w3r h SER 424 CO 0.05 0.47 -0.18 0.00 -0.87 0.00 0.00 176.83 176.30 2w3r n ALA 425 N -2.48 2.90 -3.40 5.18 0.00 -0.56 -4.97 120.51 117.19 2w3r n ALA 425 Ca -0.01 -0.31 -0.19 0.00 0.00 0.00 0.00 53.44 52.93 2w3r n ALA 425 Cb 0.33 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 18.57 2w3r n ALA 425 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2w3r n ASN 426 N -0.90 -6.31 0.04 0.00 4.05 -0.85 -4.91 115.26 106.38 2w3r n ASN 426 Ca 0.13 -0.72 -0.11 0.00 0.45 0.00 0.00 54.58 54.32 2w3r n ASN 426 Cb 0.31 -4.41 -0.08 0.00 1.23 0.00 0.00 39.78 36.82 2w3r n ASN 426 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 2w3r h PHE 427 N -1.06 -0.17 -0.29 1.20 3.57 -0.99 -2.61 116.94 116.58 2w3r h PHE 427 Ca -0.53 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 60.97 2w3r h PHE 427 Cb 1.28 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 2w3r h PHE 427 CO 0.29 0.29 0.17 1.15 -2.23 0.00 0.00 178.31 177.99 2w3r h THR 428 N -0.80 1.11 -0.04 4.41 2.02 -1.93 -1.12 112.91 116.55 2w3r h THR 428 Ca -0.02 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2w3r h THR 428 Cb 0.54 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.70 2w3r h THR 428 CO 0.03 0.10 0.02 0.74 0.37 0.00 0.00 175.52 176.78 2w3r h THR 429 N 0.37 1.14 -0.92 3.16 2.02 -1.96 -2.72 112.91 113.99 2w3r h THR 429 Ca 0.10 -0.42 0.10 0.00 0.77 0.00 0.00 66.41 66.97 2w3r h THR 429 Cb 0.02 1.34 -0.08 0.00 -1.74 0.00 0.00 68.15 67.69 2w3r h THR 429 CO -0.02 0.12 0.56 0.03 0.37 0.00 0.00 175.52 176.58 2w3r h ARG 430 N -0.09 0.90 -0.50 6.66 3.08 -1.31 -0.40 114.38 122.71 2w3r h ARG 430 Ca 0.01 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2w3r h ARG 430 Cb 0.17 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2w3r h ARG 430 CO -0.00 0.60 0.30 -0.09 -1.07 0.00 0.00 179.97 179.70 2w3r h ARG 431 N 0.93 0.68 -0.43 0.04 2.43 -1.08 -0.73 114.38 116.22 2w3r h ARG 431 Ca 0.44 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.52 2w3r h ARG 431 Cb 0.39 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2w3r h ARG 431 CO -0.24 0.50 0.15 0.00 -1.51 0.00 0.00 179.97 178.86 2w3r h ALA 432 N 1.14 0.56 -0.22 2.80 0.00 -1.10 -1.88 119.26 120.56 2w3r h ALA 432 Ca 0.18 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2w3r h ALA 432 Cb -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2w3r h ALA 432 CO -0.03 0.20 0.15 0.93 0.00 0.00 0.00 179.25 180.49 2w3r h GLU 433 N 0.55 0.21 -0.06 0.00 5.08 -0.66 -1.50 114.58 118.21 2w3r h GLU 433 Ca 0.14 -0.01 -0.25 0.00 -1.00 0.00 0.00 59.36 58.24 2w3r h GLU 433 Cb 0.24 -0.05 0.02 0.00 0.50 0.00 0.00 28.75 29.46 2w3r h GLU 433 CO -0.01 0.14 -0.95 0.82 -1.00 0.00 0.00 179.01 178.02 2w3r h ILE 434 N 0.22 1.28 -0.51 3.13 2.04 -0.90 -2.57 117.51 120.20 2w3r h ILE 434 Ca 0.09 -2.15 0.08 0.00 1.00 0.00 0.00 64.86 63.88 2w3r h ILE 434 Cb 0.09 2.23 -0.06 0.00 -0.74 0.00 0.00 36.82 38.34 2w3r h ILE 434 CO -0.02 0.67 0.16 0.00 0.00 0.00 0.00 178.15 178.96 2w3r h ALA 435 N 0.47 0.61 -0.23 1.87 0.00 -0.46 0.15 119.26 121.66 2w3r h ALA 435 Ca -0.10 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2w3r h ALA 435 Cb 1.59 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 2w3r h ALA 435 CO 0.19 -0.24 0.08 0.00 0.00 0.00 0.00 179.25 179.28 2w3r h ALA 436 N 1.36 0.30 -0.91 0.00 0.00 -1.44 -2.76 119.26 115.81 2w3r h ALA 436 Ca 0.25 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2w3r h ALA 436 Cb 0.30 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2w3r h ALA 436 CO -0.28 -0.09 0.59 2.35 0.00 0.00 0.00 179.25 181.82 2w3r h TRP 437 N 0.21 1.11 -0.81 0.00 7.01 -1.02 -2.36 115.95 120.08 2w3r h TRP 437 Ca 0.07 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.07 2w3r h TRP 437 Cb 0.21 -0.37 -0.04 0.00 -2.10 0.00 0.00 29.16 26.86 2w3r h TRP 437 CO -0.00 0.65 0.40 -0.91 -2.79 0.00 0.00 178.44 175.78 2w3r h ASN 438 N 1.16 1.06 0.39 2.65 2.35 -0.92 -2.56 115.58 119.71 2w3r h ASN 438 Ca 0.36 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2w3r h ASN 438 Cb -0.02 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.07 2w3r h ASN 438 CO -0.11 0.90 0.00 -1.54 -1.65 0.00 0.00 177.43 175.03 2w3r n SER 439 N -4.34 0.00 -0.00 5.81 3.41 -0.92 -2.37 113.62 115.20 2w3r n SER 439 Ca 0.08 -0.29 0.09 0.00 -0.26 0.00 0.00 58.87 58.48 2w3r n SER 439 Cb 0.13 -0.22 -0.12 0.00 -0.26 0.00 0.00 64.21 63.75 2w3r n SER 439 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2w3r n THR 440 N -1.22 0.00 -4.20 6.66 -1.04 -1.02 -4.99 114.28 108.47 2w3r n THR 440 Ca 0.15 -0.26 -0.26 0.00 -2.04 0.00 0.00 64.05 61.64 2w3r n THR 440 Cb 0.19 0.52 -0.07 0.00 -1.82 0.00 0.00 70.33 69.14 2w3r n THR 440 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2w3r s ASN 441 N -3.40 4.84 0.00 8.00 -0.87 -0.99 -5.03 114.94 117.49 2w3r s ASN 441 Ca -0.00 -0.40 0.00 0.00 -1.57 0.00 0.00 52.86 50.89 2w3r s ASN 441 Cb 0.12 -1.05 0.00 0.00 -0.02 0.00 0.00 41.25 40.31 2w3r s ASN 441 CO 0.73 0.07 0.01 -2.11 -2.57 0.00 0.00 177.10 173.23 2w3r n ARG 442 N -0.27 0.02 -0.08 -0.60 1.85 -1.26 -4.84 116.66 111.48 2w3r n ARG 442 Ca -0.09 -0.01 -0.10 0.00 -1.00 0.00 0.00 57.85 56.65 2w3r n ARG 442 Cb 0.56 -0.39 -0.09 0.00 -1.05 0.00 0.00 32.46 31.49 2w3r n ARG 442 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2w3r n THR 443 N -0.01 0.94 -4.88 8.89 -1.04 -1.26 -4.90 114.28 112.03 2w3r n THR 443 Ca 0.00 -0.43 -0.33 0.00 -2.04 0.00 0.00 64.05 61.25 2w3r n THR 443 Cb 0.19 -0.94 -0.14 0.00 -1.82 0.00 0.00 70.33 67.62 2w3r n THR 443 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w3r s LEU 444 N -5.62 2.70 -0.04 -4.42 1.43 -1.26 -0.38 118.68 111.08 2w3r s LEU 444 Ca -0.17 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.72 2w3r s LEU 444 Cb 0.05 -1.56 -0.00 0.00 0.03 0.00 0.00 46.19 44.71 2w3r s LEU 444 CO 0.44 0.29 -0.14 0.00 0.23 0.00 0.00 176.35 177.17 2w3r s ALA 445 N -0.39 1.25 0.30 4.21 0.00 -0.81 -4.73 121.76 121.58 2w3r s ALA 445 Ca 0.04 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2w3r s ALA 445 Cb -0.12 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 2w3r s ALA 445 CO 0.02 0.22 0.53 1.03 0.00 0.00 0.00 175.76 177.56 2w3r s ARG 446 N 0.10 3.56 -0.13 0.00 0.52 -1.26 -0.53 118.95 121.21 2w3r s ARG 446 Ca -0.03 -0.16 -0.12 0.00 -0.52 0.00 0.00 55.73 54.90 2w3r s ARG 446 Cb -0.10 -2.68 0.04 0.00 0.52 0.00 0.00 34.95 32.73 2w3r s ARG 446 CO 0.01 0.21 0.35 0.20 0.02 0.00 0.00 175.30 176.09 2w3r s GLY 447 N -3.48 -0.26 0.01 -3.53 0.00 -0.69 -4.13 107.32 95.23 2w3r s GLY 447 Ca 0.42 1.02 0.02 0.00 0.00 0.00 0.00 44.72 46.18 2w3r s GLY 447 CO 0.32 0.91 -0.08 -1.50 0.00 0.00 0.00 173.10 172.76 2w3r s ILE 448 N 0.30 0.60 0.04 0.90 2.07 -1.26 -0.52 121.20 123.34 2w3r s ILE 448 Ca -0.01 -0.50 -0.19 0.00 -1.41 0.00 0.00 60.65 58.54 2w3r s ILE 448 Cb -0.03 -0.54 0.04 0.00 0.13 0.00 0.00 42.46 42.06 2w3r s ILE 448 CO -0.01 0.05 0.43 0.00 -1.91 0.00 0.00 174.94 173.50 2w3r s ALA 449 N -0.44 -1.07 -0.10 1.50 0.00 -0.78 -4.70 121.76 116.17 2w3r s ALA 449 Ca 0.00 0.37 0.04 0.00 0.00 0.00 0.00 51.96 52.36 2w3r s ALA 449 Cb -0.04 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.43 2w3r s ALA 449 CO 0.00 -0.46 -0.23 -1.17 0.00 0.00 0.00 175.76 173.90 2w3r s LEU 450 N -1.98 2.07 -0.02 0.00 0.20 -1.26 -1.35 118.68 116.33 2w3r s LEU 450 Ca -0.05 -0.55 0.03 0.00 0.69 0.00 0.00 54.13 54.25 2w3r s LEU 450 Cb -0.01 -1.38 -0.00 0.00 -0.43 0.00 0.00 46.19 44.37 2w3r s LEU 450 CO -0.02 0.14 -0.12 -0.94 -0.29 0.00 0.00 176.35 175.12 2w3r s SER 451 N 0.44 1.47 0.55 3.68 1.04 -0.70 -4.87 113.70 115.30 2w3r s SER 451 Ca -0.17 -0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.04 2w3r s SER 451 Cb -0.17 -0.32 0.03 0.00 0.10 0.00 0.00 66.02 65.66 2w3r s SER 451 CO 0.07 0.11 0.77 -2.16 0.98 0.00 0.00 173.24 173.01 2w3r s PRO 452 N 0.00 2.59 -0.04 4.02 0.04 -1.26 -2.09 135.00 138.25 2w3r s PRO 452 Ca -0.01 -0.73 0.02 0.00 0.04 0.00 0.00 61.00 60.32 2w3r s PRO 452 Cb -0.08 -2.48 0.02 0.00 0.04 0.00 0.00 34.50 32.00 2w3r s PRO 452 CO 0.00 -0.69 -0.07 0.08 0.04 0.00 0.00 177.00 176.37 2w3r s VAL 453 N -2.76 0.69 -0.28 -0.36 1.01 0.12 -4.90 120.40 113.91 2w3r s VAL 453 Ca 0.56 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 2w3r s VAL 453 Cb -0.10 -0.67 0.09 0.00 0.00 0.00 0.00 36.38 35.70 2w3r s VAL 453 CO 0.39 0.25 0.09 -0.75 0.00 0.00 0.00 175.10 175.08 2w3r s LYS 454 N 0.74 0.58 -0.18 2.72 2.20 -1.26 -2.93 119.74 121.63 2w3r s LYS 454 Ca -0.11 -0.83 -0.01 0.00 -0.36 0.00 0.00 55.97 54.66 2w3r s LYS 454 Cb -0.14 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.36 2w3r s LYS 454 CO 0.01 -0.93 -0.13 0.12 -0.36 0.00 0.00 175.35 174.06 2w3r s PHE 455 N 1.77 2.83 0.39 4.03 5.36 -0.75 -4.87 117.98 126.74 2w3r s PHE 455 Ca 0.08 -1.12 -0.24 0.00 -0.96 0.00 0.00 56.93 54.68 2w3r s PHE 455 Cb -0.17 -1.95 -0.09 0.00 -0.34 0.00 0.00 43.02 40.47 2w3r s PHE 455 CO -0.25 -0.55 1.07 0.20 -1.46 0.00 0.00 175.22 174.24 2w3r s GLY 456 N 1.07 2.78 -0.19 13.12 0.00 -1.26 -0.08 107.32 122.76 2w3r s GLY 456 Ca -0.00 0.76 -0.01 0.00 0.00 0.00 0.00 44.72 45.47 2w3r s GLY 456 CO -0.03 1.22 -0.13 -0.42 0.00 0.00 0.00 173.10 173.74 2w3r s ILE 457 N -1.58 2.73 0.00 0.90 -1.09 0.25 -4.90 121.20 117.50 2w3r s ILE 457 Ca 0.57 -0.72 0.00 0.00 -2.23 0.00 0.00 60.65 58.27 2w3r s ILE 457 Cb -0.24 -2.19 0.00 0.00 -1.58 0.00 0.00 42.46 38.45 2w3r s ILE 457 CO 0.30 0.49 0.00 -1.20 -1.23 0.00 0.00 174.94 173.30 2w3r n SER 458 N 4.55 0.00 -4.72 3.58 7.64 -1.26 -1.53 113.62 121.88 2w3r n SER 458 Ca -0.19 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 2w3r n SER 458 Cb 0.51 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 2w3r n SER 458 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2w3r s PHE 459 N -2.00 3.23 0.14 1.43 0.40 -1.26 -4.91 117.98 115.01 2w3r s PHE 459 Ca 0.00 0.94 0.26 0.00 -0.60 0.00 0.00 56.93 57.53 2w3r s PHE 459 Cb 0.00 -3.69 1.03 0.00 0.51 0.00 0.00 43.02 40.87 2w3r s PHE 459 CO 0.00 -2.42 1.87 1.79 0.70 0.00 0.00 175.22 177.16 2w3r h THR 460 N 4.26 0.45 -1.50 0.64 1.35 -1.96 -3.30 112.91 112.84 2w3r h THR 460 Ca -0.42 -0.97 -0.61 0.00 -0.55 0.00 0.00 66.41 63.86 2w3r h THR 460 Cb 1.21 1.70 -0.11 0.00 -1.73 0.00 0.00 68.15 69.21 2w3r h THR 460 CO 0.87 0.17 1.32 -0.22 -0.25 0.00 0.00 175.52 177.41 2w3r s LEU 461 N -6.70 3.72 0.24 3.87 1.98 -1.26 -4.93 118.68 115.60 2w3r s LEU 461 Ca 0.00 -1.41 -0.05 0.00 -2.89 0.00 0.00 54.13 49.79 2w3r s LEU 461 Cb 0.10 -2.54 0.37 0.00 0.66 0.00 0.00 46.19 44.79 2w3r s LEU 461 CO 0.62 -1.48 1.82 0.74 -1.89 0.00 0.00 176.35 176.16 2w3r h THR 462 N 6.54 0.95 0.00 3.68 2.02 -1.96 -2.27 112.91 121.87 2w3r h THR 462 Ca 0.12 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2w3r h THR 462 Cb 1.02 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2w3r h THR 462 CO 1.36 0.15 0.00 0.00 0.37 0.00 0.00 175.52 177.40 2w3r n HIS 463 N -4.71 0.71 0.70 3.16 1.44 -1.26 -0.72 115.22 114.53 2w3r n HIS 463 Ca 0.13 0.32 0.11 0.00 -2.01 0.00 0.00 57.72 56.27 2w3r n HIS 463 Cb 0.25 -1.02 0.46 0.00 0.12 0.00 0.00 29.99 29.80 2w3r n HIS 463 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2w3r n LEU 464 N -2.18 0.18 -3.34 2.39 4.77 -0.85 -4.24 117.00 113.73 2w3r n LEU 464 Ca 0.00 0.53 -0.37 0.00 -0.03 0.00 0.00 56.01 56.14 2w3r n LEU 464 Cb 0.13 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.71 2w3r n LEU 464 CO 0.14 -0.18 3.17 0.59 -1.33 0.00 0.00 177.39 179.78 2w3r n ASN 465 N -1.69 7.63 -3.97 -1.43 3.02 0.10 -4.72 115.26 114.20 2w3r n ASN 465 Ca 0.05 -2.56 -0.09 0.00 -0.03 0.00 0.00 54.58 51.95 2w3r n ASN 465 Cb 0.28 -1.50 -0.11 0.00 -0.61 0.00 0.00 39.78 37.84 2w3r n ASN 465 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w3r s GLN 466 N 2.50 0.41 0.05 3.52 -2.07 -1.26 -1.39 119.66 121.42 2w3r s GLN 466 Ca 0.63 -0.68 -0.10 0.00 -1.82 0.00 0.00 55.36 53.39 2w3r s GLN 466 Cb 0.16 0.15 0.00 0.00 -1.09 0.00 0.00 33.01 32.24 2w3r s GLN 466 CO -0.06 -0.08 0.20 0.00 -1.32 0.00 0.00 175.29 174.04 2w3r s ALA 467 N -1.92 -0.36 0.13 2.60 0.00 0.27 -4.48 121.76 117.99 2w3r s ALA 467 Ca -0.11 -0.31 0.05 0.00 0.00 0.00 0.00 51.96 51.59 2w3r s ALA 467 Cb -0.06 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2w3r s ALA 467 CO -0.02 -0.38 -0.12 0.20 0.00 0.00 0.00 175.76 175.43 2w3r s GLY 468 N -2.19 1.06 0.09 0.00 0.00 -1.26 -0.66 107.32 104.35 2w3r s GLY 468 Ca -0.04 -1.34 -0.00 0.00 0.00 0.00 0.00 44.72 43.34 2w3r s GLY 468 CO -0.05 -1.42 -0.01 0.00 0.00 0.00 0.00 173.10 171.62 2w3r s ALA 469 N -2.53 0.76 -0.04 3.20 0.00 0.10 -2.48 121.76 120.77 2w3r s ALA 469 Ca 0.11 -1.33 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 2w3r s ALA 469 Cb -0.02 0.41 0.03 0.00 0.00 0.00 0.00 23.12 23.54 2w3r s ALA 469 CO 0.02 -0.36 0.06 -1.17 0.00 0.00 0.00 175.76 174.30 2w3r s LEU 470 N -3.00 0.54 -0.06 0.00 2.96 0.88 -1.51 118.68 118.49 2w3r s LEU 470 Ca 0.13 0.09 0.05 0.00 -0.22 0.00 0.00 54.13 54.18 2w3r s LEU 470 Cb 0.07 -0.07 -0.01 0.00 0.50 0.00 0.00 46.19 46.69 2w3r s LEU 470 CO -0.05 -0.19 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.88 2w3r s VAL 471 N 1.68 1.82 -0.11 1.68 1.01 -0.44 -1.04 120.40 125.00 2w3r s VAL 471 Ca -0.02 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2w3r s VAL 471 Cb -0.12 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 2w3r s VAL 471 CO -0.03 0.51 -0.19 -1.10 0.00 0.00 0.00 175.10 174.29 2w3r s GLN 472 N 0.01 3.19 -0.26 2.72 -1.52 0.05 -1.94 119.66 121.90 2w3r s GLN 472 Ca -0.06 -0.79 -0.04 0.00 -1.95 0.00 0.00 55.36 52.52 2w3r s GLN 472 Cb -0.14 -2.45 0.01 0.00 -0.22 0.00 0.00 33.01 30.21 2w3r s GLN 472 CO 0.04 0.21 -0.01 0.42 -0.25 0.00 0.00 175.29 175.70 2w3r s ILE 473 N 0.32 3.37 0.48 1.08 1.01 -0.09 -0.83 121.20 126.54 2w3r s ILE 473 Ca -0.15 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.65 2w3r s ILE 473 Cb -0.17 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 2w3r s ILE 473 CO 0.07 0.20 0.79 -0.31 0.00 0.00 0.00 174.94 175.69 2w3r s TYR 474 N 1.42 3.56 0.50 3.97 1.51 -0.41 -4.79 117.35 123.12 2w3r s TYR 474 Ca 0.02 0.82 0.41 0.00 -1.01 0.00 0.00 57.07 57.31 2w3r s TYR 474 Cb -0.16 -2.30 2.18 0.00 -0.11 0.00 0.00 41.96 41.56 2w3r s TYR 474 CO -0.02 -0.28 2.26 1.79 -1.11 0.00 0.00 175.55 178.19 2w3r h THR 475 N 0.23 0.00 -0.09 -0.71 1.35 -1.92 0.10 112.91 111.86 2w3r h THR 475 Ca -0.47 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2w3r h THR 475 Cb 1.20 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 2w3r h THR 475 CO 0.62 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.99 2w3r n ASP 476 N -2.99 1.01 0.00 5.36 3.85 -1.26 -4.23 116.55 118.29 2w3r n ASP 476 Ca -0.02 -1.58 0.00 0.00 -0.71 0.00 0.00 54.79 52.48 2w3r n ASP 476 Cb 0.10 -0.06 0.00 0.00 -1.35 0.00 0.00 41.12 39.81 2w3r n ASP 476 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2w3r n GLY 477 N 1.00 1.67 3.81 6.12 0.00 0.35 -4.85 105.19 113.29 2w3r n GLY 477 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2w3r n GLY 477 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w3r s SER 478 N -2.71 5.65 -0.08 1.61 1.04 -1.25 -4.79 113.70 113.16 2w3r s SER 478 Ca 0.00 1.74 0.03 0.00 0.48 0.00 0.00 55.95 58.20 2w3r s SER 478 Cb 0.00 -2.52 0.01 0.00 0.10 0.00 0.00 66.02 63.61 2w3r s SER 478 CO 0.00 -1.26 -0.17 -0.69 0.98 0.00 0.00 173.24 172.10 2w3r s VAL 479 N -2.67 1.53 -0.32 5.02 1.01 0.88 -1.29 120.40 124.57 2w3r s VAL 479 Ca 0.61 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.77 2w3r s VAL 479 Cb -0.15 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 2w3r s VAL 479 CO 0.43 0.44 0.21 0.00 0.00 0.00 0.00 175.10 176.18 2w3r s ALA 480 N 0.59 3.47 -0.19 5.51 0.00 -0.01 -0.15 121.76 130.98 2w3r s ALA 480 Ca -0.15 -1.29 -0.04 0.00 0.00 0.00 0.00 51.96 50.48 2w3r s ALA 480 Cb -0.16 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.38 2w3r s ALA 480 CO 0.05 -0.82 -0.04 -1.17 0.00 0.00 0.00 175.76 173.78 2w3r s LEU 481 N 1.72 3.07 -0.02 0.00 2.96 0.34 -0.77 118.68 125.98 2w3r s LEU 481 Ca 0.06 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 2w3r s LEU 481 Cb -0.17 -1.76 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 2w3r s LEU 481 CO 0.10 0.07 -0.10 0.21 -1.32 0.00 0.00 176.35 175.31 2w3r s ASN 482 N 0.95 1.25 0.31 3.68 3.84 -0.20 -1.73 114.94 123.04 2w3r s ASN 482 Ca 0.00 -0.19 -0.01 0.00 0.21 0.00 0.00 52.86 52.87 2w3r s ASN 482 Cb -0.15 -0.24 -0.01 0.00 -0.55 0.00 0.00 41.25 40.30 2w3r s ASN 482 CO 0.01 0.10 0.38 -1.38 -2.79 0.00 0.00 177.10 173.42 2w3r s HIS 483 N -0.03 1.17 -0.21 0.43 -3.43 -1.26 -0.08 115.29 111.87 2w3r s HIS 483 Ca 0.00 -1.33 0.19 0.00 -0.80 0.00 0.00 55.06 53.12 2w3r s HIS 483 Cb -0.06 -0.27 0.29 0.00 -1.43 0.00 0.00 32.58 31.11 2w3r s HIS 483 CO 0.00 -0.99 1.56 0.78 -2.00 0.00 0.00 174.74 174.09 2w3r h GLY 484 N 2.20 0.00 -2.03 -1.38 0.00 -1.82 -3.43 103.07 96.62 2w3r h GLY 484 Ca -0.28 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.55 2w3r h GLY 484 CO 0.40 0.00 0.41 -0.32 0.00 0.00 0.00 176.54 177.03 2w3r s GLY 485 N -4.35 2.53 -0.07 4.60 0.00 -1.26 -4.91 107.32 103.87 2w3r s GLY 485 Ca 0.05 0.73 0.04 0.00 0.00 0.00 0.00 44.72 45.54 2w3r s GLY 485 CO 0.70 1.08 -0.19 -0.51 0.00 0.00 0.00 173.10 174.18 2w3r s THR 486 N -1.91 2.58 -0.57 0.90 -4.23 -1.26 -4.83 115.64 106.33 2w3r s THR 486 Ca 0.71 -0.88 -0.28 0.00 -1.18 0.00 0.00 61.69 60.06 2w3r s THR 486 Cb -0.22 -1.99 0.03 0.00 1.34 0.00 0.00 72.50 71.66 2w3r s THR 486 CO 0.27 0.57 1.22 -0.70 -0.54 0.00 0.00 174.62 175.44 2w3r s GLU 487 N -0.26 3.51 -0.07 3.99 2.56 -1.26 -4.82 118.70 122.34 2w3r s GLU 487 Ca 0.00 0.31 0.13 0.00 0.00 0.00 0.00 54.97 55.41 2w3r s GLU 487 Cb -0.13 -4.02 0.39 0.00 2.00 0.00 0.00 34.13 32.37 2w3r s GLU 487 CO 0.03 -1.69 1.31 0.00 -0.56 0.00 0.00 175.26 174.35 2w3r n MET 488 N 8.42 2.90 0.00 4.30 0.00 -1.26 -1.12 117.12 130.36 2w3r n MET 488 Ca 0.09 -2.35 0.00 0.00 0.00 0.00 0.00 57.70 55.44 2w3r n MET 488 Cb 0.49 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 32.22 2w3r n MET 488 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w3r n GLY 489 N 0.10 0.82 0.19 3.17 0.00 -1.26 -3.60 105.19 104.60 2w3r n GLY 489 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 2w3r n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLN 490 N -0.73 1.25 -1.61 1.61 0.00 -1.26 -4.89 117.38 111.75 2w3r n GLN 490 Ca 0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 57.00 56.56 2w3r n GLN 490 Cb 0.00 -1.35 -0.02 0.00 0.00 0.00 0.00 30.24 28.88 2w3r n GLN 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2w3r n GLY 491 N 0.93 0.53 0.23 2.61 0.00 -1.26 -4.95 105.19 103.28 2w3r n GLY 491 Ca 0.16 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 2w3r n GLY 491 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2w3r h LEU 492 N 0.00 0.68 -0.37 0.99 5.85 -1.92 -2.71 115.31 117.83 2w3r h LEU 492 Ca -0.14 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 2w3r h LEU 492 Cb 0.73 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2w3r h LEU 492 CO 0.19 0.56 0.19 0.45 -0.34 0.00 0.00 178.44 179.49 2w3r h HIS 493 N 0.74 0.52 -0.49 1.25 3.86 -1.94 -1.06 115.15 118.03 2w3r h HIS 493 Ca 0.20 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 2w3r h HIS 493 Cb 0.02 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.31 2w3r h HIS 493 CO -0.02 0.42 0.25 0.00 0.86 0.00 0.00 177.93 179.44 2w3r h ALA 494 N 1.05 0.62 -0.45 2.45 0.00 -1.90 -0.76 119.26 120.27 2w3r h ALA 494 Ca 0.13 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 494 Cb 0.08 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2w3r h ALA 494 CO -0.02 0.17 0.13 0.87 0.00 0.00 0.00 179.25 180.40 2w3r h LYS 495 N 0.64 0.27 -0.56 0.00 1.57 -1.17 0.21 116.57 117.53 2w3r h LYS 495 Ca 0.17 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2w3r h LYS 495 Cb 0.09 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2w3r h LYS 495 CO -0.02 0.18 0.29 0.52 -0.57 0.00 0.00 179.45 179.85 2w3r h MET 496 N 0.28 0.79 -0.72 3.15 2.86 -0.99 -1.30 114.93 119.00 2w3r h MET 496 Ca 0.22 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 2w3r h MET 496 Cb 0.25 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 2w3r h MET 496 CO -0.26 0.62 0.44 0.28 1.06 0.00 0.00 176.91 179.05 2w3r h VAL 497 N 0.75 1.06 -0.44 -2.22 2.07 -0.27 0.37 116.25 117.57 2w3r h VAL 497 Ca 0.19 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 2w3r h VAL 497 Cb 0.07 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 2w3r h VAL 497 CO -0.03 0.15 0.21 1.56 0.02 0.00 0.00 177.57 179.48 2w3r h GLN 498 N 0.84 0.63 0.06 1.57 4.20 -0.28 0.90 115.11 123.04 2w3r h GLN 498 Ca 0.30 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.92 2w3r h GLN 498 Cb 0.08 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 2w3r h GLN 498 CO -0.13 0.54 -0.09 0.28 -0.67 0.00 0.00 178.83 178.75 2w3r h VAL 499 N 0.56 0.78 -0.80 -0.54 2.07 -0.87 0.86 116.25 118.32 2w3r h VAL 499 Ca 0.15 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.70 2w3r h VAL 499 Cb 0.12 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 2w3r h VAL 499 CO -0.02 0.00 0.51 0.00 0.02 0.00 0.00 177.57 178.08 2w3r h ALA 500 N 0.73 1.05 -0.03 1.67 0.00 -0.70 -0.48 119.26 121.50 2w3r h ALA 500 Ca 0.01 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2w3r h ALA 500 Cb 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2w3r h ALA 500 CO -0.05 0.34 -0.59 0.00 0.00 0.00 0.00 179.25 178.95 2w3r h ALA 501 N 1.33 0.95 -0.04 0.00 0.00 -0.69 -2.46 119.26 118.35 2w3r h ALA 501 Ca 0.32 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2w3r h ALA 501 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2w3r h ALA 501 CO -0.11 0.73 -0.06 0.00 0.00 0.00 0.00 179.25 179.81 2w3r h ALA 502 N 1.32 0.07 -0.71 0.00 0.00 -0.08 -1.24 119.26 118.62 2w3r h ALA 502 Ca -0.01 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 2w3r h ALA 502 Cb 1.06 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2w3r h ALA 502 CO 0.08 -0.13 0.18 0.28 0.00 0.00 0.00 179.25 179.67 2w3r h VAL 503 N -0.36 1.26 0.00 0.00 2.07 -1.14 -3.00 116.25 115.08 2w3r h VAL 503 Ca 0.01 -0.96 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 2w3r h VAL 503 Cb 0.58 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2w3r h VAL 503 CO 0.01 0.37 -0.35 -0.07 0.02 0.00 0.00 177.57 177.56 2w3r h LEU 504 N 1.07 0.00 -0.30 2.57 3.38 -1.52 -3.48 115.31 117.03 2w3r h LEU 504 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2w3r h LEU 504 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2w3r h LEU 504 CO 0.00 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.49 2w3r n GLY 505 N 1.03 0.74 3.43 0.83 0.00 -0.85 -4.66 105.19 105.72 2w3r n GLY 505 Ca 0.02 -0.69 -0.21 0.00 0.00 0.00 0.00 46.02 45.14 2w3r n GLY 505 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w3r s ILE 506 N -2.30 1.69 0.09 -0.61 -4.36 -0.53 -0.52 121.20 114.67 2w3r s ILE 506 Ca 0.00 -2.13 -0.31 0.00 -0.26 0.00 0.00 60.65 57.95 2w3r s ILE 506 Cb 0.00 -2.46 -0.07 0.00 1.25 0.00 0.00 42.46 41.19 2w3r s ILE 506 CO 0.00 -0.30 1.30 -0.62 0.24 0.00 0.00 174.94 175.56 2w3r s ASP 507 N -3.45 6.95 0.54 4.36 -1.08 -1.26 -4.50 116.67 118.22 2w3r s ASP 507 Ca 0.30 2.19 0.48 0.00 -0.52 0.00 0.00 52.55 54.99 2w3r s ASP 507 Cb 0.03 -2.58 1.71 0.00 -1.46 0.00 0.00 42.92 40.62 2w3r s ASP 507 CO 0.12 -0.56 1.57 -0.65 0.52 0.00 0.00 175.17 176.17 2w3r h PRO 508 N 6.73 0.00 0.00 4.34 0.11 -1.89 0.94 132.00 142.22 2w3r h PRO 508 Ca -0.42 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 2w3r h PRO 508 Cb 1.21 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2w3r h PRO 508 CO 0.84 0.00 -0.01 0.28 -0.21 0.00 0.00 178.00 178.90 2w3r h VAL 509 N 0.00 0.65 0.00 3.15 2.07 -1.97 -0.24 116.25 119.91 2w3r h VAL 509 Ca 0.94 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 68.43 2w3r h VAL 509 Cb 3.64 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 34.43 2w3r h VAL 509 CO -0.09 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.50 2w3r n GLN 510 N -4.01 0.16 -3.75 1.57 1.13 0.32 -4.71 117.38 108.10 2w3r n GLN 510 Ca -0.03 0.25 -0.37 0.00 -1.94 0.00 0.00 57.00 54.91 2w3r n GLN 510 Cb 0.09 -1.74 -0.12 0.00 0.11 0.00 0.00 30.24 28.58 2w3r n GLN 510 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2w3r s VAL 511 N -3.14 4.33 -0.17 5.09 1.01 -0.10 -0.09 120.40 127.34 2w3r s VAL 511 Ca 0.09 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 2w3r s VAL 511 Cb 