#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 1.89 0.00 2.46 0.31 -1.22 -2.82 118.33 118.95 2w3r n VAL 3 Ca 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 2w3r n VAL 3 Cb 0.00 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 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 0.94 3.12 3.75 2.92 0.00 0.75 -5.01 105.19 111.66 2w3r n GLY 4 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.82 4.78 -1.45 1.61 1.02 -1.13 -4.41 119.74 119.34 2w3r s LYS 5 Ca 0.00 1.55 -0.12 0.00 0.02 0.00 0.00 55.97 57.42 2w3r s LYS 5 Cb 0.00 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 34.07 2w3r s LYS 5 CO 0.00 0.42 2.51 -0.35 -0.92 0.00 0.00 175.35 177.01 2w3r n PRO 6 N 1.32 3.07 -3.05 -1.68 -0.04 -1.26 -4.41 135.00 128.96 2w3r n PRO 6 Ca -0.01 -2.32 -0.34 0.00 -0.04 0.00 0.00 63.50 60.79 2w3r n PRO 6 Cb 0.47 -3.02 -0.06 0.00 -0.04 0.00 0.00 33.50 30.85 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 1.18 4.13 0.93 1.53 1.43 -1.26 -4.79 118.68 121.83 2w3r s LEU 7 Ca 0.57 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.98 2w3r s LEU 7 Cb 0.15 -4.04 0.15 0.00 0.03 0.00 0.00 46.19 42.48 2w3r s LEU 7 CO -0.06 -0.17 1.09 -2.16 0.23 0.00 0.00 176.35 175.28 2w3r s PRO 8 N -2.71 0.93 0.56 1.29 0.04 -1.26 -4.71 135.00 129.14 2w3r s PRO 8 Ca 0.53 0.85 -0.19 0.00 0.04 0.00 0.00 61.00 62.22 2w3r s PRO 8 Cb -0.12 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 2w3r s PRO 8 CO 0.18 -2.47 0.78 1.58 0.04 0.00 0.00 177.00 177.11 2w3r n HIS 9 N -4.05 0.23 0.25 0.56 -0.00 -1.26 -4.90 115.22 106.05 2w3r n HIS 9 Ca 0.07 0.46 0.09 0.00 0.46 0.00 0.00 57.72 58.80 2w3r n HIS 9 Cb 0.55 -2.07 0.64 0.00 -0.12 0.00 0.00 29.99 28.99 2w3r n HIS 9 CO 0.00 0.00 0.00 0.38 0.46 0.00 0.00 176.34 177.18 2w3r h ASP 10 N 0.55 0.00 -0.09 0.26 2.03 -1.92 -2.83 116.42 114.41 2w3r h ASP 10 Ca -0.46 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 55.82 2w3r h ASP 10 Cb 1.38 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.87 2w3r h ASP 10 CO 0.50 0.12 -0.08 -1.20 -1.03 0.00 0.00 179.24 177.54 2w3r n SER 11 N -4.09 2.62 -0.18 4.15 7.64 -1.26 -4.80 113.62 117.70 2w3r n SER 11 Ca -0.02 -3.27 0.05 0.00 1.01 0.00 0.00 58.87 56.64 2w3r n SER 11 Cb 0.20 -0.49 0.33 0.00 -1.01 0.00 0.00 64.21 63.24 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 0.66 1.65 -0.05 -0.43 0.00 -1.87 0.45 119.26 119.68 2w3r h ALA 12 Ca 0.02 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2w3r h ALA 12 Cb 1.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2w3r h ALA 12 CO 0.09 0.25 -0.75 -0.09 0.00 0.00 0.00 179.25 178.75 2w3r h ARG 13 N 0.80 0.32 -0.27 0.00 2.43 -1.87 -2.62 114.38 113.16 2w3r h ARG 13 Ca 0.30 -0.27 -0.15 0.00 -0.81 0.00 0.00 59.98 59.05 2w3r h ARG 13 Cb 0.17 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2w3r h ARG 13 CO -0.09 0.93 -0.44 0.00 -1.51 0.00 0.00 179.97 178.85 2w3r h ALA 14 N 0.99 0.71 -0.63 2.80 0.00 -1.55 -2.80 119.26 118.79 2w3r h ALA 14 Ca -0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 2w3r h ALA 14 Cb 1.32 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2w3r h ALA 14 CO 0.12 0.67 0.22 0.45 0.00 0.00 0.00 179.25 180.71 2w3r h HIS 15 N 0.56 0.99 0.00 0.00 3.86 -0.97 0.23 115.15 119.81 2w3r h HIS 15 Ca 0.04 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2w3r h HIS 15 Cb 0.99 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.17 2w3r h HIS 15 CO 0.05 0.80 0.00 -0.24 0.86 0.00 0.00 177.93 179.40 2w3r h VAL 16 N 0.89 0.00 -0.07 2.45 3.04 -1.32 -3.06 116.25 118.18 2w3r h VAL 16 Ca 0.20 -0.59 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 2w3r h VAL 16 Cb 0.26 1.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.09 2w3r h VAL 16 CO -0.01 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 176.90 2w3r n THR 17 N -2.58 1.82 -3.81 3.17 -2.24 -1.07 -5.00 114.28 104.57 2w3r n THR 17 Ca 0.04 -1.95 -0.27 0.00 -2.27 0.00 0.00 64.05 59.59 2w3r n THR 17 Cb 0.42 -0.11 0.04 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.01 -0.47 0.01 3.38 0.00 -1.10 -4.90 105.19 101.09 2w3r n GLY 18 Ca 0.15 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.41 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 -4.68 0.49 -2.02 1.61 6.02 0.75 -4.96 117.38 114.59 2w3r n GLN 19 Ca -0.02 -0.09 -0.42 0.00 -0.01 0.00 0.00 57.00 56.46 2w3r n GLN 19 Cb 0.56 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.54 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 -2.69 3.70 -0.09 -1.58 0.00 -0.95 -5.00 121.76 115.15 2w3r s ALA 20 Ca -0.04 1.28 -0.15 0.00 0.00 0.00 0.00 51.96 53.05 2w3r s ALA 20 Cb 0.06 -3.59 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 2w3r s ALA 20 CO 0.43 -0.72 0.38 1.03 0.00 0.00 0.00 175.76 