0.12 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2w3r s VAL 511 CO 0.48 0.33 -0.03 -0.60 0.00 0.00 0.00 175.10 175.27 2w3r s ARG 512 N 1.62 3.63 -0.10 2.72 6.06 0.79 -4.99 118.95 128.68 2w3r s ARG 512 Ca 0.06 -0.53 -0.24 0.00 -2.50 0.00 0.00 55.73 52.52 2w3r s ARG 512 Cb -0.15 -2.94 -0.03 0.00 0.06 0.00 0.00 34.95 31.89 2w3r s ARG 512 CO 0.04 0.17 0.73 -1.50 -2.50 0.00 0.00 175.30 172.24 2w3r s ILE 513 N 0.55 5.00 0.32 4.11 1.10 -1.26 -0.50 121.20 130.51 2w3r s ILE 513 Ca -0.03 1.49 0.02 0.00 -0.51 0.00 0.00 60.65 61.62 2w3r s ILE 513 Cb -0.14 -4.06 -0.03 0.00 0.15 0.00 0.00 42.46 38.37 2w3r s ILE 513 CO 0.03 0.18 0.49 0.42 -2.11 0.00 0.00 174.94 173.95 2w3r s THR 514 N 1.23 5.14 0.65 4.00 -4.23 -0.70 -4.94 115.64 116.79 2w3r s THR 514 Ca 0.37 -0.62 -0.17 0.00 -1.18 0.00 0.00 61.69 60.10 2w3r s THR 514 Cb -0.17 -3.86 -0.01 0.00 1.34 0.00 0.00 72.50 69.80 2w3r s THR 514 CO 0.16 -0.49 1.16 0.00 -0.54 0.00 0.00 174.62 174.91 2w3r s ALA 515 N -2.22 2.42 0.10 3.99 0.00 -1.26 -4.78 121.76 120.01 2w3r s ALA 515 Ca 0.38 0.79 -0.31 0.00 0.00 0.00 0.00 51.96 52.82 2w3r s ALA 515 Cb -0.09 -3.40 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 2w3r s ALA 515 CO 0.34 -1.34 1.42 0.99 0.00 0.00 0.00 175.76 177.17 2w3r s THR 516 N -1.98 3.29 -0.11 0.00 2.01 0.05 -4.84 115.64 114.05 2w3r s THR 516 Ca 0.72 0.89 -0.04 0.00 0.31 0.00 0.00 61.69 63.57 2w3r s THR 516 Cb -0.26 -3.57 0.06 0.00 0.01 0.00 0.00 72.50 68.74 2w3r s THR 516 CO 0.38 0.05 0.22 -0.62 -0.69 0.00 0.00 174.62 173.97 2w3r s ASP 517 N 1.31 0.51 0.61 3.53 3.68 -1.26 -0.52 116.67 124.52 2w3r s ASP 517 Ca 0.66 0.49 0.38 0.00 2.13 0.00 0.00 52.55 56.22 2w3r s ASP 517 Cb -0.37 0.54 1.90 0.00 -1.45 0.00 0.00 42.92 43.55 2w3r s ASP 517 CO 0.30 -0.24 2.19 0.71 0.13 0.00 0.00 175.17 178.25 2w3r h THR 518 N 6.32 0.06 -0.00 1.71 1.35 -1.60 0.39 112.91 121.13 2w3r h THR 518 Ca -0.14 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 2w3r h THR 518 Cb 1.11 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2w3r h THR 518 CO 0.14 0.01 -0.29 -1.54 -0.25 0.00 0.00 175.52 173.59 2w3r n SER 519 N -3.15 0.63 -0.11 5.36 3.41 -1.26 -3.70 113.62 114.79 2w3r n SER 519 Ca -0.01 -0.46 -0.22 0.00 -0.26 0.00 0.00 58.87 57.91 2w3r n SER 519 Cb 0.18 0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.13 2w3r n SER 519 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2w3r n LYS 520 N -1.10 0.51 -4.03 4.33 5.02 -0.26 -4.92 118.16 117.71 2w3r n LYS 520 Ca 0.10 0.22 -0.31 0.00 -2.02 0.00 0.00 58.31 56.29 2w3r n LYS 520 Cb 0.33 -1.36 -0.15 0.00 -0.02 0.00 0.00 35.03 33.82 2w3r n LYS 520 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2w3r s VAL 521 N -2.54 1.88 0.63 -0.18 1.01 -0.03 -4.87 120.40 116.29 2w3r s VAL 521 Ca -0.32 -1.29 -0.02 0.00 0.00 0.00 0.00 61.98 60.34 2w3r s VAL 521 Cb 0.11 -1.97 0.05 0.00 0.00 0.00 0.00 36.38 34.57 2w3r s VAL 521 CO 0.42 0.08 0.89 -2.16 0.00 0.00 0.00 175.10 174.33 2w3r s PRO 522 N 1.27 2.33 -1.44 2.72 0.04 -1.24 -4.20 135.00 134.47 2w3r s PRO 522 Ca -0.04 -0.58 -0.12 0.00 0.04 0.00 0.00 61.00 60.30 2w3r s PRO 522 Cb -0.18 -2.34 0.08 0.00 0.04 0.00 0.00 34.50 32.10 2w3r s PRO 522 CO -0.07 -0.99 0.69 0.09 0.04 0.00 0.00 177.00 176.76 2w3r n ASN 523 N -2.62 -4.25 -4.83 6.66 3.02 -1.26 -4.89 115.26 107.08 2w3r n ASN 523 Ca 0.08 -0.58 -0.33 0.00 -0.03 0.00 0.00 54.58 53.73 2w3r n ASN 523 Cb 0.60 -3.46 -0.04 0.00 -0.61 0.00 0.00 39.78 36.27 2w3r n ASN 523 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2w3r s THR 524 N -3.11 4.40 0.97 3.41 -4.23 -1.26 -5.01 115.64 110.81 2w3r s THR 524 Ca 0.52 1.28 -0.17 0.00 -1.18 0.00 0.00 61.69 62.14 2w3r s THR 524 Cb -0.27 -3.65 0.22 0.00 1.34 0.00 0.00 72.50 70.15 2w3r s THR 524 CO 0.64 -0.54 1.31 -1.20 -0.54 0.00 0.00 174.62 174.29 2w3r n SER 525 N -1.28 0.03 -4.78 3.99 7.64 -1.26 -4.64 113.62 113.31 2w3r n SER 525 Ca 0.07 -1.46 -0.31 0.00 1.01 0.00 0.00 58.87 58.18 2w3r n SER 525 Cb 0.54 -1.00 0.08 0.00 -1.01 0.00 0.00 64.21 62.82 2w3r n SER 525 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w3r s ALA 526 N -3.94 2.30 -1.07 -0.43 0.00 -1.26 -4.83 121.76 112.52 2w3r s ALA 526 Ca 0.74 0.13 -0.16 0.00 0.00 0.00 0.00 51.96 52.67 2w3r s ALA 526 Cb -0.02 -3.22 0.15 0.00 0.00 0.00 0.00 23.12 20.03 2w3r s ALA 526 CO 0.52 -1.67 1.28 0.99 0.00 0.00 0.00 175.76 176.89 2w3r s THR 527 N -2.97 4.88 0.36 0.00 2.01 -0.67 -4.92 115.64 114.33 2w3r s THR 527 Ca 0.60 -2.12 -0.06 0.00 0.31 0.00 0.00 61.69 60.43 2w3r s THR 527 Cb -0.16 -4.85 0.02 0.00 0.01 0.00 0.00 72.50 67.53 2w3r s THR 527 CO 0.56 -1.57 0.58 0.00 -0.69 0.00 0.00 174.62 173.50 2w3r n ALA 528 N 6.09 -0.80 -1.77 7.40 0.00 -1.26 -4.92 120.51 125.25 2w3r n ALA 528 Ca 0.30 -1.48 -0.18 0.00 0.00 0.00 0.00 53.44 52.08 2w3r n ALA 528 Cb 0.46 1.19 -0.06 0.00 0.00 0.00 0.00 19.45 21.04 2w3r n ALA 528 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n ALA 529 N -0.69 -0.39 -1.26 0.00 0.00 -1.26 -2.30 120.51 114.62 2w3r n ALA 529 Ca -0.14 0.25 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 2w3r n ALA 529 Cb 0.58 -1.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 2w3r n ALA 529 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2w3r n SER 530 N -1.29 -5.21 -0.31 0.00 7.64 -1.26 -4.12 113.62 109.06 2w3r n SER 530 Ca -0.19 0.25 0.14 0.00 1.01 0.00 0.00 58.87 60.08 2w3r n SER 530 Cb 0.61 -3.90 0.51 0.00 -1.01 0.00 0.00 64.21 60.42 2w3r n SER 530 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2w3r n SER 531 N -0.92 1.09 0.16 6.43 3.41 -0.97 -4.40 113.62 118.42 2w3r n SER 531 Ca -0.10 -1.12 -0.16 0.00 -0.26 0.00 0.00 58.87 57.23 2w3r n SER 531 Cb 0.55 0.04 -0.09 0.00 -0.26 0.00 0.00 64.21 64.44 2w3r n SER 531 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2w3r h GLY 532 N 4.90 -1.19 1.00 5.00 0.00 -1.89 0.95 103.07 111.84 2w3r h GLY 532 Ca 0.00 0.62 -0.04 0.00 0.00 0.00 0.00 47.33 47.91 2w3r h GLY 532 CO 0.00 -0.31 0.21 0.00 0.00 0.00 0.00 176.54 176.45 2w3r h ALA 533 N -0.72 0.77 0.31 3.60 0.00 -1.94 -2.82 119.26 118.46 2w3r h ALA 533 Ca -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2w3r h ALA 533 Cb 0.75 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2w3r h ALA 533 CO -0.20 0.41 -0.45 -0.44 0.00 0.00 0.00 179.25 178.56 2w3r h ASP 534 N 0.82 -1.29 0.00 0.00 5.19 -1.70 -1.62 116.42 117.83 2w3r h ASP 534 Ca 0.19 0.12 -0.10 0.00 -0.62 0.00 0.00 57.03 56.62 2w3r h ASP 534 Cb 0.24 0.45 -0.02 0.00 0.18 0.00 0.00 39.33 40.18 2w3r h ASP 534 CO -0.01 -0.57 -0.56 0.24 -3.12 0.00 0.00 179.24 175.22 2w3r h MET 535 N -0.82 0.00 -0.76 3.56 2.86 -0.92 -3.24 114.93 115.61 2w3r h MET 535 Ca -0.02 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2w3r h MET 535 Cb 0.76 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.38 2w3r h MET 535 CO -0.15 0.98 0.50 -0.91 1.06 0.00 0.00 176.91 178.40 2w3r h ASN 536 N -1.00 0.83 -0.52 1.22 2.35 -1.64 -1.30 115.58 115.51 2w3r h ASN 536 Ca -0.15 -0.01 0.10 0.00 -0.55 0.00 0.00 56.30 55.68 2w3r h ASN 536 Cb 1.12 -0.20 -0.08 0.00 0.05 0.00 0.00 38.32 39.21 2w3r h ASN 536 CO -0.09 0.58 0.04 1.23 -1.65 0.00 0.00 177.43 177.53 2w3r h GLY 537 N 0.96 0.57 1.02 2.83 0.00 -1.41 0.21 103.07 107.27 2w3r h GLY 537 Ca 0.29 0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.59 2w3r h GLY 537 CO -0.08 -0.13 0.09 -0.33 0.00 0.00 0.00 176.54 176.09 2w3r h MET 538 N 0.16 0.95 -0.81 4.80 2.86 -1.38 -1.34 114.93 120.17 2w3r h MET 538 Ca 0.26 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2w3r h MET 538 Cb 0.39 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 2w3r h MET 538 CO -0.40 0.91 0.52 0.00 1.06 0.00 0.00 176.91 179.00 2w3r h ALA 539 N 1.00 1.03 -0.00 6.32 0.00 -0.41 0.12 119.26 127.32 2w3r h ALA 539 Ca 0.17 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2w3r h ALA 539 Cb 0.43 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2w3r h ALA 539 CO 0.01 0.46 0.00 0.28 0.00 0.00 0.00 179.25 180.00 2w3r h VAL 540 N 1.10 1.07 -0.46 0.00 2.07 -0.49 -2.40 116.25 117.14 2w3r h VAL 540 Ca 0.30 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.70 2w3r h VAL 540 Cb -0.10 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 2w3r h VAL 540 CO -0.06 0.05 0.05 0.50 0.02 0.00 0.00 177.57 178.13 2w3r h LYS 541 N -0.08 0.16 -0.41 1.57 3.64 -0.73 -0.65 116.57 120.08 2w3r h LYS 541 Ca 0.00 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2w3r h LYS 541 Cb 0.08 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 2w3r h LYS 541 CO -0.00 0.11 0.18 0.22 -2.27 0.00 0.00 179.45 177.69 2w3r h ASP 542 N 0.17 0.25 -0.59 4.20 3.58 -0.69 0.06 116.42 123.40 2w3r h ASP 542 Ca 0.23 0.03 -0.09 0.00 0.42 0.00 0.00 57.03 57.62 2w3r h ASP 542 Cb 0.32 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 2w3r h ASP 542 CO -0.34 0.18 0.03 0.00 -2.88 0.00 0.00 179.24 176.24 2w3r h ALA 543 N 1.23 0.79 -0.40 -0.78 0.00 -0.97 -2.44 119.26 116.70 2w3r h ALA 543 Ca 0.18 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2w3r h ALA 543 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2w3r h ALA 543 CO -0.15 0.60 -0.33 0.00 0.00 0.00 0.00 179.25 179.38 2w3r h GLU 545 N 0.77 0.00 -0.17 0.00 5.08 -0.90 0.88 114.58 120.24 2w3r h GLU 545 Ca 0.08 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 2w3r h GLU 545 Cb 0.91 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2w3r h GLU 545 CO 0.08 0.32 -0.54 1.15 -1.00 0.00 0.00 179.01 179.02 2w3r h THR 546 N 0.00 1.33 0.02 1.13 2.02 -1.36 -0.23 112.91 115.83 2w3r h THR 546 Ca -0.00 -1.79 -0.00 0.00 0.77 0.00 0.00 66.41 65.38 2w3r h THR 546 Cb 0.67 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.86 2w3r h THR 546 CO 0.04 0.55 -0.01 -0.07 0.37 0.00 0.00 175.52 176.40 2w3r h LEU 547 N 0.39 -0.03 -1.48 2.58 3.38 -0.77 -2.69 115.31 116.70 2w3r h LEU 547 Ca 0.01 -0.64 0.05 0.00 0.09 0.00 0.00 57.88 57.39 2w3r h LEU 547 Cb 1.07 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 2w3r h LEU 547 CO 0.10 0.65 0.41 -0.09 0.09 0.00 0.00 178.44 179.60 2w3r h ARG 548 N -0.73 0.63 -0.64 1.13 2.43 0.66 -1.80 114.38 116.06 2w3r h ARG 548 Ca -0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 2w3r h ARG 548 Cb 0.67 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 2w3r h ARG 548 CO 0.01 0.42 0.16 0.78 -1.51 0.00 0.00 179.97 179.83 2w3r h GLY 549 N 0.65 1.08 0.98 2.80 0.00 -1.05 -1.44 103.07 106.09 2w3r h GLY 549 Ca 0.26 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 2w3r h GLY 549 CO -0.08 0.60 -0.24 3.21 0.00 0.00 0.00 176.54 180.04 2w3r h ARG 550 N 0.96 0.74 -0.25 4.80 3.08 -0.98 -2.22 114.38 120.51 2w3r h ARG 550 Ca 0.21 -0.36 -0.19 0.00 0.07 0.00 0.00 59.98 59.71 2w3r h ARG 550 Cb 0.33 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2w3r h ARG 550 CO -0.00 0.97 -0.59 -0.07 -1.07 0.00 0.00 179.97 179.21 2w3r h LEU 551 N 0.50 0.91 -0.40 3.04 3.38 -1.39 -1.36 115.31 119.99 2w3r h LEU 551 Ca 0.06 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2w3r h LEU 551 Cb 0.80 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2w3r h LEU 551 CO 0.06 1.30 0.22 0.00 0.09 0.00 0.00 178.44 180.11 2w3r h ALA 552 N 0.71 0.52 -0.03 1.53 0.00 -1.29 -0.41 119.26 120.30 2w3r h ALA 552 Ca 0.00 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2w3r h ALA 552 Cb 1.20 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2w3r h ALA 552 CO 0.13 0.04 -0.34 0.78 0.00 0.00 0.00 179.25 179.86 2w3r h GLY 553 N 0.52 0.06 0.45 0.00 0.00 -1.34 0.14 103.07 102.89 2w3r h GLY 553 Ca 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 2w3r h GLY 553 CO -0.02 0.04 -0.00 -2.75 0.00 0.00 0.00 176.54 173.81 2w3r h PHE 554 N 0.05 -0.00 -0.31 5.60 3.57 -0.93 -2.60 116.94 122.31 2w3r h PHE 554 Ca 0.00 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 2w3r h PHE 554 Cb 0.62 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2w3r h PHE 554 CO 0.00 0.55 0.19 0.28 -2.23 0.00 0.00 178.31 177.10 2w3r h VAL 555 N -0.55 1.05 -0.58 1.41 2.07 -0.98 -2.05 116.25 116.61 2w3r h VAL 555 Ca -0.00 -0.13 0.09 0.00 0.82 0.00 0.00 66.70 67.47 2w3r h VAL 555 Cb 0.55 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 2w3r h VAL 555 CO 0.00 0.07 0.22 0.00 0.02 0.00 0.00 177.57 177.88 2w3r h ALA 556 N 1.13 0.74 -0.25 1.67 0.00 -0.78 0.20 119.26 121.96 2w3r h ALA 556 Ca 0.12 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 2w3r h ALA 556 Cb -0.02 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2w3r h ALA 556 CO -0.05 -0.19 -0.38 0.00 0.00 0.00 0.00 179.25 178.63 2w3r h ALA 557 N 1.39 0.86 -0.08 0.00 0.00 -1.30 0.30 119.26 120.44 2w3r h ALA 557 Ca 0.29 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2w3r h ALA 557 Cb 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2w3r h ALA 557 CO -0.29 0.64 -0.17 -0.09 0.00 0.00 0.00 179.25 179.34 2w3r h ARG 558 N 0.48 0.25 -0.00 0.00 2.43 -0.58 -3.21 114.38 113.76 2w3r h ARG 558 Ca 0.05 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2w3r h ARG 558 Cb 0.88 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2w3r h ARG 558 CO 0.08 0.76 -0.23 0.39 -1.51 0.00 0.00 179.97 179.46 2w3r n GLU 559 N -4.58 0.08 -2.18 0.20 -0.58 0.60 -5.00 120.64 109.19 2w3r n GLU 559 Ca -0.08 -0.03 -0.02 0.00 -0.42 0.00 0.00 57.16 56.62 2w3r n GLU 559 Cb 0.39 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 2w3r n GLU 559 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2w3r n GLY 560 N 1.47 -2.47 0.00 0.62 0.00 0.91 -4.97 105.19 100.76 2w3r n GLY 560 Ca 0.07 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2w3r n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s ALA 562 N -1.19 3.31 0.48 0.00 0.00 -1.26 -4.45 121.76 118.65 2w3r s ALA 562 Ca 0.00 0.49 0.16 0.00 0.00 0.00 0.00 51.96 52.62 2w3r s ALA 562 Cb 0.00 -3.17 1.17 0.00 0.00 0.00 0.00 23.12 21.13 2w3r s ALA 562 CO 0.00 0.07 2.05 0.00 0.00 0.00 0.00 175.76 177.88 2w3r h ALA 563 N 5.21 2.08 0.00 0.00 0.00 -1.92 -1.13 119.26 123.52 2w3r h ALA 563 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2w3r h ALA 563 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2w3r h ALA 563 CO 0.70 -0.16 0.00 2.89 0.00 0.00 0.00 179.25 182.68 2w3r n ARG 564 N -4.47 0.40 0.01 0.00 1.85 -1.26 -1.80 116.66 111.39 2w3r n ARG 564 Ca 0.04 0.07 0.11 0.00 -1.00 0.00 0.00 57.85 57.07 2w3r n ARG 564 Cb 0.29 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.15 2w3r n ARG 564 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2w3r n ASP 565 N -1.17 0.70 -4.67 2.89 8.00 -0.43 -4.89 116.55 116.99 2w3r n ASP 565 Ca 0.11 -0.57 -0.43 0.00 0.71 0.00 0.00 54.79 54.61 2w3r n ASP 565 Cb 0.12 1.01 -0.02 0.00 -0.02 0.00 0.00 41.12 42.20 2w3r n ASP 565 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w3r s VAL 566 N -3.12 4.29 -0.27 2.53 1.01 -0.75 -4.74 120.40 119.35 2w3r s VAL 566 Ca 0.05 1.57 -0.06 0.00 0.00 0.00 0.00 61.98 63.54 2w3r s VAL 566 Cb 0.15 -4.01 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 2w3r s VAL 566 CO 0.84 -0.11 0.04 -0.63 0.00 0.00 0.00 175.10 175.24 2w3r s ILE 567 N 3.19 3.81 -0.36 2.22 1.01 0.35 -4.94 121.20 126.48 2w3r s ILE 567 Ca 0.55 -0.58 -0.14 0.00 0.00 0.00 0.00 60.65 60.47 2w3r s ILE 567 Cb -0.22 -2.88 -0.01 0.00 0.01 0.00 0.00 42.46 39.36 2w3r s ILE 567 CO 0.16 0.21 0.28 -0.36 0.00 0.00 0.00 174.94 175.23 2w3r s PHE 568 N 1.50 3.23 -0.22 3.97 0.40 -1.26 -0.29 117.98 125.31 2w3r s PHE 568 Ca 0.04 -0.28 -0.25 0.00 -0.60 0.00 0.00 56.93 55.84 2w3r s PHE 568 Cb -0.16 -2.56 0.07 0.00 0.51 0.00 0.00 43.02 40.88 2w3r s PHE 568 CO 0.01 -0.45 0.67 0.34 0.70 0.00 0.00 175.22 176.50 2w3r s ASP 569 N 1.72 -0.69 -1.56 1.36 -1.08 0.12 -4.42 116.67 112.12 2w3r s ASP 569 Ca 0.07 1.24 -0.12 0.00 -0.52 0.00 0.00 52.55 53.22 2w3r s ASP 569 Cb -0.18 1.23 0.09 0.00 -1.46 0.00 0.00 42.92 42.60 2w3r s ASP 569 CO 0.11 -0.30 0.73 0.00 0.52 0.00 0.00 175.17 176.23 2w3r n ALA 570 N 2.39 -1.51 -0.94 3.66 0.00 -0.85 -0.28 120.51 122.99 2w3r n ALA 570 Ca -0.15 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2w3r n ALA 570 Cb 0.56 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.89 2w3r n ALA 570 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3r n GLY 571 N -1.64 0.39 3.38 0.00 0.00 0.32 -4.90 105.19 102.75 2w3r n GLY 571 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 2w3r n GLY 571 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3r s GLN 572 N -0.69 1.77 -0.09 1.61 -1.52 0.61 -0.81 119.66 120.54 2w3r s GLN 572 Ca 0.00 -1.14 0.02 0.00 -1.95 0.00 0.00 55.36 52.29 2w3r s GLN 572 Cb 0.00 -2.01 -0.02 0.00 -0.22 0.00 0.00 33.01 30.76 2w3r s GLN 572 CO 0.00 0.50 -0.16 0.08 -0.25 0.00 0.00 175.29 175.47 2w3r s VAL 573 N -0.90 2.86 -0.07 1.09 1.01 0.27 -0.70 120.40 123.97 2w3r s VAL 573 Ca 0.13 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2w3r s VAL 573 Cb -0.10 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.14 2w3r s VAL 573 CO 0.04 0.56 -0.13 -1.10 0.00 0.00 0.00 175.10 174.46 2w3r s GLN 574 N -0.11 1.82 -0.26 2.72 -0.21 0.61 -1.02 119.66 123.21 2w3r s GLN 574 Ca -0.02 -0.46 -0.19 0.00 0.02 0.00 0.00 55.36 54.70 2w3r s GLN 574 Cb -0.14 -1.49 0.07 0.00 1.00 0.00 0.00 33.01 32.46 2w3r s GLN 574 CO 0.04 0.05 0.67 0.00 -2.12 0.00 0.00 175.29 173.92 2w3r s ALA 575 N 0.60 -1.72 -1.42 6.09 0.00 -0.62 -0.50 121.76 124.20 2w3r s ALA 575 Ca -0.14 2.11 -0.02 0.00 0.00 0.00 0.00 51.96 53.90 2w3r s ALA 575 Cb -0.16 -1.23 0.00 0.00 0.00 0.00 0.00 23.12 21.73 2w3r s ALA 575 CO 0.04 -0.34 0.32 0.43 0.00 0.00 0.00 175.76 176.21 2w3r n SER 576 N 3.49 -5.40 0.00 0.00 7.64 -1.26 -2.12 113.62 115.96 2w3r n SER 576 Ca -0.17 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.55 2w3r n SER 576 Cb 0.57 -4.33 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 2w3r n SER 576 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w3r n GLY 577 N -1.26 1.79 3.90 0.23 0.00 -1.26 -4.99 105.19 103.60 2w3r n GLY 577 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 2w3r n GLY 577 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s LYS 578 N -0.07 3.65 -0.04 1.61 1.02 -0.90 -5.11 119.74 119.89 2w3r s LYS 578 Ca 0.00 -0.02 -0.00 0.00 0.02 0.00 0.00 55.97 55.97 2w3r s LYS 578 Cb 0.00 -2.75 0.03 0.00 -0.52 0.00 0.00 37.83 34.59 2w3r s LYS 578 CO 0.00 0.35 -0.00 -1.54 -0.92 0.00 0.00 175.35 173.24 2w3r s SER 579 N -2.73 0.89 0.29 2.83 1.04 -1.26 -1.58 113.70 113.17 2w3r s SER 579 Ca 0.43 -0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.89 2w3r s SER 579 Cb -0.11 -0.31 -0.04 0.00 0.10 0.00 0.00 66.02 65.66 2w3r s SER 579 CO 0.26 -0.13 0.12 0.26 0.98 0.00 0.00 173.24 174.73 2w3r s TRP 580 N 1.37 2.84 0.59 5.02 0.51 -0.19 -4.97 118.94 124.10 2w3r s TRP 580 Ca -0.05 -0.24 -0.16 0.00 -2.12 0.00 0.00 56.10 53.53 2w3r s TRP 580 Cb -0.13 -1.44 -0.04 0.00 -0.81 0.00 0.00 33.47 31.05 2w3r s TRP 580 CO -0.02 0.47 1.05 1.03 -0.51 0.00 0.00 176.95 178.96 2w3r s ARG 581 N -3.80 3.40 0.19 4.98 0.52 -1.26 -0.56 118.95 122.41 2w3r s ARG 581 Ca 0.35 1.15 -0.12 0.00 -0.52 0.00 0.00 55.73 56.58 2w3r s ARG 581 Cb -0.06 -2.05 0.20 0.00 0.52 0.00 0.00 34.95 33.57 2w3r s ARG 581 CO 0.23 -0.74 1.73 0.35 0.02 0.00 0.00 175.30 176.89 2w3r h PHE 582 N 0.46 0.24 -0.08 -0.53 3.57 -1.29 -1.76 116.94 117.55 2w3r h PHE 582 Ca -0.47 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.06 2w3r h PHE 582 Cb 1.21 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.92 2w3r h PHE 582 CO 0.60 0.04 0.05 0.00 -2.23 0.00 0.00 178.31 176.76 2w3r h ALA 583 N 1.38 1.93 0.00 2.41 0.00 -1.89 -1.92 119.26 121.17 2w3r h ALA 583 Ca 0.26 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.05 2w3r h ALA 583 Cb 0.32 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2w3r h ALA 583 CO -0.30 0.06 -0.50 0.93 0.00 0.00 0.00 179.25 179.44 2w3r h GLU 584 N 0.11 0.00 0.06 0.00 5.08 -1.69 -2.36 114.58 115.78 2w3r h GLU 584 Ca 0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.21 2w3r h GLU 584 Cb 0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 2w3r h GLU 584 CO -0.01 0.50 -0.73 0.82 -1.00 0.00 0.00 179.01 178.60 2w3r h ILE 585 N 0.00 1.45 -0.04 3.13 1.08 -1.26 -3.15 117.51 118.72 2w3r h ILE 585 Ca -0.01 -2.28 -0.00 0.00 -0.39 0.00 0.00 64.86 62.18 2w3r h ILE 585 Cb 0.90 2.83 -0.00 0.00 -3.07 0.00 0.00 36.82 37.48 2w3r h ILE 585 CO 0.07 0.66 0.02 0.58 -0.69 0.00 0.00 178.15 178.78 2w3r h VAL 586 N -0.18 1.07 -0.91 1.67 2.07 -1.41 0.19 116.25 118.75 2w3r h VAL 586 Ca -0.11 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.28 2w3r h VAL 586 Cb 1.48 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 32.34 2w3r h VAL 586 CO 0.14 0.06 0.59 0.00 0.02 0.00 0.00 177.57 178.38 2w3r h ALA 587 N 0.93 1.53 -0.27 1.67 0.00 -1.58 0.27 119.26 121.81 2w3r h ALA 587 Ca 0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 587 Cb 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2w3r h ALA 587 CO -0.00 0.31 -0.04 0.00 0.00 0.00 0.00 179.25 179.52 2w3r h ALA 588 N 1.52 0.37 -0.22 0.00 0.00 -1.37 0.11 119.26 119.67 2w3r h ALA 588 Ca 0.40 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 588 Cb 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2w3r h ALA 588 CO -0.16 0.16 -0.11 0.00 0.00 0.00 0.00 179.25 179.14 2w3r h ALA 589 N 0.79 1.42 0.39 0.00 0.00 -0.09 0.22 119.26 121.99 2w3r h ALA 589 Ca 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2w3r h ALA 589 Cb 0.50 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2w3r h ALA 589 CO 0.02 0.40 -0.19 -0.92 0.00 0.00 0.00 179.25 178.57 2w3r h TYR 590 N 0.33 -0.48 -0.92 0.00 3.20 -0.18 -0.06 116.97 118.86 2w3r h TYR 590 Ca 0.07 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.02 2w3r h TYR 590 Cb 0.39 0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.76 2w3r h TYR 590 CO 0.01 -0.26 0.59 0.52 -1.64 0.00 0.00 178.16 177.38 2w3r h MET 591 N -0.59 0.92 0.00 1.82 2.86 -0.40 0.72 114.93 120.26 2w3r h MET 591 Ca -0.05 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2w3r h MET 591 Cb 0.44 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.89 2w3r h MET 591 CO 0.09 0.61 0.00 0.00 1.06 0.00 0.00 176.91 178.67 2w3r h ALA 592 N 1.54 1.00 -3.26 6.32 0.00 -0.38 -3.48 119.26 120.99 2w3r h ALA 592 Ca 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 2w3r h ALA 592 Cb 0.36 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.17 2w3r h ALA 592 CO -0.18 0.00 -0.08 0.54 0.00 0.00 0.00 179.25 179.53 2w3r n ARG 593 N -2.79 -0.23 -5.17 0.00 1.74 0.25 -5.06 116.66 105.40 2w3r n ARG 593 Ca 0.01 0.18 -0.32 0.00 -0.77 0.00 0.00 57.85 56.95 2w3r n ARG 593 Cb 0.28 -1.97 -0.15 0.00 -1.02 0.00 0.00 32.46 29.60 2w3r n ARG 593 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2w3r s ILE 594 N -3.04 2.34 -0.05 0.55 1.01 -0.55 -5.03 121.20 116.44 2w3r s ILE 594 Ca 0.04 -0.98 -0.30 0.00 0.00 0.00 0.00 60.65 59.41 2w3r s ILE 594 Cb -0.01 -1.86 -0.07 0.00 0.01 0.00 0.00 42.46 40.54 2w3r s ILE 594 CO 0.08 0.58 1.86 -0.55 0.00 0.00 0.00 174.94 176.91 2w3r s SER 595 N -0.44 6.40 -0.48 3.58 0.15 -1.26 -4.64 113.70 117.00 2w3r s SER 595 Ca 0.05 2.33 0.03 0.00 0.70 0.00 0.00 55.95 59.06 2w3r s SER 595 Cb -0.12 -2.53 0.57 0.00 -1.71 0.00 0.00 66.02 62.23 2w3r s SER 595 CO 0.01 -1.14 1.85 0.18 1.20 0.00 0.00 173.24 175.34 2w3r n LEU 596 N 7.98 6.54 -3.84 3.45 4.77 -1.26 -4.88 117.00 129.76 2w3r n LEU 596 Ca 0.20 -3.90 -0.15 0.00 -0.03 0.00 0.00 56.01 52.13 2w3r n LEU 596 Cb 0.42 -0.82 -0.15 0.00 -2.33 0.00 0.00 43.42 40.54 2w3r n LEU 596 CO 0.66 1.27 -0.37 -0.55 -1.33 0.00 0.00 177.39 177.07 2w3r s SER 597 N -1.78 0.25 -0.12 -1.43 0.15 -1.26 -0.92 113.70 108.60 2w3r s SER 597 Ca 0.57 -0.01 -0.15 0.00 0.70 0.00 0.00 55.95 57.06 2w3r s SER 597 Cb 0.47 -0.11 0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2w3r s SER 597 CO 0.05 -0.06 0.40 0.00 1.20 0.00 0.00 173.24 174.83 2w3r s ALA 598 N 0.64 -0.99 0.48 5.45 0.00 -0.82 -5.03 121.76 121.50 2w3r s ALA 598 Ca -0.06 0.97 -0.02 0.00 0.00 0.00 0.00 51.96 52.85 2w3r s ALA 598 Cb -0.09 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 2w3r s ALA 598 CO -0.01 -0.21 0.74 0.95 0.00 0.00 0.00 175.76 177.22 2w3r s THR 599 N -0.18 4.20 0.01 0.00 -4.23 -1.26 -1.32 115.64 112.86 2w3r s THR 599 Ca -0.03 -0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 2w3r s THR 599 Cb -0.03 -3.59 -0.01 0.00 1.34 0.00 0.00 72.50 70.21 2w3r s THR 599 CO 0.02 -0.49 -0.01 -0.83 -0.54 0.00 0.00 174.62 172.77 2w3r s GLY 600 N -4.20 0.17 -0.07 3.99 0.00 -0.57 -3.96 107.32 102.68 2w3r s GLY 600 