176.89 2w3r s ARG 21 N 0.96 4.13 0.50 0.00 0.52 -1.26 -4.99 118.95 118.82 2w3r s ARG 21 Ca 0.67 0.31 0.07 0.00 -0.52 0.00 0.00 55.73 56.26 2w3r s ARG 21 Cb -0.41 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 31.73 2w3r s ARG 21 CO 0.32 0.39 0.45 0.71 0.02 0.00 0.00 175.30 177.20 2w3r s TYR 22 N -0.08 1.97 0.20 -0.53 1.51 -1.26 -4.72 117.35 114.44 2w3r s TYR 22 Ca 0.22 -0.70 -0.17 0.00 -1.01 0.00 0.00 57.07 55.40 2w3r s TYR 22 Cb -0.15 -2.05 0.19 0.00 -0.11 0.00 0.00 41.96 39.84 2w3r s TYR 22 CO 0.09 -0.45 1.60 1.25 -1.11 0.00 0.00 175.55 176.93 2w3r h LEU 23 N 0.77 -0.95 -1.90 -1.29 5.85 -1.93 -0.49 115.31 115.37 2w3r h LEU 23 Ca -0.37 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 2w3r h LEU 23 Cb 1.29 0.52 -0.00 0.00 0.37 0.00 0.00 40.66 42.83 2w3r h LEU 23 CO 0.55 -0.27 -0.05 -0.78 -0.34 0.00 0.00 178.44 177.54 2w3r h ASP 24 N -0.10 0.00 1.42 1.25 -0.00 -1.97 -2.51 116.42 114.51 2w3r h ASP 24 Ca 0.28 0.00 -0.08 0.00 -0.00 0.00 0.00 57.03 57.22 2w3r h ASP 24 Cb 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 39.85 2w3r h ASP 24 CO -0.70 0.05 -0.40 0.44 -0.00 0.00 0.00 179.24 178.63 2w3r h ASP 25 N 0.00 0.00 -2.99 2.28 3.32 -1.47 -3.46 116.42 114.10 2w3r h ASP 25 Ca -0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2w3r h ASP 25 Cb 0.37 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.01 2w3r h ASP 25 CO 0.01 0.40 0.67 0.18 -1.72 0.00 0.00 179.24 178.78 2w3r n LEU 26 N -3.26 3.57 -4.77 1.55 4.77 -0.95 -4.95 117.00 112.97 2w3r n LEU 26 Ca 0.02 1.16 -0.40 0.00 -0.03 0.00 0.00 56.01 56.76 2w3r n LEU 26 Cb 0.65 -1.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.23 2w3r n LEU 26 CO 0.39 -0.30 0.89 -2.16 -1.33 0.00 0.00 177.39 174.88 2w3r s PRO 27 N -0.76 4.33 0.04 3.23 0.04 -1.26 -5.05 135.00 135.57 2w3r s PRO 27 Ca 0.64 2.01 -0.11 0.00 0.04 0.00 0.00 61.00 63.58 2w3r s PRO 27 Cb -0.59 -2.98 0.01 0.00 0.04 0.00 0.00 34.50 30.98 2w3r s PRO 27 CO 0.52 -0.14 0.23 0.00 0.04 0.00 0.00 177.00 177.66 2w3r n PRO 29 N 0.71 0.23 -0.14 0.00 -0.02 -1.26 -4.84 135.00 129.67 2w3r n PRO 29 Ca -0.19 0.13 0.18 0.00 -2.02 0.00 0.00 63.50 61.61 2w3r n PRO 29 Cb 0.59 -2.09 0.57 0.00 -0.02 0.00 0.00 33.50 32.54 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 -0.67 2.28 -0.26 3.55 0.00 -2.01 -1.41 119.26 120.74 2w3r h ALA 30 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2w3r h ALA 30 Cb 1.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2w3r h ALA 30 CO 0.43 -0.49 0.00 0.27 0.00 0.00 0.00 179.25 179.46 2w3r n ASN 31 N -4.44 1.53 -4.69 0.00 6.94 -1.26 -4.91 115.26 108.43 2w3r n ASN 31 Ca 0.15 -1.92 -0.44 0.00 -0.02 0.00 0.00 54.58 52.34 2w3r n ASN 31 Cb 0.62 -0.17 -0.04 0.00 -2.36 0.00 0.00 39.78 37.83 2w3r n ASN 31 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2w3r n THR 32 N 0.31 0.14 -3.49 5.53 -1.04 -0.53 -4.52 114.28 110.68 2w3r n THR 32 Ca 0.11 -0.04 -0.23 0.00 -2.04 0.00 0.00 64.05 61.86 2w3r n THR 32 Cb 0.26 -1.70 -0.01 0.00 -1.82 0.00 0.00 70.33 67.06 2w3r n THR 32 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w3r s LEU 33 N 0.84 4.06 -0.02 -4.42 1.43 0.12 -4.86 118.68 115.82 2w3r s LEU 33 Ca 0.76 0.32 0.04 0.00 -1.03 0.00 0.00 54.13 54.22 2w3r s LEU 33 Cb -0.61 -3.17 -0.01 0.00 0.03 0.00 0.00 46.19 42.43 2w3r s LEU 33 CO 0.38 -0.28 -0.15 -1.00 0.23 0.00 0.00 176.35 175.53 2w3r s HIS 34 N -2.25 1.41 0.23 0.29 3.76 -0.54 -0.26 115.29 117.93 2w3r s HIS 34 Ca 0.39 -0.33 0.10 0.00 -0.15 0.00 0.00 55.06 55.08 2w3r s HIS 34 Cb -0.09 -0.93 -0.05 0.00 1.11 0.00 0.00 32.58 32.62 2w3r s HIS 34 CO 0.34 -0.08 -0.13 -0.51 -0.85 0.00 0.00 174.74 173.51 2w3r s LEU 35 N -0.14 2.81 -0.05 0.89 1.43 -0.22 -1.21 118.68 122.18 2w3r s LEU 35 Ca 0.01 -0.79 -0.10 0.00 -1.03 0.00 0.00 54.13 52.22 2w3r s LEU 35 Cb -0.08 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.75 2w3r s LEU 35 CO 0.00 0.06 0.25 0.00 0.23 0.00 0.00 176.35 176.89 2w3r s ALA 36 N -2.09 -0.61 0.23 4.21 0.00 -0.95 -4.54 121.76 118.01 2w3r s ALA 36 Ca 0.27 0.40 -0.19 0.00 0.00 0.00 0.00 51.96 52.44 2w3r s ALA 36 Cb -0.07 -0.14 -0.08 0.00 0.00 0.00 0.00 23.12 22.82 2w3r s ALA 36 CO 0.15 -0.19 0.71 -0.06 0.00 0.00 0.00 175.76 176.38 2w3r s PHE 37 N -0.68 3.62 -0.25 0.00 2.99 -1.26 -0.98 117.98 121.41 2w3r s PHE 37 Ca -0.08 1.35 -0.14 0.00 0.00 0.00 0.00 56.93 58.06 2w3r s PHE 37 Cb -0.04 -2.60 -0.04 0.00 0.00 0.00 0.00 43.02 40.34 2w3r s PHE 37 CO 0.02 0.32 0.33 0.20 -0.00 0.00 0.00 175.22 176.08 2w3r s GLY 38 N -1.71 1.94 0.15 4.36 0.00 -0.65 -4.88 107.32 106.52 2w3r s GLY 38 Ca 0.44 -0.80 -0.01 0.00 0.00 0.00 0.00 44.72 44.34 2w3r s GLY 38 CO 0.21 0.83 0.33 1.08 0.00 0.00 0.00 173.10 175.54 2w3r s LEU 39 N 1.75 4.28 0.32 0.66 1.43 -1.26 -0.86 118.68 125.00 2w3r s LEU 39 Ca 0.14 0.39 -0.29 0.00 -1.03 0.00 0.00 54.13 53.34 2w3r s LEU 39 Cb -0.15 -3.12 -0.10 0.00 0.03 0.00 0.00 46.19 42.84 2w3r s LEU 39 CO 0.09 0.04 1.37 -0.55 0.23 0.00 0.00 176.35 177.53 2w3r s SER 40 N -2.84 6.67 0.00 2.29 0.15 -0.16 -4.86 113.70 114.95 2w3r s SER 40 Ca 0.38 2.74 0.24 0.00 0.70 0.00 0.00 55.95 60.01 2w3r s SER 40 Cb -0.12 -2.65 0.31 0.00 -1.71 0.00 0.00 66.02 61.86 2w3r s SER 40 CO 0.28 -0.64 1.33 0.35 1.20 0.00 0.00 173.24 175.76 2w3r n THR 41 N 1.17 0.13 -4.95 6.45 -2.24 -1.26 -1.68 114.28 111.90 2w3r n THR 41 Ca 0.02 -0.54 -0.32 0.00 -2.27 0.00 0.00 64.05 60.93 2w3r n THR 41 Cb 0.41 1.29 -0.14 0.00 -2.10 0.00 0.00 70.33 69.78 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 -1.87 2.81 0.23 -0.78 0.41 -1.26 -4.92 118.70 113.32 2w3r s GLU 42 Ca 0.31 -0.75 0.03 0.00 -0.41 0.00 0.00 54.97 54.16 2w3r s GLU 42 Cb 0.21 -2.41 0.23 0.00 -1.78 0.00 0.00 34.13 30.38 2w3r s GLU 42 CO 0.31 0.42 1.55 0.00 -0.49 0.00 0.00 175.26 177.05 2w3r h ALA 43 N 5.99 0.83 -1.99 5.21 0.00 -1.81 -3.30 119.26 124.19 2w3r h ALA 43 Ca -0.36 -0.54 0.05 0.00 0.00 0.00 0.00 54.91 54.07 2w3r h ALA 43 Cb 1.18 -0.08 -0.21 0.00 0.00 0.00 0.00 17.79 18.67 2w3r h ALA 43 CO 0.51 0.72 -0.18 0.45 0.00 0.00 0.00 179.25 180.75 2w3r s SER 44 N -6.90 -1.02 0.11 0.00 0.15 -1.26 -2.27 113.70 102.51 2w3r s SER 44 Ca -0.04 1.41 -0.26 0.00 0.70 0.00 0.00 55.95 57.76 2w3r s SER 44 Cb 0.12 2.14 0.08 0.00 -1.71 0.00 0.00 66.02 66.65 2w3r s SER 44 CO 0.80 -0.23 1.06 0.00 1.20 0.00 0.00 173.24 176.08 2w3r s ALA 45 N 2.85 -1.81 -0.08 5.45 0.00 -1.05 -0.54 121.76 126.58 2w3r s ALA 45 Ca -0.03 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2w3r s ALA 45 Cb -0.12 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 2w3r s ALA 45 CO -0.18 -1.05 -0.06 0.00 0.00 0.00 0.00 175.76 174.47 2w3r s ALA 46 N -2.90 3.01 -0.52 0.00 0.00 -1.09 -1.08 121.76 119.19 2w3r s ALA 46 Ca 0.14 -0.87 -0.29 0.00 0.00 0.00 0.00 51.96 50.94 2w3r s ALA 46 Cb 0.00 -1.29 0.03 0.00 0.00 0.00 0.00 23.12 21.86 2w3r s ALA 46 CO 0.01 0.54 1.20 0.42 0.00 0.00 0.00 175.76 177.92 2w3r s ILE 47 N -0.69 4.08 -0.06 0.00 1.01 0.58 0.56 121.20 126.67 2w3r s ILE 47 Ca 0.10 1.04 -0.05 0.00 0.00 0.00 0.00 60.65 61.75 2w3r s ILE 47 Cb -0.11 -4.62 -0.27 0.00 0.01 0.00 0.00 42.46 37.46 2w3r s ILE 47 CO 0.02 -1.15 0.60 0.74 0.00 0.00 0.00 174.94 175.15 2w3r h THR 48 N 6.23 0.86 -3.35 2.92 2.02 -0.69 -3.46 112.91 117.44 2w3r h THR 48 Ca -0.24 -2.54 -0.17 0.00 0.77 0.00 0.00 66.41 64.23 2w3r h THR 48 Cb 1.06 2.62 -0.24 0.00 -1.74 0.00 0.00 68.15 69.86 2w3r h THR 48 CO 1.15 0.82 -0.49 -0.83 0.37 0.00 0.00 175.52 176.55 2w3r s GLY 49 N -5.25 -0.08 -0.39 2.16 0.00 -1.03 -4.97 107.32 97.76 2w3r s GLY 49 Ca -0.15 0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.87 2w3r s GLY 49 CO 0.82 0.19 0.23 -2.27 0.00 0.00 0.00 173.10 172.07 2w3r s LEU 50 N -0.47 1.76 -0.56 0.66 2.96 -1.26 -1.78 118.68 119.99 2w3r s LEU 50 Ca -0.06 -2.41 -0.20 0.00 -0.22 0.00 0.00 54.13 51.24 2w3r s LEU 50 Cb -0.04 -0.68 0.08 0.00 0.50 0.00 0.00 46.19 46.05 2w3r s LEU 50 CO 0.01 -0.29 0.71 -0.62 -1.32 0.00 0.00 176.35 174.84 2w3r s ASP 51 N 0.71 6.21 -0.20 3.68 2.15 0.14 -4.88 116.67 124.48 2w3r s ASP 51 Ca 0.18 -1.09 0.15 0.00 0.43 0.00 0.00 52.55 52.23 2w3r s ASP 51 Cb -0.23 -2.32 0.69 0.00 -0.30 0.00 0.00 42.92 40.77 2w3r s ASP 51 CO -0.00 -1.05 1.61 0.18 -0.17 0.00 0.00 175.17 175.74 2w3r n LEU 52 N 6.46 4.90 -0.03 -1.34 4.77 -1.26 -1.52 117.00 128.97 2w3r n LEU 52 Ca -0.07 -2.90 -0.14 0.00 -0.03 0.00 0.00 56.01 52.87 2w3r n LEU 52 Cb 0.44 -0.61 -0.09 0.00 -2.33 0.00 0.00 43.42 40.83 2w3r n LEU 52 CO 0.57 0.67 0.54 -0.08 -1.33 0.00 0.00 177.39 177.76 2w3r h GLU 53 N 3.13 0.20 0.00 3.23 4.57 -1.92 -1.33 114.58 122.46 2w3r h GLU 53 Ca 0.00 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 2w3r h GLU 53 Cb 1.71 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 30.32 2w3r h GLU 53 CO 0.36 0.74 -0.03 -1.35 -1.18 0.00 0.00 179.01 177.55 2w3r h PRO 54 N -0.31 0.00 0.16 0.92 0.11 -1.81 -0.15 132.00 130.92 2w3r h PRO 54 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2w3r h PRO 54 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 2w3r h PRO 54 CO 0.03 0.03 -0.08 0.28 -0.21 0.00 0.00 178.00 178.05 2w3r h VAL 55 N 0.00 0.97 -0.62 3.15 2.07 -1.70 -2.42 116.25 117.69 2w3r h VAL 55 Ca -0.00 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 66.93 2w3r h VAL 55 Cb 0.05 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 2w3r h VAL 55 CO 0.00 0.14 0.41 0.03 0.02 0.00 0.00 177.57 178.18 2w3r h ARG 56 N -0.52 0.72 0.00 1.57 3.08 -0.66 -2.45 114.38 116.13 2w3r h ARG 56 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2w3r h ARG 