Ca 0.49 -0.42 -0.07 0.00 0.00 0.00 0.00 44.72 44.72 2w3r s GLY 600 CO 0.41 -0.48 0.19 -0.12 0.00 0.00 0.00 173.10 173.10 2w3r s PHE 601 N -1.12 -0.19 0.02 1.90 5.36 -1.26 0.01 117.98 122.69 2w3r s PHE 601 Ca -0.12 0.47 0.01 0.00 -0.96 0.00 0.00 56.93 56.33 2w3r s PHE 601 Cb -0.08 0.06 -0.02 0.00 -0.34 0.00 0.00 43.02 42.65 2w3r s PHE 601 CO -0.01 -0.12 -0.05 -0.47 -1.46 0.00 0.00 175.22 173.11 2w3r s TYR 602 N -0.03 0.44 -0.04 10.12 5.04 0.16 -4.73 117.35 128.32 2w3r s TYR 602 Ca -0.01 -0.40 -0.01 0.00 -2.44 0.00 0.00 57.07 54.20 2w3r s TYR 602 Cb -0.02 -0.28 0.03 0.00 0.35 0.00 0.00 41.96 42.04 2w3r s TYR 602 CO 0.00 -0.10 0.07 0.00 -1.34 0.00 0.00 175.55 174.19 2w3r s ALA 603 N -1.09 -0.07 -0.11 3.97 0.00 -1.26 -0.56 121.76 122.64 2w3r s ALA 603 Ca -0.09 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 2w3r s ALA 603 Cb -0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 2w3r s ALA 603 CO -0.00 -0.12 1.41 0.99 0.00 0.00 0.00 175.76 178.04 2w3r s THR 604 N 0.97 3.98 0.86 0.00 2.01 -0.48 -5.01 115.64 117.98 2w3r s THR 604 Ca -0.08 1.22 -0.13 0.00 0.31 0.00 0.00 61.69 63.01 2w3r s THR 604 Cb -0.11 -3.79 0.13 0.00 0.01 0.00 0.00 72.50 68.75 2w3r s THR 604 CO -0.04 -0.09 1.22 -2.16 -0.69 0.00 0.00 174.62 172.86 2w3r s PRO 605 N 3.51 1.42 0.00 4.92 0.04 -1.26 -4.38 135.00 139.26 2w3r s PRO 605 Ca 0.62 -0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.48 2w3r s PRO 605 Cb -0.27 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2w3r s PRO 605 CO 0.21 -1.90 0.00 1.63 0.04 0.00 0.00 177.00 176.98 2w3r n LYS 606 N -3.45 0.00 -3.00 4.56 5.02 -1.26 -4.90 118.16 115.13 2w3r n LYS 606 Ca 0.11 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.00 2w3r n LYS 606 Cb 0.60 -3.08 -0.05 0.00 -0.02 0.00 0.00 35.03 32.49 2w3r n LYS 606 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2w3r s LEU 607 N 0.00 4.22 -0.30 -0.35 1.43 -1.26 -4.85 118.68 117.56 2w3r s LEU 607 Ca 0.00 1.10 -0.15 0.00 -1.03 0.00 0.00 54.13 54.05 2w3r s LEU 607 Cb 0.00 -3.10 0.16 0.00 0.03 0.00 0.00 46.19 43.29 2w3r s LEU 607 CO 0.00 -0.27 0.98 -0.55 0.23 0.00 0.00 176.35 176.74 2w3r s SER 608 N 1.05 -0.59 0.04 2.29 0.15 0.45 -5.03 113.70 112.06 2w3r s SER 608 Ca 0.36 0.80 -0.23 0.00 0.70 0.00 0.00 55.95 57.58 2w3r s SER 608 Cb -0.17 1.67 0.05 0.00 -1.71 0.00 0.00 66.02 65.86 2w3r s SER 608 CO 0.14 -0.11 0.54 -1.66 1.20 0.00 0.00 173.24 173.34 2w3r s TRP 609 N 2.46 -0.45 -0.34 3.44 1.48 -1.26 0.60 118.94 124.88 2w3r s TRP 609 Ca -0.03 0.52 -0.11 0.00 -1.06 0.00 0.00 56.10 55.42 2w3r s TRP 609 Cb -0.06 0.36 -0.00 0.00 -1.16 0.00 0.00 33.47 32.60 2w3r s TRP 609 CO -0.17 -0.65 0.20 0.34 -4.06 0.00 0.00 176.95 172.61 2w3r s ASP 610 N -1.94 5.79 0.18 -2.66 3.68 0.24 -4.97 116.67 117.00 2w3r s ASP 610 Ca -0.06 -0.59 -0.13 0.00 2.13 0.00 0.00 52.55 53.91 2w3r s ASP 610 Cb -0.01 -2.06 0.11 0.00 -1.45 0.00 0.00 42.92 39.51 2w3r s ASP 610 CO -0.01 -0.26 1.83 -0.09 0.13 0.00 0.00 175.17 176.77 2w3r h ARG 611 N 8.43 0.67 0.01 4.34 2.43 -1.96 -0.36 114.38 127.94 2w3r h ARG 611 Ca -0.30 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2w3r h ARG 611 Cb 1.14 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2w3r h ARG 611 CO 0.64 0.44 -0.01 -0.07 -1.51 0.00 0.00 179.97 179.46 2w3r h LEU 612 N 0.69 -0.01 -1.93 3.80 3.38 -1.96 -3.19 115.31 116.09 2w3r h LEU 612 Ca 0.22 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2w3r h LEU 612 Cb -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2w3r h LEU 612 CO -0.08 0.55 -0.11 0.03 0.09 0.00 0.00 178.44 178.92 2w3r h ARG 613 N -0.59 0.00 -4.24 1.13 2.47 -1.94 -3.47 114.38 107.74 2w3r h ARG 613 Ca -0.00 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.47 2w3r h ARG 613 Cb 0.57 0.00 0.10 0.00 -1.65 0.00 0.00 29.97 28.99 2w3r h ARG 613 CO 0.00 0.11 -0.46 0.41 0.56 0.00 0.00 179.97 180.59 2w3r n GLY 614 N -0.65 -0.04 2.92 0.04 0.00 -0.19 -4.86 105.19 102.41 2w3r n GLY 614 Ca -0.02 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 2w3r n GLY 614 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3r s GLN 615 N -5.63 0.30 0.00 1.61 -1.52 -0.92 -4.35 119.66 109.16 2w3r s GLN 615 Ca 0.29 -0.12 0.00 0.00 -1.95 0.00 0.00 55.36 53.58 2w3r s GLN 615 Cb -0.13 -0.31 0.00 0.00 -0.22 0.00 0.00 33.01 32.36 2w3r s GLN 615 CO 0.48 0.06 0.00 0.41 -0.25 0.00 0.00 175.29 175.99 2w3r n GLY 616 N 3.07 0.73 3.11 3.09 0.00 -0.71 0.83 105.19 115.31 2w3r n GLY 616 Ca -0.14 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 43.43 2w3r n GLY 616 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3r s ARG 617 N -1.04 2.36 0.12 1.61 3.52 0.20 -3.94 118.95 121.78 2w3r s ARG 617 Ca 0.00 -2.21 0.09 0.00 -0.13 0.00 0.00 55.73 53.47 2w3r s ARG 617 Cb 0.00 -3.69 -0.18 0.00 -1.56 0.00 0.00 34.95 29.52 2w3r s ARG 617 CO 0.00 -1.14 1.23 -1.00 -0.81 0.00 0.00 175.30 173.58 2w3r h PRO 618 N 7.51 0.00 -6.28 5.12 0.13 -1.93 0.13 132.00 136.68 2w3r h PRO 618 Ca -0.07 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.46 2w3r h PRO 618 Cb 1.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.03 2w3r h PRO 618 CO 0.72 0.87 -0.62 -0.06 -0.23 0.00 0.00 178.00 178.68 2w3r s PHE 619 N -2.73 3.00 -0.08 1.56 2.99 -1.26 -4.74 117.98 116.72 2w3r s PHE 619 Ca 0.01 -0.06 -0.20 0.00 0.00 0.00 0.00 56.93 56.68 2w3r s PHE 619 Cb 0.09 -1.47 -0.29 0.00 0.00 0.00 0.00 43.02 41.35 2w3r s PHE 619 CO 0.81 0.51 0.74 1.25 -0.00 0.00 0.00 175.22 178.53 2w3r h LEU 620 N 2.78 0.40 -8.05 -0.37 5.85 -1.62 -3.47 115.31 110.82 2w3r h LEU 620 Ca -0.47 -0.90 -0.03 0.00 0.84 0.00 0.00 57.88 57.31 2w3r h LEU 620 Cb 1.19 -0.13 -0.09 0.00 0.37 0.00 0.00 40.66 42.00 2w3r h LEU 620 CO 0.61 1.46 -0.05 -0.72 -0.34 0.00 0.00 178.44 179.40 2w3r s TYR 621 N -2.44 0.17 0.17 1.25 -0.85 -1.26 -4.96 117.35 109.44 2w3r s TYR 621 Ca -0.17 -0.54 0.06 0.00 -0.52 0.00 0.00 57.07 55.90 2w3r s TYR 621 Cb 0.02 0.29 -0.04 0.00 0.38 0.00 0.00 41.96 42.61 2w3r s TYR 621 CO 0.79 -0.98 0.09 -0.06 -1.52 0.00 0.00 175.55 173.87 2w3r s PHE 622 N -3.96 3.04 -0.15 -3.49 0.40 -1.26 -0.58 117.98 111.97 2w3r s PHE 622 Ca 0.17 -0.06 -0.02 0.00 -0.60 0.00 0.00 56.93 56.42 2w3r s PHE 622 Cb -0.01 -1.46 -0.02 0.00 0.51 0.00 0.00 43.02 42.04 2w3r s PHE 622 CO 0.05 0.52 -0.09 0.00 0.70 0.00 0.00 175.22 176.40 2w3r s ALA 623 N -1.77 2.77 0.29 5.36 0.00 0.89 -4.92 121.76 124.38 2w3r s ALA 623 Ca 0.30 -0.90 0.09 0.00 0.00 0.00 0.00 51.96 51.45 2w3r s ALA 623 Cb -0.10 -1.39 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 2w3r s ALA 623 CO 0.22 0.14 0.00 0.71 0.00 0.00 0.00 175.76 176.83 2w3r s TYR 624 N 0.51 2.64 -0.06 0.00 1.51 -1.26 -1.82 117.35 118.88 2w3r s TYR 624 Ca -0.06 -0.28 -0.31 0.00 -1.01 0.00 0.00 57.07 55.40 2w3r s TYR 624 Cb -0.15 -1.28 0.13 0.00 -0.11 0.00 0.00 41.96 40.55 2w3r s TYR 624 CO 0.04 0.57 1.36 0.20 -1.11 0.00 0.00 175.55 176.61 2w3r s GLY 625 N -3.69 -0.40 -0.10 0.71 0.00 -1.15 -0.77 107.32 101.93 2w3r s GLY 625 Ca 0.33 0.68 -0.16 0.00 0.00 0.00 0.00 44.72 45.56 2w3r s GLY 625 CO 0.20 1.51 0.40 0.00 0.00 0.00 0.00 173.10 175.21 2w3r s ALA 626 N -2.15 -1.01 -0.05 3.20 0.00 -0.37 -0.70 121.76 120.67 2w3r s ALA 626 Ca 0.18 0.91 0.02 0.00 0.00 0.00 0.00 51.96 53.06 2w3r s ALA 626 Cb 0.05 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.81 2w3r s ALA 626 CO -0.05 -0.23 -0.08 0.00 0.00 0.00 0.00 175.76 175.40 2w3r s ALA 627 N -0.41 0.91 -0.30 0.00 0.00 -0.89 -1.88 121.76 119.19 2w3r s ALA 627 Ca -0.05 -0.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.63 2w3r s ALA 627 Cb -0.03 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2w3r s ALA 627 CO 0.03 0.04 0.10 0.42 0.00 0.00 0.00 175.76 176.34 2w3r s ILE 628 N 0.80 4.08 -0.00 0.00 1.01 -0.21 -1.72 121.20 125.16 2w3r s ILE 628 Ca -0.13 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 59.89 2w3r s ILE 628 Cb -0.15 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.18 2w3r s ILE 628 CO 0.02 0.06 -0.08 -0.89 0.00 0.00 0.00 174.94 174.05 2w3r s THR 629 N 1.52 3.57 -0.06 2.92 2.01 -0.45 -0.79 115.64 124.36 2w3r s THR 629 Ca 0.03 -0.78 0.04 0.00 0.31 0.00 0.00 61.69 61.29 2w3r s THR 629 Cb -0.17 -2.54 0.00 0.00 0.01 0.00 0.00 72.50 69.80 2w3r s THR 629 CO 0.03 0.41 -0.17 -0.70 -0.69 0.00 0.00 174.62 173.51 2w3r s GLU 630 N -1.34 1.92 0.24 4.92 2.12 -0.09 -1.87 118.70 124.59 2w3r s GLU 630 Ca 0.16 -0.59 0.01 0.00 0.36 0.00 0.00 54.97 54.91 2w3r s GLU 630 Cb -0.11 -1.60 -0.05 0.00 0.26 0.00 0.00 34.13 32.63 2w3r s GLU 630 CO 0.07 0.18 0.11 0.14 -0.54 0.00 0.00 175.26 175.21 2w3r s VAL 631 N 0.24 0.37 -0.01 3.70 -7.23 0.33 -0.00 120.40 117.80 2w3r s VAL 631 Ca -0.09 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.10 2w3r s VAL 631 Cb -0.13 -2.59 -0.00 0.00 0.56 0.00 0.00 36.38 34.21 2w3r s VAL 631 CO 0.03 0.00 -0.06 0.68 -0.31 0.00 0.00 175.10 175.45 2w3r s VAL 632 N -3.88 0.45 0.20 1.32 -7.23 -0.32 -1.71 120.40 109.23 2w3r s VAL 632 Ca 0.38 -0.23 0.10 0.00 -1.81 0.00 0.00 61.98 60.42 2w3r s VAL 632 Cb 0.08 -0.39 -0.04 0.00 0.56 0.00 0.00 36.38 36.58 2w3r s VAL 632 CO 0.13 0.13 -0.21 0.27 -0.31 0.00 0.00 175.10 175.12 2w3r s ILE 633 N -0.08 2.16 -0.30 -0.62 -4.36 0.31 -1.73 121.20 116.58 2w3r s ILE 633 Ca 0.02 -2.09 -0.08 0.00 -0.26 0.00 0.00 60.65 58.23 2w3r s ILE 633 Cb -0.03 -2.07 0.00 0.00 1.25 0.00 0.00 42.46 41.62 2w3r s ILE 633 CO -0.00 -0.28 0.12 -0.62 0.24 0.00 0.00 174.94 174.40 2w3r s ASP 634 N -2.90 5.36 0.57 4.36 2.15 0.83 -1.92 116.67 125.12 2w3r s ASP 634 Ca 0.21 -0.61 0.33 0.00 0.43 0.00 0.00 52.55 52.92 2w3r s ASP 634 Cb -0.06 -1.95 1.74 0.00 -0.30 0.00 0.00 42.92 42.35 2w3r s ASP 634 CO 0.10 -0.19 2.16 0.03 -0.17 0.00 0.00 175.17 177.09 2w3r h ARG 635 N 8.30 0.00 0.18 4.34 3.08 -1.05 0.39 114.38 129.62 2w3r h ARG 635 Ca -0.32 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.41 2w3r h ARG 635 Cb 1.14 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.20 2w3r h ARG 635 CO 0.61 0.06 -1.52 -0.07 -1.07 0.00 0.00 179.97 177.97 2w3r h LEU 636 N 0.00 0.60 0.00 3.04 3.38 -1.94 -3.43 115.31 116.96 2w3r h LEU 636 Ca -0.00 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 57.21 2w3r h LEU 636 Cb 0.23 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2w3r h LEU 636 CO 0.01 1.60 -1.05 0.35 0.09 0.00 0.00 178.44 179.44 2w3r n THR 637 N -3.59 0.05 0.00 0.22 -2.24 -1.12 -5.03 114.28 102.57 2w3r n THR 637 Ca -0.17 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2w3r n THR 637 Cb 1.07 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 2w3r n THR 637 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3r n GLY 638 N 3.24 0.90 3.75 3.38 0.00 0.14 -4.44 105.19 112.15 2w3r n GLY 638 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2w3r n GLY 638 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w3r s GLU 639 N -0.82 3.23 0.00 1.61 2.02 -1.26 -4.14 118.70 119.34 2w3r s GLU 639 Ca 0.00 2.28 -0.25 0.00 0.02 0.00 0.00 54.97 57.03 2w3r s GLU 639 Cb 0.00 -2.33 0.06 0.00 0.10 0.00 0.00 34.13 31.96 2w3r s GLU 639 CO 0.00 -1.14 0.55 0.54 0.02 0.00 0.00 175.26 175.24 2w3r s ASN 640 N -0.86 -0.49 -0.03 -0.19 2.20 -1.26 -0.12 114.94 114.19 2w3r s ASN 640 Ca 0.70 0.38 -0.02 0.00 -0.94 0.00 0.00 52.86 52.98 2w3r s ASN 640 Cb -0.41 0.49 0.01 0.00 -2.00 0.00 0.00 41.25 39.33 2w3r s ASN 640 CO 0.50 -0.64 0.06 -0.60 -2.94 0.00 0.00 177.10 173.48 2w3r s ARG 641 N -1.79 0.07 -0.15 3.55 3.52 -0.70 -4.98 118.95 118.47 2w3r s ARG 641 Ca -0.09 0.11 -0.29 0.00 -0.13 0.00 0.00 55.73 55.34 2w3r s ARG 641 Cb -0.01 0.00 -0.01 0.00 -1.56 0.00 0.00 34.95 33.38 2w3r s ARG 641 CO 0.04 -0.03 0.98 0.42 -0.81 0.00 0.00 175.30 175.90 2w3r s ILE 642 N 0.17 4.78 -0.17 4.11 1.01 -1.26 -1.18 121.20 128.66 2w3r s ILE 642 Ca -0.01 1.96 0.10 0.00 0.00 0.00 0.00 60.65 62.69 2w3r s ILE 642 Cb -0.02 -4.28 -0.23 0.00 0.01 0.00 0.00 42.46 37.95 2w3r s ILE 642 CO -0.00 -0.03 0.18 0.18 0.00 0.00 0.00 174.94 175.26 2w3r n LEU 643 N 5.34 1.22 -3.59 2.97 4.77 1.00 -3.50 117.00 125.21 2w3r n LEU 643 Ca 0.09 0.09 -0.16 0.00 -0.03 0.00 0.00 56.01 56.00 2w3r n LEU 643 Cb 0.48 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 2w3r n LEU 643 CO 0.51 0.62 0.43 -0.60 -1.33 0.00 0.00 177.39 177.02 2w3r s ARG 644 N -2.53 0.93 0.02 3.23 