56 Cb 0.40 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.29 2w3r h ARG 56 CO 0.04 0.48 0.00 0.93 -1.07 0.00 0.00 179.97 180.34 2w3r h GLU 57 N 0.74 0.00 -7.00 0.04 5.08 -1.00 -3.44 114.58 109.00 2w3r h GLU 57 Ca 0.25 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.07 2w3r h GLU 57 Cb 0.06 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.42 2w3r h GLU 57 CO -0.07 0.00 0.64 0.45 -1.00 0.00 0.00 179.01 179.03 2w3r s SER 58 N -5.48 5.82 0.13 1.42 0.15 -0.92 -4.89 113.70 109.94 2w3r s SER 58 Ca 0.07 2.77 -0.33 0.00 0.70 0.00 0.00 55.95 59.16 2w3r s SER 58 Cb 0.08 -2.64 -0.18 0.00 -1.71 0.00 0.00 66.02 61.57 2w3r s SER 58 CO 0.61 -1.19 0.89 -2.65 1.20 0.00 0.00 173.24 172.09 2w3r n PRO 59 N -0.38 0.36 -2.21 5.44 -0.02 -1.26 -3.01 135.00 133.92 2w3r n PRO 59 Ca 0.06 0.13 -0.20 0.00 -2.02 0.00 0.00 63.50 61.47 2w3r n PRO 59 Cb 0.44 -1.43 -0.03 0.00 -0.02 0.00 0.00 33.50 32.45 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 1.81 0.08 3.69 -1.23 0.00 -1.26 -4.88 105.19 103.40 2w3r n GLY 60 Ca 0.18 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.96 5.27 -0.24 1.61 1.01 -1.16 -0.77 120.40 123.15 2w3r s VAL 61 Ca 0.00 0.56 -0.12 0.00 0.00 0.00 0.00 61.98 62.42 2w3r s VAL 61 Cb 0.00 -3.65 -0.16 0.00 0.00 0.00 0.00 36.38 32.57 2w3r s VAL 61 CO 0.00 0.32 -0.14 -0.38 0.00 0.00 0.00 175.10 174.91 2w3r n ILE 62 N 4.01 1.55 -3.91 2.22 2.08 0.37 -4.99 119.36 120.69 2w3r n ILE 62 Ca -0.11 -0.37 -0.10 0.00 0.56 0.00 0.00 62.75 62.73 2w3r n ILE 62 Cb 0.52 -1.81 -0.10 0.00 -0.75 0.00 0.00 39.64 37.50 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 -2.48 -0.16 -0.05 -1.39 0.00 -1.06 -5.02 121.76 111.60 2w3r s ALA 63 Ca -0.34 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 51.33 2w3r s ALA 63 Cb 0.11 0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.37 2w3r s ALA 63 CO 0.56 -0.20 -0.12 0.08 0.00 0.00 0.00 175.76 176.09 2w3r s VAL 64 N -1.48 1.04 -0.01 0.00 1.01 -1.26 -0.43 120.40 119.28 2w3r s VAL 64 Ca -0.15 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.45 2w3r s VAL 64 Cb -0.08 -0.94 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 2w3r s VAL 64 CO 0.00 0.32 -0.24 -0.36 0.00 0.00 0.00 175.10 174.83 2w3r s PHE 65 N 0.44 2.12 0.30 5.22 0.40 0.12 -4.95 117.98 121.64 2w3r s PHE 65 Ca -0.09 -0.40 0.10 0.00 -0.60 0.00 0.00 56.93 55.94 2w3r s PHE 65 Cb -0.13 -1.36 -0.06 0.00 0.51 0.00 0.00 43.02 41.98 2w3r s PHE 65 CO 0.02 -0.03 -0.14 0.99 0.70 0.00 0.00 175.22 176.76 2w3r s THR 66 N -0.57 2.26 0.47 0.64 2.01 -1.26 -0.60 115.64 118.59 2w3r s THR 66 Ca 0.09 -2.29 0.29 0.00 0.31 0.00 0.00 61.69 60.09 2w3r s THR 66 Cb -0.09 -2.43 0.49 0.00 0.01 0.00 0.00 72.50 70.47 2w3r s THR 66 CO -0.01 -0.33 1.75 0.00 -0.69 0.00 0.00 174.62 175.34 2w3r h ALA 67 N 2.19 2.74 -0.48 7.40 0.00 -1.80 0.39 119.26 129.71 2w3r h ALA 67 Ca -0.41 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 2w3r h ALA 67 Cb 1.25 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 2w3r h ALA 67 CO 0.65 -1.17 0.14 0.00 0.00 0.00 0.00 179.25 178.87 2w3r h ALA 68 N 1.50 1.35 0.00 0.00 0.00 -1.94 -2.88 119.26 117.29 2w3r h ALA 68 Ca 0.64 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.36 2w3r h ALA 68 Cb 2.10 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.69 2w3r h ALA 68 CO -0.19 0.47 -0.12 -0.44 0.00 0.00 0.00 179.25 178.97 2w3r h ASP 69 N 0.69 0.00 -2.43 0.00 3.32 -0.60 -3.45 116.42 113.95 2w3r h ASP 69 Ca 0.16 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.65 2w3r h ASP 69 Cb 0.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 2w3r h ASP 69 CO -0.01 0.12 1.24 -0.76 -1.72 0.00 0.00 179.24 178.11 2w3r s LEU 70 N -6.40 4.01 0.33 1.55 1.43 -1.09 -4.88 118.68 113.63 2w3r s LEU 70 Ca 0.03 2.10 0.01 0.00 -1.03 0.00 0.00 54.13 55.24 2w3r s LEU 70 Cb 0.08 -3.53 0.58 0.00 0.03 0.00 0.00 46.19 43.36 2w3r s LEU 70 CO 0.62 -1.32 1.98 1.55 0.23 0.00 0.00 176.35 179.41 2w3r h PRO 71 N 11.58 0.92 0.00 1.29 0.13 -1.87 -3.46 132.00 140.59 2w3r h PRO 71 Ca -0.41 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2w3r h PRO 71 Cb 1.20 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2w3r h PRO 71 CO 0.97 0.61 0.00 0.72 -0.23 0.00 0.00 178.00 180.06 2w3r n HIS 72 N -4.44 0.00 -1.65 1.56 8.25 -1.26 -5.05 115.22 112.64 2w3r n HIS 72 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.13 2w3r n HIS 72 Cb 0.