3.52 -1.15 -1.81 118.95 121.16 2w3r s ARG 644 Ca -0.16 0.70 0.04 0.00 -0.13 0.00 0.00 55.73 56.18 2w3r s ARG 644 Cb 0.07 0.44 -0.02 0.00 -1.56 0.00 0.00 34.95 33.89 2w3r s ARG 644 CO 0.77 -0.19 -0.11 0.99 -0.81 0.00 0.00 175.30 175.95 2w3r s THR 645 N -0.25 0.85 -0.16 4.11 2.01 0.85 -0.92 115.64 122.14 2w3r s THR 645 Ca -0.04 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.14 2w3r s THR 645 Cb -0.03 -0.78 0.04 0.00 0.01 0.00 0.00 72.50 71.75 2w3r s THR 645 CO 0.05 -0.01 -0.02 -1.81 -0.69 0.00 0.00 174.62 172.14 2w3r s ASP 646 N -0.91 2.64 -0.10 3.53 1.01 0.03 -0.95 116.67 121.93 2w3r s ASP 646 Ca -0.00 -0.61 0.03 0.00 0.71 0.00 0.00 52.55 52.68 2w3r s ASP 646 Cb -0.07 -0.74 -0.01 0.00 1.01 0.00 0.00 42.92 43.12 2w3r s ASP 646 CO 0.01 -0.22 -0.21 -0.63 0.21 0.00 0.00 175.17 174.32 2w3r s ILE 647 N 1.76 2.30 -0.20 0.77 1.01 0.16 -1.04 121.20 125.96 2w3r s ILE 647 Ca 0.01 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.73 2w3r s ILE 647 Cb -0.15 -1.89 0.03 0.00 0.01 0.00 0.00 42.46 40.45 2w3r s ILE 647 CO -0.07 0.55 -0.17 -0.22 0.00 0.00 0.00 174.94 175.03 2w3r s LEU 648 N 0.25 2.47 0.01 2.97 2.96 -0.79 -0.60 118.68 125.96 2w3r s LEU 648 Ca -0.14 -0.79 0.05 0.00 -0.22 0.00 0.00 54.13 53.02 2w3r s LEU 648 Cb -0.17 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.99 2w3r s LEU 648 CO 0.07 -0.04 -0.15 -2.28 -1.32 0.00 0.00 176.35 172.63 2w3r s HIS 649 N 1.27 1.30 -0.43 5.38 5.65 -0.65 -1.24 115.29 126.57 2w3r s HIS 649 Ca 0.02 -0.29 -0.21 0.00 0.25 0.00 0.00 55.06 54.83 2w3r s HIS 649 Cb -0.15 -0.80 0.02 0.00 -1.18 0.00 0.00 32.58 30.47 2w3r s HIS 649 CO -0.11 0.01 0.64 0.34 -0.65 0.00 0.00 174.74 174.98 2w3r s ASP 650 N -0.71 6.34 -0.16 9.88 2.15 0.05 0.15 116.67 134.38 2w3r s ASP 650 Ca 0.04 -0.28 0.16 0.00 0.43 0.00 0.00 52.55 52.90 2w3r s ASP 650 Cb -0.07 -2.32 0.58 0.00 -0.30 0.00 0.00 42.92 40.81 2w3r s ASP 650 CO 0.00 -0.76 1.49 0.00 -0.17 0.00 0.00 175.17 175.73 2w3r n ALA 651 N 6.25 3.06 -0.79 3.66 0.00 -1.25 -4.37 120.51 127.06 2w3r n ALA 651 Ca -0.01 -1.98 0.00 0.00 0.00 0.00 0.00 53.44 51.45 2w3r n ALA 651 Cb 0.48 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.14 2w3r n ALA 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3r n GLY 652 N 0.07 1.46 3.53 0.00 0.00 -1.26 -0.44 105.19 108.55 2w3r n GLY 652 Ca 0.22 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.19 2w3r n GLY 652 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s ALA 653 N -1.88 3.44 0.12 4.61 0.00 0.32 -3.58 121.76 124.80 2w3r s ALA 653 Ca 0.00 -2.95 -0.33 0.00 0.00 0.00 0.00 51.96 48.68 2w3r s ALA 653 Cb 0.00 -4.43 -0.18 0.00 0.00 0.00 0.00 23.12 18.51 2w3r s ALA 653 CO 0.00 -3.16 0.79 0.45 0.00 0.00 0.00 175.76 173.84 2w3r n SER 654 N 7.49 -0.51 0.11 0.00 2.88 -1.20 -3.62 113.62 118.76 2w3r n SER 654 Ca 0.41 1.14 -0.02 0.00 -1.33 0.00 0.00 58.87 59.07 2w3r n SER 654 Cb 0.46 -0.97 0.02 0.00 -0.75 0.00 0.00 64.21 62.97 2w3r n SER 654 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2w3r h LEU 655 N 1.97 0.00 -6.22 2.46 3.38 -1.91 -3.36 115.31 111.63 2w3r h LEU 655 Ca -0.38 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.47 2w3r h LEU 655 Cb 1.43 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.91 2w3r h LEU 655 CO 0.61 0.73 -0.48 0.21 0.09 0.00 0.00 178.44 179.61 2w3r s ASN 656 N -6.63 -0.25 0.19 -0.43 3.84 -1.26 -0.41 114.94 109.99 2w3r s ASN 656 Ca 0.01 -0.13 -0.10 0.00 0.21 0.00 0.00 52.86 52.85 2w3r s ASN 656 Cb 0.10 1.41 0.12 0.00 -0.55 0.00 0.00 41.25 42.33 2w3r s ASN 656 CO 0.78 -0.33 1.78 -0.65 -2.79 0.00 0.00 177.10 175.89 2w3r h PRO 657 N 8.11 1.01 0.32 0.43 0.11 -1.80 0.62 132.00 140.80 2w3r h PRO 657 Ca -0.08 -0.15 -0.00 0.00 0.11 0.00 0.00 66.00 65.88 2w3r h PRO 657 Cb 1.14 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 2w3r h PRO 657 CO 0.23 0.79 -0.31 0.00 -0.21 0.00 0.00 178.00 178.51 2w3r h ALA 658 N 1.16 -0.66 -0.95 -0.75 0.00 -1.88 0.13 119.26 116.31 2w3r h ALA 658 Ca 0.24 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2w3r h ALA 658 Cb 0.12 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2w3r h ALA 658 CO -0.03 -0.90 0.60 -0.07 0.00 0.00 0.00 179.25 178.85 2w3r h LEU 659 N -0.65 0.97 -0.75 0.00 3.38 -1.77 -1.79 115.31 114.69 2w3r h LEU 659 Ca -0.02 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2w3r h LEU 659 Cb 0.59 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2w3r h LEU 659 CO -0.06 0.62 0.04 0.44 0.09 0.00 0.00 178.44 179.58 2w3r h ASP 660 N 1.11 0.95 -0.46 -0.43 5.19 -0.48 -0.79 116.42 121.51 2w3r h ASP 660 Ca 0.41 -0.24 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 2w3r h ASP 660 Cb 0.15 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 2w3r h ASP 660 CO -0.17 0.99 0.25 0.40 -3.12 0.00 0.00 179.24 177.59 2w3r h ILE 661 N 0.92 1.17 -0.50 0.35 1.08 -0.42 -2.65 117.51 117.45 2w3r h ILE 661 Ca 0.17 -0.43 0.07 0.00 -0.39 0.00 0.00 64.86 64.29 2w3r h ILE 661 Cb 0.48 0.61 -0.06 0.00 -3.07 0.00 0.00 36.82 34.78 2w3r h ILE 661 CO 0.02 0.17 0.18 1.23 -0.69 0.00 0.00 178.15 179.06 2w3r h GLY 662 N 0.60 0.67 1.03 5.37 0.00 -0.78 -0.80 103.07 109.16 2w3r h GLY 662 Ca 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 2w3r h GLY 662 CO -0.03 0.01 0.51 1.46 0.00 0.00 0.00 176.54 178.49 2w3r h GLN 663 N 0.35 1.27 -0.04 4.80 1.08 -1.06 -1.14 115.11 120.38 2w3r h GLN 663 Ca 0.24 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 2w3r h GLN 663 Cb 0.26 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2w3r h GLN 663 CO -0.25 0.92 -0.03 0.82 -0.95 0.00 0.00 178.83 179.34 2w3r h ILE 664 N 1.28 1.36 -0.69 2.54 2.04 -1.06 0.13 117.51 123.10 2w3r h ILE 664 Ca 0.32 -1.10 0.10 0.00 1.00 0.00 0.00 64.86 65.18 2w3r h ILE 664 Cb 0.01 2.02 -0.07 0.00 -0.74 0.00 0.00 36.82 38.04 2w3r h ILE 664 CO -0.05 0.30 0.32 -0.33 0.00 0.00 0.00 178.15 178.38 2w3r h GLU 665 N -0.35 0.53 0.06 2.37 5.08 -1.09 0.91 114.58 122.08 2w3r h GLU 665 Ca 0.01 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2w3r h GLU 665 Cb 0.49 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2w3r h GLU 665 CO 0.01 0.35 -0.03 0.78 -1.00 0.00 0.00 179.01 179.12 2w3r h GLY 666 N 0.54 -0.08 1.00 -3.84 0.00 -1.19 -3.02 103.07 96.48 2w3r h GLY 666 Ca 0.35 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 2w3r h GLY 666 CO -0.29 -0.03 0.37 0.00 0.00 0.00 0.00 176.54 176.59 2w3r h ALA 667 N 0.38 0.88 -0.29 3.60 0.00 -0.54 -2.22 119.26 121.08 2w3r h ALA 667 Ca -0.01 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 667 Cb 0.46 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2w3r h ALA 667 CO 0.01 0.41 0.07 -0.92 0.00 0.00 0.00 179.25 178.82 2w3r h TYR 668 N 0.95 0.11 -0.82 0.00 3.20 -0.88 0.21 116.97 119.73 2w3r h TYR 668 Ca 0.24 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 2w3r h TYR 668 Cb 0.05 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.27 2w3r h TYR 668 CO -0.00 0.03 0.51 0.28 -1.64 0.00 0.00 178.16 177.34 2w3r h VAL 669 N 0.18 1.22 -0.27 1.81 2.07 -1.37 0.16 116.25 120.05 2w3r h VAL 669 Ca 0.13 -0.46 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 2w3r h VAL 669 Cb 0.13 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2w3r h VAL 669 CO -0.17 0.23 -0.26 -0.61 0.02 0.00 0.00 177.57 176.78 2w3r h GLN 670 N 1.12 0.66 0.51 1.57 4.15 -0.82 0.91 115.11 123.21 2w3r h GLN 670 Ca 0.30 -0.34 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 2w3r h GLN 670 Cb -0.08 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 2w3r h GLN 670 CO -0.06 0.95 -0.32 0.78 -1.93 0.00 0.00 178.83 178.26 2w3r h GLY 671 N 0.39 -0.84 0.51 2.39 0.00 -0.15 -0.95 103.07 104.42 2w3r h GLY 671 Ca 0.04 0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.80 2w3r h GLY 671 CO 0.07 -0.31 0.23 0.00 0.00 0.00 0.00 176.54 176.52 2w3r h ALA 672 N -0.36 0.71 -0.82 3.60 0.00 -0.74 -2.57 119.26 119.09 2w3r h ALA 672 Ca -0.06 0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2w3r h ALA 672 Cb 0.64 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 2w3r h ALA 672 CO 0.06 -0.17 0.49 0.78 0.00 0.00 0.00 179.25 180.42 2w3r h GLY 673 N 0.43 1.24 0.78 0.00 0.00 -0.63 -1.41 103.07 103.47 2w3r h GLY 673 Ca 0.27 -0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.33 2w3r h GLY 673 CO -0.25 0.22 0.59 -0.25 0.00 0.00 0.00 176.54 176.84 2w3r h TRP 674 N 0.88 1.02 -0.55 5.60 7.01 -0.76 -2.44 115.95 126.71 2w3r h TRP 674 Ca 0.37 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.39 2w3r h TRP 674 Cb 0.21 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.94 2w3r h TRP 674 CO -0.05 0.50 0.00 1.28 -2.79 0.00 0.00 178.44 177.39 2w3r n LEU 675 N -4.51 3.86 0.00 0.65 4.77 -0.58 -4.53 117.00 116.66 2w3r n LEU 675 Ca 0.15 -1.94 0.00 0.00 -0.03 0.00 0.00 56.01 54.18 2w3r n LEU 675 Cb 0.25 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 2w3r n LEU 675 CO 0.32 0.71 0.00 0.35 -1.33 0.00 0.00 177.39 177.44 2w3r n THR 676 N 0.98 0.00 0.51 -5.08 -2.24 -0.93 -0.78 114.28 106.74 2w3r n THR 676 Ca 0.21 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.11 2w3r n THR 676 Cb 0.71 0.00 0.46 0.00 -2.10 0.00 0.00 70.33 69.39 2w3r n THR 676 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2w3r n THR 677 N 0.00 0.72 -2.84 4.28 -2.24 -1.21 -3.35 114.28 109.64 2w3r n THR 677 Ca 0.00 0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.37 2w3r n THR 677 Cb 0.00 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.28 2w3r n THR 677 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w3r s GLU 678 N -3.21 3.71 -0.09 -0.78 2.02 -1.03 -4.25 118.70 115.07 2w3r s GLU 678 Ca 0.07 0.38 -0.03 0.00 0.02 0.00 0.00 54.97 55.41 2w3r s GLU 678 Cb 0.11 -3.85 0.05 0.00 0.10 0.00 0.00 34.13 30.53 2w3r s GLU 678 CO 0.47 -1.04 0.13 -2.00 0.02 0.00 0.00 175.26 172.85 2w3r s GLU 679 N 3.52 0.02 0.07 1.61 2.12 -1.26 -4.72 118.70 120.06 2w3r s GLU 679 Ca 0.37 0.45 -0.24 0.00 0.36 0.00 0.00 54.97 55.90 2w3r s GLU 679 Cb -0.11 -0.51 -0.06 0.00 0.26 0.00 0.00 34.13 33.70 2w3r s GLU 679 CO 0.21 -0.36 0.75 -0.51 -0.54 0.00 0.00 175.26 174.81 2w3r s LEU 680 N 2.25 4.48 -0.07 2.70 1.43 -1.26 -4.89 118.68 123.33 2w3r s LEU 680 Ca 0.04 1.47 -0.01 0.00 -1.03 0.00 0.00 54.13 54.59 2w3r s LEU 680 Cb -0.13 -3.21 0.03 0.00 0.03 0.00 0.00 46.19 42.91 2w3r s LEU 680 CO -0.06 0.08 0.01 -0.69 0.23 0.00 0.00 176.35 175.92 2w3r s VAL 681 N -0.35 0.30 0.16 -1.59 1.01 -1.26 -4.92 120.40 113.75 2w3r s VAL 681 Ca 0.37 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.55 2w3r s VAL 681 Cb -0.21 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2w3r s VAL 681 CO 0.23 0.25 0.26 0.26 0.00 0.00 0.00 175.10 176.09 2w3r s TRP 682 N 1.97 3.41 0.25 5.22 0.51 -1.26 0.40 118.94 129.43 2w3r s TRP 682 Ca 0.04 0.08 -0.02 0.00 -2.12 0.00 0.00 56.10 54.08 2w3r s TRP 682 Cb -0.12 -1.63 0.05 0.00 -0.81 0.00 0.00 33.47 30.97 2w3r s TRP 682 CO -0.05 0.51 0.35 -0.40 -0.51 0.00 0.00 176.95 176.85 2w3r n ASP 683 N -0.57 0.29 0.00 2.95 5.75 0.58 -4.85 116.55 120.70 2w3r n ASP 683 Ca -0.07 -1.28 0.09 0.00 -0.01 0.00 0.00 54.79 53.51 2w3r n ASP 683 Cb 0.54 -0.24 0.54 0.00 -1.03 0.00 0.00 41.12 40.94 2w3r n ASP 683 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w3r n HIS 684 N -2.09 0.00 -0.04 2.11 1.44 -1.26 -2.97 115.22 112.41 2w3r n HIS 684 Ca 0.05 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 2w3r n HIS 684 Cb 0.18 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.29 2w3r n HIS 684 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w3r n GLY 686 N -0.33 0.74 3.65 0.00 0.00 -1.16 -4.22 105.19 103.87 2w3r n GLY 686 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2w3r n GLY 686 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3r s ARG 687 N -0.28 4.15 0.08 1.61 0.52 -1.26 -4.33 118.95 119.43 2w3r s ARG 687 Ca 0.00 1.14 -0.31 0.00 -0.52 0.00 0.00 55.73 56.04 2w3r s ARG 687 Cb 0.00 -3.69 -0.09 0.00 0.52 0.00 0.00 34.95 31.70 2w3r s ARG 687 CO 0.00 -0.74 1.66 -1.17 0.02 0.00 0.00 175.30 175.07 2w3r s LEU 688 N 3.34 4.37 -0.04 2.53 2.96 -1.26 -0.31 118.68 130.27 2w3r s LEU 688 Ca 0.43 2.52 0.16 0.00 -0.22 0.00 0.00 54.13 57.02 2w3r s LEU 688 Cb -0.14 -3.56 -0.21 0.00 0.50 0.00 0.00 46.19 42.78 2w3r s LEU 688 CO 0.11 -0.89 0.56 0.23 -1.32 0.00 0.00 176.35 175.03 2w3r n MET 689 N 5.51 0.64 -3.36 1.98 2.81 0.16 -4.60 117.12 120.27 2w3r n MET 689 Ca 0.16 0.15 -0.46 0.00 -1.81 0.00 0.00 57.70 55.74 2w3r n MET 689 Cb 0.40 -1.71 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 2w3r n MET 689 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2w3r s THR 690 N -2.78 5.62 0.00 2.03 -4.23 -1.20 -4.76 115.64 110.32 2w3r s THR 690 Ca -0.06 -2.80 0.00 0.00 -1.18 0.00 0.00 61.69 57.65 2w3r s THR 690 Cb 0.08 -4.45 0.00 0.00 1.34 0.00 0.00 72.50 69.47 2w3r s THR 690 CO 0.83 -1.07 0.44 0.00 -0.54 0.00 0.00 174.62 174.28 2w3r n HIS 691 N 3.54 0.00 -4.46 3.99 1.44 -1.26 -4.80 115.22 113.68 2w3r n HIS 691 Ca 0.17 -0.09 -0.22 0.00 -2.01 0.00 0.00 57.72 55.57 2w3r n HIS 691 Cb 0.44 -0.01 -0.10 0.00 0.12 0.00 0.00 29.99 30.44 2w3r n HIS 691 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w3r s ALA 692 N -0.17 2.46 0.07 1.59 0.00 -1.26 -4.11 121.76 120.33 2w3r s ALA 692 Ca 0.00 -1.97 0.31 0.00 0.00 0.00 0.00 51.96 50.29 2w3r s ALA 692 Cb 0.00 0.24 1.20 0.00 0.00 0.00 0.00 23.12 24.56 2w3r s ALA 692 CO 0.00 -0.10 1.92 -1.35 0.00 0.00 0.00 175.76 176.23 2w3r h PRO 693 N 2.19 0.00 0.00 0.00 0.11 -1.96 -0.35 132.00 132.00 2w3r h PRO 693 Ca -0.41 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 2w3r h PRO 693 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2w3r h PRO 693 CO 0.69 0.05 -0.21 0.66 -0.21 0.00 0.00 178.00 178.98 2w3r h SER 694 N 0.00 0.00 0.00 -2.05 4.64 -2.02 -3.30 113.55 110.82 2w3r h SER 694 Ca -0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 2w3r h SER 694 Cb 0.60 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.65 2w3r h SER 694 CO 0.01 0.21 -1.95 0.35 -0.87 0.00 0.00 176.83 174.58 2w3r n THR 695 N -4.28 0.76 -3.64 2.95 -2.24 -1.01 -4.93 114.28 101.88 2w3r n THR 695 Ca -0.02 -0.56 -0.36 0.00 -2.27 0.00 0.00 64.05 60.83 2w3r n THR 695 Cb 0.27 -0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 68.01 2w3r n THR 695 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w3r s TYR 696 N -2.56 3.39 -0.65 4.78 5.04 -0.17 -4.92 117.35 122.27 2w3r s TYR 696 Ca -0.07 0.39 0.03 0.00 -2.44 0.00 0.00 57.07 54.98 2w3r s TYR 696 Cb 0.06 -2.26 0.16 0.00 0.35 0.00 0.00 41.96 40.27 2w3r s TYR 696 CO 0.62 0.20 0.44 0.15 -1.34 0.00 0.00 175.55 175.62 2w3r s LYS 697 N 0.64 2.40 0.61 4.97 3.01 -1.26 -4.57 119.74 125.54 2w3r s LYS 697 Ca 0.11 -3.01 -0.14 0.00 -1.01 0.00 0.00 55.97 51.92 2w3r s LYS 697 Cb -0.12 -3.48 -0.03 0.00 -1.01 0.00 0.00 37.83 33.18 2w3r s LYS 697 CO 0.02 -1.21 1.04 0.96 0.51 0.00 0.00 175.35 176.66 2w3r s ILE 698 N -0.90 4.18 -0.09 2.17 -4.36 -1.26 -3.52 121.20 117.42 2w3r s ILE 698 Ca 0.22 0.89 -0.35 0.00 -0.26 0.00 0.00 60.65 61.14 2w3r s ILE 698 Cb -0.14 -3.54 -0.13 0.00 1.25 0.00 0.00 42.46 39.90 2w3r s ILE 698 CO -0.09 -0.75 1.80 -2.65 0.24 0.00 0.00 174.94 173.48 2w3r n PRO 699 N -2.36 1.93 -2.21 0.37 -0.02 -1.26 -5.00 135.00 126.46 2w3r n PRO 699 Ca 0.07 0.71 -0.26 0.00 -2.02 0.00 0.00 63.50 62.00 2w3r n PRO 699 Cb 0.53 -2.50 0.08 0.00 -0.02 0.00 0.00 33.50 31.59 2w3r n PRO 699 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3r s ALA 700 N 3.43 3.14 0.14 3.55 0.00 -1.26 -4.94 121.76 125.82 2w3r s ALA 700 Ca 0.92 -0.99 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 2w3r s ALA 700 Cb -0.78 -2.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 2w3r s ALA 700 CO 0.52 -1.37 1.58 0.35 0.00 0.00 0.00 175.76 176.84 2w3r h PHE 701 N -0.65 -1.18 0.00 0.00 3.57 -2.00 0.73 116.94 117.40 2w3r h PHE 701 Ca -0.44 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.12 2w3r h PHE 701 Cb 1.31 0.56 0.00 0.00 2.79 0.00 0.00 35.95 40.60 2w3r h PHE 701 CO 0.22 -0.45 0.00 0.66 -2.23 0.00 0.00 178.31 176.51 2w3r h SER 702 N -0.40 0.00 0.74 0.41 4.64 -2.03 -2.19 113.55 114.72 2w3r h SER 702 Ca 0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 2w3r h SER 702 Cb 0.60 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2w3r h SER 702 CO -0.47 0.00 -0.03 0.44 -0.87 0.00 0.00 176.83 175.90 2w3r h ASP 703 N 0.00 0.00 -3.62 4.97 5.19 -1.21 -3.45 116.42 118.29 2w3r h ASP 703 Ca 0.00 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 55.84 2w3r h ASP 703 Cb 0.13 0.00 0.16 0.00 0.18 0.00 0.00 39.33 39.80 2w3r h ASP 703 CO 0.00 0.03 0.22 -2.11 -3.12 0.00 0.00 179.24 174.25 2w3r n ARG 704 N -3.16 1.05 -1.65 3.56 1.85 -0.83 -4.75 116.66 112.75 2w3r n ARG 704 Ca -0.00 0.40 -0.47 0.00 -1.00 0.00 0.00 57.85 56.77 2w3r n ARG 704 Cb 0.26 -2.23 -0.04 0.00 -1.05 0.00 0.00 32.46 29.39 2w3r n ARG 704 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2w3r n PRO 705 N -0.97 1.87 0.24 2.89 -0.02 -1.26 -4.86 135.00 132.88 2w3r n PRO 705 Ca 0.13 0.67 0.07 0.00 -2.02 0.00 0.00 63.50 62.36 2w3r n PRO 705 Cb 0.46 -2.39 0.58 0.00 -0.02 0.00 0.00 33.50 32.14 2w3r n PRO 705 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3r h ARG 706 N 5.29 0.00 -4.73 -0.52 2.47 -1.56 -3.36 114.38 111.97 2w3r h ARG 706 Ca -0.45 0.00 -0.57 0.00 -1.26 0.00 0.00 59.98 57.69 2w3r h ARG 706 Cb 1.28 0.00 -0.34 0.00 -1.65 0.00 0.00 29.97 29.26 2w3r h ARG 706 CO 0.84 0.13 -0.83 0.42 0.56 0.00 0.00 179.97 181.09 2w3r s ILE 707 N -4.64 1.44 -0.27 2.04 1.01 -0.75 -4.98 121.20 115.05 2w3r s ILE 707 Ca -0.04 -0.62 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 2w3r s ILE 707 Cb 0.16 -1.31 0.08 0.00 0.01 0.00 0.00 42.46 41.39 2w3r s ILE 707 CO 0.67 0.43 0.03 0.12 0.00 0.00 0.00 174.94 176.19 2w3r s PHE 708 N 0.88 2.04 -0.50 3.97 5.99 -1.26 -0.11 117.98 128.99 2w3r s PHE 708 Ca -0.09 -1.72 -0.01 0.00 0.00 0.00 0.00 56.93 55.11 2w3r s PHE 708 Cb -0.15 -1.68 0.13 0.00 0.00 0.00 0.00 43.02 41.32 2w3r s PHE 708 CO 0.00 -0.80 0.28 -0.80 -0.00 0.00 0.00 175.22 173.91 2w3r s ASN 709 N 1.51 5.03 -0.26 6.13 0.01 -0.13 -5.00 114.94 122.23 2w3r s ASN 709 Ca 0.03 -2.52 -0.08 0.00 -0.71 0.00 0.00 52.86 49.57 2w3r s ASN 709 Cb -0.18 -1.78 -0.03 0.00 0.41 0.00 0.00 41.25 39.67 2w3r s ASN 709 CO -0.14 -0.40 0.11 -0.69 -1.51 0.00 0.00 177.10 174.46 2w3r s VAL 710 N 0.42 4.56 -0.02 1.60 1.01 -1.26 0.40 120.40 127.11 2w3r s VAL 710 Ca 0.13 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.02 2w3r s VAL 710 Cb -0.22 -3.17 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 2w3r s VAL 710 CO -0.04 0.29 -0.11 0.00 0.00 0.00 0.00 175.10 175.24 2w3r s ALA 711 N 1.65 0.97 -0.02 5.51 0.00 0.23 -4.99 121.76 125.11 2w3r s ALA 711 Ca 0.06 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.32 2w3r s ALA 711 Cb -0.16 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2w3r s ALA 711 CO 0.06 0.20 0.80 -0.51 0.00 0.00 0.00 175.76 176.30 2w3r s LEU 712 N -0.03 4.36 -0.42 0.00 1.43 -1.26 -1.63 118.68 121.12 2w3r s LEU 712 Ca 0.00 1.39 -0.28 0.00 -1.03 0.00 0.00 54.13 54.21 2w3r s LEU 712 Cb -0.07 -3.26 -0.00 0.00 0.03 0.00 0.00 46.19 42.88 2w3r s LEU 712 CO 0.00 -0.14 1.62 0.86 0.23 0.00 0.00 176.35 178.93 2w3r s TRP 713 N 0.71 2.06 -0.56 0.29 -0.11 0.39 -4.82 118.94 116.90 2w3r s TRP 713 Ca 0.42 0.64 -0.17 0.00 1.22 0.00 0.00 56.10 58.21 2w3r s TRP 713 Cb -0.19 -4.22 0.11 0.00 -1.50 0.00 0.00 33.47 27.67 2w3r s TRP 713 CO 0.22 -2.41 0.60 0.34 -4.62 0.00 0.00 176.95 171.08 2w3r s ASP 714 N 5.36 6.19 -0.29 5.86 -1.08 -1.26 -3.77 116.67 127.67 2w3r s ASP 714 Ca 0.68 -1.60 -0.13 0.00 -0.52 0.00 0.00 52.55 50.99 2w3r s ASP 714 Cb -0.17 -2.25 0.12 0.00 -1.46 0.00 0.00 42.92 39.16 2w3r s ASP 714 CO 0.31 -0.97 0.69 -1.58 0.52 0.00 0.00 175.17 174.13 2w3r s GLN 715 N 2.13 0.60 0.77 4.34 0.74 -1.23 -5.03 119.66 121.98 2w3r s GLN 715 Ca 0.07 1.32 -0.15 0.00 0.05 0.00 0.00 55.36 56.65 2w3r s GLN 715 Cb -0.27 0.57 0.03 0.00 1.10 0.00 0.00 33.01 34.44 2w3r s GLN 715 CO 0.05 -0.17 0.92 -2.30 -0.55 0.00 0.00 175.29 173.24 2w3r n PRO 716 N 4.98 0.31 -2.27 1.67 -0.02 -1.26 -3.71 135.00 134.70 2w3r n PRO 716 Ca -0.15 0.16 -0.38 0.00 -2.02 0.00 0.00 63.50 61.11 2w3r n PRO 716 Cb 0.53 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 2w3r n PRO 716 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2w3r s ASN 717 N -1.79 6.50 0.17 2.55 3.84 -0.11 -4.78 114.94 121.32 2w3r s ASN 717 Ca 0.71 2.38 -0.01 0.00 0.21 0.00 0.00 52.86 56.14 2w3r s ASN 717 Cb -0.32 -2.62 0.04 0.00 -0.55 0.00 0.00 41.25 37.81 2w3r s ASN 717 CO 0.53 -0.69 1.42 0.03 -2.79 0.00 0.00 177.10 175.60 2w3r h ARG 718 N 2.65 0.39 -6.97 0.43 3.08 -1.93 -3.45 114.38 108.58 2w3r h ARG 718 Ca -0.49 -0.33 -0.48 0.00 0.07 0.00 0.00 59.98 58.75 2w3r h ARG 718 Cb 1.24 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.36 2w3r h ARG 718 CO 0.63 0.98 0.22 -1.21 -1.07 0.00 0.00 179.97 179.52 2w3r s GLU 719 N -3.56 3.91 -1.31 0.04 0.41 -1.26 -4.97 118.70 111.95 2w3r s GLU 719 Ca -0.05 0.72 -0.18 0.00 -0.41 0.00 0.00 54.97 55.05 2w3r s GLU 719 Cb 0.10 -2.29 0.04 0.00 -1.78 0.00 0.00 34.13 30.21 2w3r s GLU 719 CO 0.84 -0.09 1.86 0.39 -0.49 0.00 0.00 175.26 177.77 2w3r n GLU 720 N -1.21 2.94 -3.72 1.61 1.02 -1.26 -4.81 120.64 115.21 2w3r n GLU 720 Ca 0.04 -3.04 -0.20 0.00 -0.02 0.00 0.00 57.16 53.94 2w3r n GLU 720 Cb 0.54 -3.47 -0.02 0.00 -0.02 0.00 0.00 31.44 28.47 2w3r n GLU 720 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2w3r s THR 721 N 4.68 4.15 -0.76 2.62 -4.23 -1.26 -5.00 115.64 115.83 2w3r s THR 721 Ca 0.54 -1.15 -0.32 0.00 -1.18 0.00 0.00 61.69 59.58 2w3r s THR 721 Cb 0.06 -3.42 -0.17 0.00 1.34 0.00 0.00 72.50 70.31 2w3r s THR 721 CO 0.05 -0.21 2.52 0.00 -0.54 0.00 0.00 174.62 176.44 2w3r n ILE 722 N -1.47 0.00 -3.88 2.99 0.13 -1.26 -0.62 119.36 115.25 2w3r n ILE 722 Ca -0.03 -0.21 -0.27 0.00 -1.10 0.00 0.00 62.75 61.15 2w3r n ILE 722 Cb 0.58 -1.14 0.01 0.00 -0.84 0.00 0.00 39.64 38.26 2w3r n ILE 722 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 2w3r n PHE 723 N 11.32 -1.97 -2.20 9.51 3.01 -1.26 -2.65 117.46 133.22 2w3r n PHE 723 Ca 0.56 0.84 -0.06 0.00 1.01 0.00 0.00 57.45 59.79 2w3r n PHE 723 Cb 0.16 -3.98 -0.01 0.00 -0.01 0.00 0.00 39.48 35.64 2w3r n PHE 723 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2w3r n ARG 724 N -4.45 -2.29 -2.16 -1.08 5.12 0.20 -4.56 116.66 107.45 2w3r n ARG 724 Ca -0.15 0.32 -0.27 0.00 -1.93 0.00 0.00 57.85 55.82 2w3r n ARG 724 Cb 0.61 -4.78 0.06 0.00 -1.16 0.00 0.00 32.46 27.19 2w3r n ARG 724 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2w3r s SER 725 N -1.91 5.02 -0.02 0.55 1.04 -1.09 -0.52 113.70 116.76 2w3r s SER 725 Ca 0.00 0.64 0.06 0.00 0.48 0.00 0.00 55.95 57.13 2w3r s SER 725 Cb 0.00 -1.36 -0.01 0.00 0.10 0.00 0.00 66.02 64.74 2w3r s SER 725 CO 0.00 -1.49 -0.19 -0.54 0.98 0.00 0.00 173.24 172.00 2w3r s LYS 726 N -5.25 1.57 -0.22 4.02 1.02 0.41 -4.73 119.74 116.56 2w3r s LYS 726 Ca 0.59 -0.67 -0.37 0.00 0.02 0.00 0.00 55.97 55.54 2w3r s LYS 726 Cb -0.11 -1.50 -0.13 0.00 -0.52 0.00 0.00 37.83 35.57 2w3r s LYS 726 CO 0.46 0.39 1.89 0.00 -0.92 0.00 0.00 175.35 177.17 2w3r n ALA 727 N 2.68 0.48 0.14 5.17 0.00 -1.26 -4.60 120.51 123.11 2w3r n ALA 727 Ca -0.15 0.26 0.06 0.00 0.00 0.00 0.00 53.44 53.60 2w3r n ALA 727 Cb 0.53 -2.40 0.10 0.00 0.00 0.00 0.00 19.45 17.69 2w3r n ALA 727 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2w3r n VAL 728 N 5.34 0.51 0.17 0.00 3.14 -1.26 -4.73 118.33 121.50 2w3r n VAL 728 Ca 0.28 -0.76 -0.14 0.00 -2.96 0.00 0.00 64.34 60.76 2w3r n VAL 728 Cb 0.21 0.86 -0.08 0.00 -1.06 0.00 0.00 33.84 33.77 2w3r n VAL 728 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2w3r h GLY 729 N 2.11 -0.41 0.00 7.55 0.00 -1.89 -3.40 103.07 107.02 2w3r h GLY 729 Ca 0.00 0.15 -0.33 0.00 0.00 0.00 0.00 47.33 47.15 2w3r h GLY 729 CO 0.00 -0.15 -2.19 1.18 0.00 0.00 0.00 176.54 175.38 2w3r n GLU 730 N -5.22 0.49 -0.34 4.80 1.02 -1.26 -4.73 120.64 115.40 2w3r n GLU 730 Ca -0.10 0.15 0.16 0.00 -0.02 0.00 0.00 57.16 57.36 2w3r n GLU 730 Cb 0.21 -1.35 0.32 0.00 -0.02 0.00 0.00 31.44 30.59 2w3r n GLU 730 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2w3r h PRO 731 N -0.33 0.02 0.00 3.49 0.11 -1.85 0.19 132.00 133.63 2w3r h PRO 731 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2w3r h PRO 731 Cb 1.61 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.72 2w3r h PRO 731 CO -0.18 0.01 0.00 -1.35 -0.21 0.00 0.00 178.00 176.27 2w3r h PRO 732 N 0.02 