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 1.91 -2.57 0.41 9.92 -1.19 -4.96 116.55 120.07 2w3r n ASP 73 Ca 0.00 1.11 -0.25 0.00 -0.53 0.00 0.00 54.79 55.11 2w3r n ASP 73 Cb 0.00 -1.41 -0.00 0.00 -0.64 0.00 0.00 41.12 39.07 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 0.57 4.38 -4.08 -2.24 5.15 -1.26 -4.48 115.26 113.30 2w3r n ASN 74 Ca 0.08 -3.63 -0.24 0.00 -0.60 0.00 0.00 54.58 50.19 2w3r n ASN 74 Cb 0.38 -0.48 -0.16 0.00 -0.53 0.00 0.00 39.78 38.99 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 -3.48 1.80 0.00 1.20 2.15 -1.25 -3.14 116.67 113.93 2w3r s ASP 75 Ca 0.46 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.15 2w3r s ASP 75 Cb 0.39 -0.54 0.00 0.00 -0.30 0.00 0.00 42.92 42.47 2w3r s ASP 75 CO -0.16 0.11 0.28 0.00 -0.17 0.00 0.00 175.17 175.22 2w3r n ALA 76 N 3.28 1.01 -1.77 3.66 0.00 0.70 -4.87 120.51 122.52 2w3r n ALA 76 Ca -0.19 -0.28 -0.38 0.00 0.00 0.00 0.00 53.44 52.59 2w3r n ALA 76 Cb 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 2w3r n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3r s SER 77 N -0.07 7.31 0.26 0.00 0.15 -1.26 -4.82 113.70 115.28 2w3r s SER 77 Ca 0.00 1.99 0.24 0.00 0.70 0.00 0.00 55.95 58.88 2w3r s SER 77 Cb 0.00 -2.60 0.97 0.00 -1.71 0.00 0.00 66.02 62.68 2w3r s SER 77 CO 0.00 -0.09 1.73 -0.81 1.20 0.00 0.00 173.24 175.26 2w3r n PRO 78 N 0.84 0.21 -2.57 5.44 -0.04 -1.26 -4.82 135.00 132.80 2w3r n PRO 78 Ca 0.01 0.40 -0.26 0.00 -0.04 0.00 0.00 63.50 63.61 2w3r n PRO 78 Cb 0.48 -1.88 0.02 0.00 -0.04 0.00 0.00 33.50 32.08 2w3r n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3r s ALA 79 N -3.30 3.41 0.34 0.55 0.00 -1.25 -5.01 121.76 116.50 2w3r s ALA 79 Ca 0.05 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.36 2w3r s ALA 79 Cb 0.10 -2.51 0.62 0.00 0.00 0.00 0.00 23.12 21.32 2w3r s ALA 79 CO 0.42 -0.59 1.86 -1.35 0.00 0.00 0.00 175.76 176.09 2w3r h PRO 80 N 0.05 0.43 -6.66 0.00 0.11 -1.94 -3.43 132.00 120.55 2w3r h PRO 80 Ca -0.46 -0.11 -0.52 0.00 0.11 0.00 0.00 66.00 65.02 2w3r h PRO 80 Cb 1.24 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 32.32 2w3r h PRO 80 CO 0.60 0.53 0.59 -1.54 -0.21 0.00 0.00 178.00 177.97 2w3r s SER 81 N -6.79 7.01 0.55 -2.05 1.04 -1.26 -4.99 113.70 107.21 2w3r s SER 81 Ca -0.07 2.29 -0.20 0.00 0.48 0.00 0.00 55.95 58.45 2w3r s SER 81 Cb 0.15 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.61 2w3r s SER 81 CO 0.76 -0.44 1.20 -2.16 0.98 0.00 0.00 173.24 173.59 2w3r s PRO 82 N -0.14 3.25 -0.07 4.02 0.04 -1.26 -4.76 135.00 136.07 2w3r s PRO 82 Ca 0.54 1.82 -0.02 0.00 0.04 0.00 0.00 61.00 63.39 2w3r s PRO 82 Cb -0.34 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.14 2w3r s PRO 82 CO 0.37 -0.98 0.03 -2.00 0.04 0.00 0.00 177.00 174.46 2w3r s GLU 83 N -3.12 0.33 0.43 4.56 2.12 -1.26 -4.95 118.70 116.81 2w3r s GLU 83 Ca 0.73 0.16 -0.23 0.00 0.36 0.00 0.00 54.97 55.98 2w3r s GLU 83 Cb -0.30 -0.94 -0.08 0.00 0.26 0.00 0.00 34.13 33.07 2w3r s GLU 83 CO 0.34 -0.36 1.11 -1.25 -0.54 0.00 0.00 175.26 174.56 2w3r s PRO 84 N 2.05 3.94 0.00 4.30 0.04 -1.21 -0.22 135.00 143.90 2w3r s PRO 84 Ca 0.04 1.63 -0.18 0.00 0.04 0.00 0.00 61.00 62.54 2w3r s PRO 84 Cb -0.13 -2.45 -0.33 0.00 0.04 0.00 0.00 34.50 31.64 2w3r s PRO 84 CO -0.05 -0.37 0.98 0.28 0.04 0.00 0.00 177.00 177.89 2w3r h VAL 85 N 1.99 1.37 -3.52 -0.36 2.07 -1.88 -3.45 116.25 112.48 2w3r h VAL 85 Ca -0.49 -2.58 -0.68 0.00 0.82 0.00 0.00 66.70 63.77 2w3r h VAL 85 Cb 1.23 3.04 -0.31 0.00 -1.52 0.00 0.00 31.29 33.74 2w3r h VAL 85 CO 0.61 0.76 -0.85 -0.76 0.02 0.00 0.00 177.57 177.35 2w3r s LEU 86 N -7.77 2.27 0.10 2.57 1.43 -1.26 -4.57 118.68 111.45 2w3r s LEU 86 Ca -0.11 -0.48 -0.36 0.00 -1.03 0.00 0.00 54.13 52.15 2w3r s LEU 86 Cb 0.03 -1.46 -0.16 0.00 0.03 0.00 0.00 46.19 44.63 2w3r s LEU 86 CO 0.90 0.19 1.34 0.00 0.23 0.00 0.00 176.35 179.01 2w3r n ALA 87 N 3.33 -0.81 -3.25 4.21 0.00 -0.18 -4.62 120.51 119.19 2w3r n ALA 87 Ca -0.18 0.51 -0.45 0.00 0.00 0.00 0.00 53.44 53.32 2w3r n ALA 87 Cb 0.53 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.89 2w3r n ALA 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2w3r n THR 88 N 2.49 4.73 0.00 0.00 -2.24 -1.26 -4.54 114.28 113.45 2w3r n THR 88 Ca 0.18 -5.48 0.00 0.00 -2.27 0.00 0.00 64.05 56.48 2w3r n THR 88 Cb 0.20 -2.48 0.00 0.00 -2.10 0.00 0.00 70.33 65.95 2w3r n THR 88 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3r n GLY 89 N 2.43 2.67 3.28 3.38 0.00 -1.26 -4.92 105.19 110.76 2w3r n GLY 89 Ca 0.25 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 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 0.93 0.07 1.61 -1.05 -1.26 -0.31 118.70 118.69 2w3r s GLU 90 Ca 0.00 -0.64 0.09 0.00 -0.15 0.00 0.00 54.97 54.27 2w3r s GLU 90 Cb 0.00 0.40 -0.03 0.00 -0.44 0.00 0.00 34.13 34.06 2w3r s GLU 90 CO 0.00 -0.33 -0.26 0.14 0.95 0.00 0.00 175.26 175.76 2w3r s VAL 91 N -3.26 2.10 -0.00 1.83 -7.23 -0.24 -4.82 120.40 108.78 2w3r s VAL 91 Ca -0.00 -1.46 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 2w3r s VAL 91 Cb 0.01 -1.82 -0.00 0.00 0.56 0.00 0.00 36.38 35.13 2w3r s VAL 91 CO -0.08 0.27 0.09 1.41 -0.31 0.00 0.00 175.10 176.48 2w3r n HIS 92 N 1.55 0.00 -3.57 2.82 -0.00 -1.26 -2.53 115.22 112.24 2w3r n HIS 92 Ca -0.17 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.47 2w3r n HIS 92 Cb 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.50 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 -0.83 -0.32 -0.60 4.41 -0.12 -0.96 -4.18 117.98 115.37 2w3r s PHE 93 Ca 0.00 0.11 -0.28 0.00 -0.05 0.00 0.00 56.93 56.71 2w3r s PHE 93 Cb 0.00 0.58 0.02 0.00 -0.63 0.00 0.00 43.02 42.99 2w3r s PHE 93 CO 0.00 -0.72 1.34 0.08 -0.05 0.00 0.00 175.22 175.87 2w3r s VAL 94 N -3.34 3.83 0.00 -2.49 1.01 -1.24 -2.81 120.40 115.35 2w3r s VAL 94 Ca 0.06 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2w3r s VAL 94 Cb -0.01 -4.58 0.00 0.00 0.00 0.00 0.00 36.38 31.78 2w3r s VAL 94 CO -0.06 -1.32 0.00 0.61 0.00 0.00 0.00 175.10 174.33 2w3r n GLY 95 N 5.24 0.28 3.68 4.51 0.00 -0.68 -4.84 105.19 113.38 2w3r n GLY 95 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 4.22 0.22 1.61 0.74 -1.12 -4.51 119.66 120.81 2w3r s GLN 96 Ca 0.00 2.13 -0.32 0.00 0.05 0.00 0.00 55.36 57.22 2w3r s GLN 96 Cb 0.00 -3.73 -0.12 0.00 1.10 0.00 0.00 33.01 30.25 2w3r s GLN 96 CO 0.00 -0.72 1.66 -2.30 -0.55 0.00 0.00 175.29 173.38 2w3r n PRO 97 N 6.12 2.61 -0.05 1.67 -0.02 -1.26 -0.99 135.00 143.07 2w3r n PRO 97 Ca 0.15 0.94 -0.11 0.00 -2.02 0.00 0.00 63.50 62.47 2w3r n PRO 97 Cb 0.43 -2.75 -0.04 0.00 -0.02 0.00 0.00 33.50 31.11 2w3r n PRO 97 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2w3r n ILE 98 N 3.40 0.60 -4.40 4.25 5.41 -0.04 -1.01 119.36 127.57 2w3r n ILE 98 Ca 0.14 -0.17 -0.20 0.00 1.00 0.00 0.00 62.75 63.52 2w3r n ILE 98 Cb 0.34 -1.44 -0.10 0.00 -0.71 0.00 0.00 39.64 37.73 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 -2.20 1.82 -0.09 1.39 -0.12 -1.22 -4.05 117.98 113.51 2w3r s PHE 99 Ca -0.15 -1.04 0.00 0.00 -0.05 0.00 0.00 56.93 55.70 2w3r s PHE 99 Cb 0.05 -1.15 0.02 0.00 -0.63 0.00 0.00 43.02 41.31 2w3r s PHE 99 CO 0.20 -0.11 -0.08 -1.17 -0.05 0.00 0.00 175.22 174.02 2w3r s LEU 100 N -3.43 1.26 -0.17 -1.99 2.96 0.24 -1.64 118.68 115.90 2w3r s LEU 100 Ca 0.37 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 53.94 2w3r s LEU 100 Cb 0.08 -0.75 -0.05 0.00 0.50 0.00 0.00 46.19 45.98 2w3r s LEU 100 CO 0.15 -0.08 0.12 -0.69 -1.32 0.00 0.00 176.35 174.53 2w3r s VAL 101 N 1.38 5.29 -0.41 1.68 1.01 -0.15 0.13 120.40 129.33 2w3r s VAL 101 Ca -0.02 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 2w3r s VAL 101 Cb -0.14 -3.38 0.11 0.00 0.00 0.00 0.00 36.38 32.98 2w3r s VAL 101 CO -0.04 0.49 0.18 0.00 0.00 0.00 0.00 175.10 175.73 2w3r s ALA 102 N -0.02 3.12 0.52 5.51 0.00 0.43 -2.24 121.76 129.08 2w3r s ALA 102 Ca 0.09 -2.61 0.07 0.00 0.00 0.00 0.00 51.96 49.51 2w3r s ALA 102 Cb -0.11 -2.30 0.04 0.00 0.00 0.00 0.00 23.12 20.74 2w3r s ALA 102 CO -0.00 -1.80 0.50 0.00 0.00 0.00 0.00 175.76 174.46 2w3r s ALA 103 N 0.96 4.42 -2.55 0.00 0.00 -0.35 -0.48 121.76 123.76 2w3r s ALA 103 Ca 0.10 -1.64 0.27 0.00 0.00 0.00 0.00 51.96 50.69 2w3r s ALA 103 Cb -0.22 -1.00 0.92 0.00 0.00 0.00 0.00 23.12 22.83 2w3r s ALA 103 CO -0.05 -0.50 1.67 0.25 0.00 0.00 0.00 175.76 177.13 2w3r n THR 104 N -1.84 0.01 -3.87 0.00 -2.24 0.05 -1.47 114.28 104.91 2w3r n THR 104 Ca 0.04 -0.29 -0.09 0.00 -2.27 0.00 0.00 64.05 61.44 2w3r n THR 104 Cb 0.63 0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 69.43 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 -1.98 -0.10 0.03 3.42 1.04 -1.26 -4.82 113.70 110.03 2w3r s SER 105 Ca 0.36 -0.72 -0.25 0.00 0.48 0.00 0.00 55.95 55.82 2w3r s SER 105 Cb 0.21 0.52 -0.17 0.00 0.10 0.00 0.00 66.02 66.67 2w3r s SER 105 CO 0.33 -1.00 1.42 -0.74 0.98 0.00 0.00 173.24 174.22 2w3r h HIS 106 N 2.35 -0.19 -0.21 5.02 2.76 -1.90 -2.80 115.15 120.19 2w3r h HIS 106 Ca -0.29 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 57.93 2w3r h HIS 106 Cb 1.25 0.06 -0.06 0.00 1.55 0.00 0.00 27.41 30.21 2w3r h HIS 106 CO 0.38 0.10 -0.19 0.00 -1.30 0.00 0.00 177.93 176.92 2w3r h ARG 107 N -0.47 -0.19 -0.82 5.26 2.47 -1.97 -1.09 114.38 117.57 2w3r h ARG 107 Ca -0.02 0.01 0.16 0.00 -1.26 0.00 0.00 59.98 58.87 2w3r h ARG 107 Cb 0.37 0.04 -0.10 0.00 -1.65 0.00 0.00 29.97 28.63 2w3r h ARG 107 CO 0.03 -0.13 0.37 0.00 0.56 0.00 0.00 179.97 180.81 2w3r h ALA 108 N 0.89 1.22 -0.21 0.04 0.00 -1.90 0.24 119.26 119.54 2w3r h ALA 108 Ca 0.13 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 2w3r h ALA 108 Cb 0.39 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2w3r h ALA 108 CO -0.33 -0.18 0.01 0.00 0.00 0.00 0.00 179.25 178.75 2w3r h ALA 109 N 1.58 0.28 -0.40 0.00 0.00 -1.10 -0.10 119.26 119.51 2w3r h ALA 109 Ca 0.46 