0.00 -0.55 1.05 0.11 -1.85 -2.16 132.00 128.61 2w3r h PRO 732 Ca 0.62 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.72 2w3r h PRO 732 Cb 1.32 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 2w3r h PRO 732 CO -0.90 0.00 0.32 0.35 -0.21 0.00 0.00 178.00 177.56 2w3r h PHE 733 N 0.00 0.73 0.00 0.65 3.57 -0.79 -2.35 116.94 118.75 2w3r h PHE 733 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2w3r h PHE 733 Cb 0.24 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.75 2w3r h PHE 733 CO 0.00 0.50 0.00 -0.07 -2.23 0.00 0.00 178.31 176.51 2w3r h LEU 734 N 0.76 0.00 -1.14 0.59 4.07 -1.53 -2.70 115.31 115.37 2w3r h LEU 734 Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2w3r h LEU 734 Cb -0.01 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.73 2w3r h LEU 734 CO -0.04 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.50 2w3r n LEU 735 N -3.02 0.55 0.11 1.67 4.77 -0.88 -2.01 117.00 118.18 2w3r n LEU 735 Ca 0.00 0.72 0.11 0.00 -0.03 0.00 0.00 56.01 56.81 2w3r n LEU 735 Cb 0.28 -0.74 0.46 0.00 -2.33 0.00 0.00 43.42 41.08 2w3r n LEU 735 CO 0.26 -0.81 0.83 0.61 -1.33 0.00 0.00 177.39 176.94 2w3r n GLY 736 N -0.95 -1.22 0.34 -0.72 0.00 -1.02 -2.75 105.19 98.89 2w3r n GLY 736 Ca -0.00 0.06 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 2w3r n GLY 736 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2w3r h ILE 737 N 0.00 1.24 -0.88 -0.61 2.04 -1.65 -2.68 117.51 114.96 2w3r h ILE 737 Ca 0.00 -0.64 0.22 0.00 1.00 0.00 0.00 64.86 65.44 2w3r h ILE 737 Cb 0.34 0.22 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 2w3r h ILE 737 CO 0.00 0.28 0.60 0.77 0.00 0.00 0.00 178.15 179.79 2w3r h SER 738 N 1.09 0.28 -0.28 1.72 4.64 -1.75 -0.11 113.55 119.14 2w3r h SER 738 Ca 0.27 0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 61.51 2w3r h SER 738 Cb 0.08 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2w3r h SER 738 CO -0.04 0.11 -0.25 0.00 -0.87 0.00 0.00 176.83 175.79 2w3r h ALA 739 N 1.60 0.41 -0.07 5.18 0.00 -1.68 -0.91 119.26 123.79 2w3r h ALA 739 Ca 0.45 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2w3r h ALA 739 Cb 1.30 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2w3r h ALA 739 CO -0.13 0.39 -0.38 0.35 0.00 0.00 0.00 179.25 179.48 2w3r h PHE 740 N 0.41 0.18 -0.04 0.00 3.57 -1.13 -0.65 116.94 119.26 2w3r h PHE 740 Ca 0.05 -0.04 -0.21 0.00 3.53 0.00 0.00 57.97 61.30 2w3r h PHE 740 Cb 0.80 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 2w3r h PHE 740 CO 0.07 0.52 -0.83 -0.07 -2.23 0.00 0.00 178.31 175.76 2w3r h LEU 741 N 0.13 0.53 -0.52 0.59 4.07 -1.03 -2.42 115.31 116.65 2w3r h LEU 741 Ca 0.01 -0.38 -0.16 0.00 0.08 0.00 0.00 57.88 57.43 2w3r h LEU 741 Cb 0.74 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 2w3r h LEU 741 CO 0.06 1.15 -0.70 0.00 -1.08 0.00 0.00 178.44 177.87 2w3r h ALA 742 N 0.82 0.73 -0.69 1.53 0.00 -0.93 0.45 119.26 121.18 2w3r h ALA 742 Ca -0.05 -0.60 -0.06 0.00 0.00 0.00 0.00 54.91 54.19 2w3r h ALA 742 Cb 1.44 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2w3r h ALA 742 CO 0.14 0.79 0.18 -0.07 0.00 0.00 0.00 179.25 180.30 2w3r h LEU 743 N 0.16 1.02 -0.51 0.00 4.07 -1.12 -0.91 115.31 118.02 2w3r h LEU 743 Ca -0.02 -0.20 -0.08 0.00 0.08 0.00 0.00 57.88 57.66 2w3r h LEU 743 Cb 1.24 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.70 2w3r h LEU 743 CO 0.11 0.97 0.01 -0.74 -1.08 0.00 0.00 178.44 177.71 2w3r h HIS 744 N 1.03 0.96 -0.99 1.13 -0.00 -1.20 -2.60 115.15 113.48 2w3r h HIS 744 Ca 0.22 -0.16 0.06 0.00 -0.00 0.00 0.00 60.37 60.49 2w3r h HIS 744 Cb 0.34 -0.25 -0.07 0.00 -0.00 0.00 0.00 27.41 27.43 2w3r h HIS 744 CO 0.03 0.90 0.64 0.22 -0.00 0.00 0.00 177.93 179.71 2w3r h ASP 745 N 0.75 1.04 0.06 3.26 3.58 -0.58 0.63 116.42 125.16 2w3r h ASP 745 Ca 0.14 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.55 2w3r h ASP 745 Cb 0.50 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2w3r h ASP 745 CO 0.02 0.67 -0.15 0.00 -2.88 0.00 0.00 179.24 176.90 2w3r h ALA 746 N 1.44 1.52 0.00 -0.78 0.00 -1.02 -2.40 119.26 118.02 2w3r h ALA 746 Ca 0.42 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 2w3r h ALA 746 Cb 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2w3r h ALA 746 CO -0.16 0.34 -0.88 0.00 0.00 0.00 0.00 179.25 178.55 2w3r h ALA 748 N 0.95 1.66 -0.64 0.00 0.00 -0.42 -2.23 119.26 118.59 2w3r h ALA 748 Ca -0.05 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.48 2w3r h ALA 748 Cb 1.51 -0.01 -0.20 0.00 0.00 0.00 0.00 17.79 19.10 2w3r h ALA 748 CO 0.14 0.06 0.43 0.00 0.00 0.00 0.00 179.25 179.88 2w3r n ALA 749 N -2.41 4.57 -0.07 0.00 0.00 -1.14 -3.95 120.51 117.51 2w3r n ALA 749 Ca -0.03 -1.88 -0.09 0.00 0.00 0.00 0.00 53.44 51.44 2w3r n ALA 749 Cb 0.13 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.21 2w3r n ALA 749 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n GLY 751 N 2.82 1.32 0.18 0.00 0.00 -1.24 -4.57 105.19 103.71 2w3r n GLY 751 Ca -0.24 -1.13 0.12 0.00 0.00 0.00 0.00 46.02 44.77 2w3r n GLY 751 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2w3r h PRO 752 N 0.00 0.00 -7.08 1.61 0.13 -1.81 -3.45 132.00 121.40 2w3r h PRO 752 Ca -0.18 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.50 2w3r h PRO 752 Cb 0.70 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 2w3r h PRO 752 CO 0.23 0.00 0.36 -1.01 -0.23 0.00 0.00 178.00 177.35 2w3r s HIS 753 N -3.20 3.23 0.07 1.56 3.76 -1.09 -5.01 115.29 114.62 2w3r s HIS 753 Ca 0.07 1.59 -0.31 0.00 -0.15 0.00 0.00 55.06 56.26 2w3r s HIS 753 Cb 0.07 -2.90 -0.09 0.00 1.11 0.00 0.00 32.58 30.77 2w3r s HIS 753 CO 0.67 -0.34 1.70 -0.46 -0.85 0.00 0.00 174.74 175.45 2w3r s TRP 754 N -2.17 2.31 0.23 1.40 -0.11 -1.26 -4.22 118.94 115.12 2w3r s TRP 754 Ca 0.63 0.22 0.09 0.00 1.22 0.00 0.00 56.10 58.27 2w3r s TRP 754 Cb -0.11 -4.01 0.22 0.00 -1.50 0.00 0.00 33.47 28.06 2w3r s TRP 754 CO 0.17 -4.12 1.53 -1.35 -4.62 0.00 0.00 176.95 168.56 2w3r h PRO 755 N 8.50 0.01 -6.33 5.86 0.11 -1.90 -3.39 132.00 134.85 2w3r h PRO 755 Ca -0.43 -0.01 -0.46 0.00 0.11 0.00 0.00 66.00 65.21 2w3r h PRO 755 Cb 1.20 0.00 0.07 0.00 0.11 0.00 0.00 31.00 32.38 2w3r h PRO 755 CO 0.93 0.72 -0.95 -3.47 -0.21 0.00 0.00 178.00 175.02 2w3r n ASP 756 N -3.70 -4.80 -4.73 -2.05 2.03 -1.26 -4.40 116.55 97.64 2w3r n ASP 756 Ca -0.01 -1.05 -0.42 0.00 0.52 0.00 0.00 54.79 53.83 2w3r n ASP 756 Cb 0.69 -3.15 -0.03 0.00 -0.72 0.00 0.00 41.12 37.92 2w3r n ASP 756 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2w3r s LEU 757 N -6.63 4.39 -0.03 -2.67 2.96 -1.26 -4.82 118.68 110.60 2w3r s LEU 757 Ca 0.44 2.38 -0.04 0.00 -0.22 0.00 0.00 54.13 56.69 2w3r s LEU 757 Cb -0.17 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 2w3r s LEU 757 CO 0.88 -0.61 0.19 -1.10 -1.32 0.00 0.00 176.35 174.38 2w3r s GLN 758 N 0.54 3.46 -0.08 1.98 -1.52 -1.26 -4.90 119.66 117.88 2w3r s GLN 758 Ca 0.61 -0.23 -0.16 0.00 -1.95 0.00 0.00 55.36 53.63 2w3r s GLN 758 Cb -0.37 -3.12 -0.05 0.00 -0.22 0.00 0.00 33.01 29.25 2w3r s GLN 758 CO 0.34 0.70 0.41 0.00 -0.25 0.00 0.00 175.29 176.49 2w3r s ALA 759 N -1.25 3.58 0.36 6.09 0.00 -0.68 -3.00 121.76 126.86 2w3r s ALA 759 Ca 0.24 -0.25 -0.25 0.00 0.00 0.00 0.00 51.96 51.70 2w3r s ALA 759 Cb -0.13 -2.50 -0.10 0.00 0.00 0.00 0.00 23.12 20.40 2w3r s ALA 759 CO 0.15 0.21 0.98 -1.25 0.00 0.00 0.00 175.76 175.84 2w3r s PRO 760 N -0.07 4.43 -1.52 0.00 0.04 -1.26 -1.86 135.00 134.77 2w3r s PRO 760 Ca 0.23 1.36 -0.12 0.00 0.04 0.00 0.00 61.00 62.51 2w3r s PRO 760 Cb -0.15 -2.66 -0.00 0.00 0.04 0.00 0.00 34.50 31.73 2w3r s PRO 760 CO 0.10 0.13 2.50 0.00 0.04 0.00 0.00 177.00 179.78 2w3r n ALA 761 N 0.25 6.35 -1.00 8.56 0.00 0.04 -4.77 120.51 129.93 2w3r n ALA 761 Ca 0.03 -3.76 -0.30 0.00 0.00 0.00 0.00 53.44 49.41 2w3r n ALA 761 Cb 0.50 -3.45 0.15 0.00 0.00 0.00 0.00 19.45 16.66 2w3r n ALA 761 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3r s THR 762 N 2.63 2.54 0.29 0.00 -4.23 -1.21 -4.61 115.64 111.05 2w3r s THR 762 Ca 0.56 0.18 0.02 0.00 -1.18 0.00 0.00 61.69 61.26 2w3r s THR 762 Cb 0.15 -2.50 0.32 0.00 1.34 0.00 0.00 72.50 71.82 2w3r s THR 762 CO -0.08 -0.23 1.64 -0.65 -0.54 0.00 0.00 174.62 174.76 2w3r h PRO 763 N -1.72 0.18 -0.73 3.99 0.11 -1.90 0.25 132.00 132.18 2w3r h PRO 763 Ca -0.49 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2w3r h PRO 763 Cb 1.28 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 2w3r h PRO 763 CO 0.51 0.12 0.44 1.49 -0.21 0.00 0.00 178.00 180.34 2w3r h GLU 764 N 0.18 1.00 -0.21 1.05 4.81 -1.85 -0.68 114.58 118.88 2w3r h GLU 764 Ca 0.56 -0.09 -0.14 0.00 -0.13 0.00 0.00 59.36 59.55 2w3r h GLU 764 Cb 1.13 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 2w3r h GLU 764 CO -0.68 0.71 -0.47 0.00 -0.73 0.00 0.00 179.01 177.84 2w3r h ALA 765 N 1.23 0.79 -0.24 2.92 0.00 -1.25 -2.14 119.26 120.58 2w3r h ALA 765 Ca 0.26 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2w3r h ALA 765 Cb -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2w3r h ALA 765 CO -0.05 0.66 -0.24 0.28 0.00 0.00 0.00 179.25 179.91 2w3r h VAL 766 N 0.43 1.32 -0.92 0.00 2.07 -0.43 -2.44 116.25 116.27 2w3r h VAL 766 Ca 0.02 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.13 2w3r h VAL 766 Cb 0.99 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 32.40 2w3r h VAL 766 CO 0.09 0.44 0.56 0.25 0.02 0.00 0.00 177.57 178.93 2w3r h LEU 767 N 0.28 1.10 0.15 2.57 5.85 -1.08 -0.66 115.31 123.52 2w3r h LEU 767 Ca 0.04 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2w3r h LEU 767 Cb 0.80 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2w3r h LEU 767 CO 0.06 0.84 -0.11 0.00 -0.34 0.00 0.00 178.44 178.89 2w3r h ALA 768 N 1.35 -0.24 -0.15 1.25 0.00 -1.31 -1.28 119.26 118.89 2w3r h ALA 768 Ca 0.33 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 2w3r h ALA 768 Cb -0.07 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2w3r h ALA 768 CO -0.06 -0.64 -0.16 0.00 0.00 0.00 0.00 179.25 178.38 2w3r h ALA 769 N 0.59 1.45 0.14 0.00 0.00 -1.16 -1.57 119.26 118.71 2w3r h ALA 769 Ca -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2w3r h ALA 769 Cb 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2w3r h ALA 769 CO -0.00 0.38 -0.07 0.28 0.00 0.00 0.00 179.25 179.85 2w3r h VAL 770 N 0.23 0.95 0.00 0.00 2.07 -0.94 -2.43 116.25 116.12 2w3r h VAL 770 Ca 0.04 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 2w3r h VAL 770 Cb 0.43 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2w3r h VAL 770 CO 0.03 0.08 -0.15 0.03 0.02 0.00 0.00 177.57 177.58 2w3r h ARG 771 N -0.34 0.00 0.18 1.57 3.08 -0.82 -0.80 114.38 117.24 2w3r h ARG 771 Ca -0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2w3r h ARG 771 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2w3r h ARG 771 CO 0.03 0.15 -0.09 0.00 -1.07 0.00 0.00 179.97 178.99 2w3r h ARG 772 N 0.00 -0.23 -0.89 0.04 3.08 -1.22 0.42 114.38 115.58 2w3r h ARG 772 Ca -0.00 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.16 2w3r h ARG 772 Cb 0.27 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.31 2w3r h ARG 772 CO 0.02 0.11 0.57 0.00 -1.07 0.00 0.00 179.97 179.60 2w3r h ALA 773 N 0.11 1.63 0.00 0.04 0.00 -1.09 0.19 119.26 120.15 2w3r h ALA 773 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2w3r h ALA 773 Cb 0.45 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 773 CO 0.04 0.19 -0.03 0.93 0.00 0.00 0.00 179.25 180.38 2w3r h GLU 774 N 0.89 0.00 -3.77 0.00 5.08 -1.06 -2.84 114.58 112.87 2w3r h GLU 774 Ca 0.41 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.60 2w3r h GLU 774 Cb 0.40 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.73 2w3r h GLU 774 CO -0.17 0.03 -0.38 0.41 -1.00 0.00 0.00 179.01 177.90 2w3r n GLY 775 N 0.53 0.07 3.10 -3.84 0.00 0.97 -4.96 105.19 101.06 2w3r n GLY 775 Ca 0.02 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 2w3r n GLY 775 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3r s ARG 776 N -4.88 2.62 0.00 1.61 0.52 0.11 -5.01 118.95 113.91 2w3r s ARG 776 Ca 0.06 -2.56 0.00 0.00 -0.52 0.00 0.00 55.73 52.71 2w3r s ARG 776 Cb -0.03 -3.76 0.00 0.00 0.52 0.00 0.00 34.95 31.68 2w3r s ARG 776 CO 0.37 -1.18 0.00 0.00 0.02 0.00 0.00 175.30 174.51