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.23 2w3r h ALA 109 Cb 0.71 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2w3r h ALA 109 CO -0.41 -0.02 0.12 0.00 0.00 0.00 0.00 179.25 178.94 2w3r h ARG 110 N 0.13 0.25 -0.29 0.00 2.47 -0.22 -0.59 114.38 116.14 2w3r h ARG 110 Ca 0.06 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2w3r h ARG 110 Cb 0.37 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 2w3r h ARG 110 CO 0.01 0.17 0.13 0.82 0.56 0.00 0.00 179.97 181.66 2w3r h ILE 111 N 0.26 1.16 0.00 2.04 2.04 -0.48 -3.05 117.51 119.47 2w3r h ILE 111 Ca 0.19 -0.47 -0.07 0.00 1.00 0.00 0.00 64.86 65.51 2w3r h ILE 111 Cb 0.20 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2w3r h ILE 111 CO -0.22 0.16 -0.35 0.00 0.00 0.00 0.00 178.15 177.75 2w3r h ALA 112 N 0.98 1.30 0.00 1.87 0.00 -0.72 -2.73 119.26 119.96 2w3r h ALA 112 Ca 0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2w3r h ALA 112 Cb 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2w3r h ALA 112 CO -0.01 0.44 -0.06 0.00 0.00 0.00 0.00 179.25 179.62 2w3r h ALA 113 N 1.65 1.84 -0.00 0.00 0.00 -1.00 -2.67 119.26 119.08 2w3r h ALA 113 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 113 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2w3r h ALA 113 CO 0.05 0.07 -0.22 0.54 0.00 0.00 0.00 179.25 179.69 2w3r n ARG 114 N -4.38 0.42 -0.21 0.00 1.74 -1.03 -4.12 116.66 109.08 2w3r n ARG 114 Ca -0.03 -0.18 0.11 0.00 -0.77 0.00 0.00 57.85 56.98 2w3r n ARG 114 Cb 0.14 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.35 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 -1.14 2.28 -2.17 5.56 5.02 -1.01 -4.95 118.16 121.75 2w3r n LYS 115 Ca 0.10 -1.96 -0.34 0.00 -2.02 0.00 0.00 58.31 54.09 2w3r n LYS 115 Cb 0.31 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.87 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 -1.44 2.69 -0.33 7.82 0.00 -1.26 -4.21 121.76 125.03 2w3r s ALA 116 Ca 0.38 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.96 2w3r s ALA 116 Cb 0.21 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 20.08 2w3r s ALA 116 CO 0.28 -0.79 0.05 1.03 0.00 0.00 0.00 175.76 176.34 2w3r s ARG 117 N -3.58 2.36 -0.06 0.00 0.52 -0.58 -5.03 118.95 112.59 2w3r s ARG 117 Ca 0.69 -1.37 0.06 0.00 -0.52 0.00 0.00 55.73 54.59 2w3r s ARG 117 Cb -0.20 -3.29 -0.01 0.00 0.52 0.00 0.00 34.95 31.96 2w3r s ARG 117 CO 0.30 -0.71 -0.23 0.42 0.02 0.00 0.00 175.30 175.10 2w3r s ILE 118 N 1.25 2.23 -0.07 1.52 1.01 -1.26 -0.69 121.20 125.19 2w3r s ILE 118 Ca -0.02 -1.01 0.04 0.00 0.00 0.00 0.00 60.65 59.66 2w3r s ILE 118 Cb -0.20 -1.82 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 2w3r s ILE 118 CO -0.01 0.57 -0.18 0.42 0.00 0.00 0.00 174.94 175.74 2w3r s THR 119 N -0.26 2.70 0.36 2.92 -4.23 -0.74 -4.98 115.64 111.42 2w3r s THR 119 Ca -0.00 -0.84 0.08 0.00 -1.18 0.00 0.00 61.69 59.75 2w3r s THR 119 Cb -0.13 -2.05 -0.06 0.00 1.34 0.00 0.00 72.50 71.61 2w3r s THR 119 CO 0.03 0.57 0.06 -0.31 -0.54 0.00 0.00 174.62 174.43 2w3r s TYR 120 N -0.34 2.57 -0.71 3.99 1.51 -1.26 0.03 117.35 123.14 2w3r s TYR 120 Ca 0.03 -0.49 0.05 0.00 -1.01 0.00 0.00 57.07 55.65 2w3r s TYR 120 Cb -0.12 -1.64 0.18 0.00 -0.11 0.00 0.00 41.96 40.27 2w3r s TYR 120 CO 0.02 0.40 0.54 0.00 -1.11 0.00 0.00 175.55 175.40 2w3r n ALA 121 N -1.04 3.52 -1.60 3.71 0.00 0.19 -4.73 120.51 120.56 2w3r n ALA 121 Ca -0.03 -4.57 -0.49 0.00 0.00 0.00 0.00 53.44 48.34 2w3r n ALA 121 Cb 0.63 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.00 2w3r n ALA 121 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2w3r n PRO 122 N 1.82 1.37 -4.19 0.00 -0.02 -1.26 -2.66 135.00 130.06 2w3r n PRO 122 Ca 0.21 0.49 -0.23 0.00 -2.02 0.00 0.00 63.50 61.95 2w3r n PRO 122 Cb 0.36 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.68 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 0.10 2.32 -0.24 -0.52 0.52 0.30 -4.93 118.95 116.50 2w3r s ARG 123 Ca 0.78 -1.53 -0.29 0.00 -0.52 0.00 0.00 55.73 54.16 2w3r s ARG 123 Cb -0.85 -2.14 -0.01 0.00 0.52 0.00 0.00 34.95 32.46 2w3r s ARG 123 CO 0.48 0.19 1.41 -2.14 0.02 0.00 0.00 175.30 175.26 2w3r s PRO 124 N -3.78 3.94 0.47 3.54 0.02 -1.26 -4.59 135.00 133.34 2w3r s PRO 124 Ca 0.35 1.49 -0.21 0.00 0.02 0.00 0.00 61.00 62.66 2w3r s PRO 124 Cb -0.03 -3.91 -0.09 0.00 0.02 0.00 0.00 34.50 30.48 2w3r s PRO 124 CO 0.21 -1.09 1.03 0.00 -0.33 0.00 0.00 177.00 176.82 2w3r s ALA 125 N 4.47 2.91 -0.51 -1.55 0.00 -1.26 -4.97 121.76 120.85 2w3r s ALA 125 Ca 0.61 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 53.10 2w3r s ALA 125 Cb -0.21 -3.24 0.13 0.00 0.00 0.00 0.00 23.12 19.80 2w3r s ALA 125 CO 0.24 -0.24 0.35 0.42 0.00 0.00 0.00 175.76 176.53 2w3r s ILE 126 N -1.97 3.89 -0.22 0.00 1.01 -1.26 -4.95 121.20 117.70 2w3r s ILE 126 Ca 0.66 -2.20 0.04 0.00 0.00 0.00 0.00 60.65 59.15 2w3r s ILE 126 Cb -0.16 -3.57 -0.16 0.00 0.01 0.00 0.00 42.46 38.58 2w3r s ILE 126 CO 0.20 -0.79 -0.16 0.18 0.00 0.00 0.00 174.94 174.37 2w3r n LEU 127 N 4.41 2.48 -4.99 2.97 4.77 -1.26 -0.02 117.00 125.36 2w3r n LEU 127 Ca -0.01 -0.10 -0.20 0.00 -0.03 0.00 0.00 56.01 55.67 2w3r n LEU 127 Cb 0.41 -0.58 0.02 0.00 -2.33 0.00 0.00 43.42 40.94 2w3r n LEU 127 CO 0.37 0.81 0.27 0.42 -1.33 0.00 0.00 177.39 177.93 2w3r s THR 128 N -2.45 2.92 0.19 -5.08 -4.23 -1.26 -4.78 115.64 100.95 2w3r s THR 128 Ca -0.27 -0.78 -0.08 0.00 -1.18 0.00 0.00 61.69 59.38 2w3r s THR 128 Cb 0.07 -3.05 0.06 0.00 1.34 0.00 0.00 72.50 70.92 2w3r s THR 128 CO 0.56 -0.03 1.63 -0.07 -0.54 0.00 0.00 174.62 176.17 2w3r h LEU 129 N 0.32 0.98 -0.57 4.79 4.07 -1.97 -2.27 115.31 120.66 2w3r h LEU 129 Ca -0.42 -0.31 -0.12 0.00 0.08 0.00 0.00 57.88 57.11 2w3r h LEU 129 Cb 1.29 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 2w3r h LEU 129 CO 0.50 1.08 -0.18 0.44 -1.08 0.00 0.00 178.44 179.20 2w3r h ASP 130 N 0.89 0.97 0.00 -0.43 3.32 -1.98 0.17 116.42 119.36 2w3r h ASP 130 Ca 0.15 -0.35 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 2w3r h ASP 130 Cb 0.62 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2w3r h ASP 130 CO 0.04 1.12 -0.00 1.56 -1.72 0.00 0.00 179.24 180.24 2w3r h GLN 131 N 0.83 -0.00 -0.60 3.56 4.20 -1.95 0.22 115.11 121.37 2w3r h GLN 131 Ca 0.12 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 2w3r h GLN 131 Cb 0.74 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.49 2w3r h GLN 131 CO 0.06 0.03 0.23 0.00 -0.67 0.00 0.00 178.83 178.47 2w3r h ALA 132 N 0.97 1.28 -0.09 3.87 0.00 -1.16 0.32 119.26 124.45 2w3r h ALA 132 Ca -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2w3r h ALA 132 Cb 0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2w3r h ALA 132 CO 0.00 0.53 -0.04 1.25 0.00 0.00 0.00 179.25 180.99 2w3r h LEU 133 N 0.86 0.20 -0.09 0.00 5.85 -0.47 0.21 115.31 121.87 2w3r h LEU 133 Ca 0.20 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 2w3r h LEU 133 Cb 0.18 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 2w3r h LEU 133 CO -0.02 0.56 0.06 0.00 -0.34 0.00 0.00 178.44 178.70 2w3r h ALA 134 N 0.64 0.12 0.00 1.25 0.00 -0.20 -2.70 119.26 118.37 2w3r h ALA 134 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2w3r h ALA 134 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 134 CO 0.01 -0.37 0.00 0.00 0.00 0.00 0.00 179.25 178.89 2w3r n ALA 135 N -2.14 1.79 -3.76 0.00 0.00 0.11 -4.87 120.51 111.64 2w3r n ALA 135 Ca -0.05 -0.05 -0.28 0.00 0.00 0.00 0.00 53.44 53.06 2w3r n ALA 135 Cb 0.05 -1.29 0.05 0.00 0.00 0.00 0.00 19.45 18.25 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 -1.57 -5.50 -4.56 0.00 2.03 -0.76 -4.96 116.55 101.22 2w3r n ASP 136 Ca 0.04 -0.67 -0.43 0.00 0.52 0.00 0.00 54.79 54.26 2w3r n ASP 136 Cb 0.21 -4.36 -0.04 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 -3.28 6.49 0.28 1.67 0.15 0.67 -4.99 113.70 114.70 2w3r s SER 137 Ca 0.63 0.10 -0.17 0.00 0.70 0.00 0.00 55.95 57.21 2w3r s SER 137 Cb -0.30 -2.44 0.02 0.00 -1.71 0.00 0.00 66.02 61.59 2w3r s SER 137 CO 0.77 -1.01 0.64 0.00 1.20 0.00 0.00 173.24 174.84 2w3r s ARG 138 N 3.64 1.77 0.38 5.44 1.70 -1.26 -1.43 118.95 129.19 2w3r s ARG 138 Ca 0.36 -1.16 0.08 0.00 -0.47 0.00 0.00 55.73 54.53 2w3r s ARG 138 Cb -0.11 0.56 -0.03 0.00 -0.57 0.00 0.00 34.95 34.80 2w3r s ARG 138 CO 0.25 -0.79 0.27 -0.06 -1.08 0.00 0.00 175.30 173.90 2w3r s PHE 139 N -3.72 2.74 0.00 5.89 0.40 0.43 -4.63 117.98 119.08 2w3r s PHE 139 Ca 0.16 -0.44 0.00 0.00 -0.60 0.00 0.00 56.93 56.05 2w3r s PHE 139 Cb -0.04 -1.93 0.00 0.00 0.51 0.00 0.00 43.02 41.56 2w3r s PHE 139 CO 0.09 0.10 0.00 0.39 0.70 0.00 0.00 175.22 176.50 2w3r n GLU 140 N -1.37 0.00 -2.24 0.44 1.02 -1.26 -4.28 120.64 112.96 2w3r n GLU 140 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 2w3r n GLU 140 Cb 0.62 -3.39 -0.02 0.00 -0.02 0.00 0.00 31.44 28.63 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 -2.00 -4.23 0.00 0.62 0.00 -1.26 -4.97 105.19 93.35 2w3r n GLY 141 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.76 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 0.86 -2.38 3.68 -0.02 0.00 -1.26 -5.00 105.19 101.06 2w3r n GLY 142 Ca -0.17 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.95 -0.07 -0.16 1.61 0.04 -1.26 -4.86 135.00 127.36 2w3r s PRO 143 Ca 0.00 0.21 0.00 0.00 0.04 0.00 0.00 61.00 61.25 2w3r s PRO 143 Cb 0.00 -1.71 -0.00 0.00 0.04 0.00 0.00 34.50 32.83 2w3r s PRO 143 CO 0.00 -3.00 -0.15 0.08 0.04 0.00 0.00 177.00 173.97 2w3r s VAL 144 N -3.09 2.68 -0.11 -0.36 1.01 -0.20 -4.95 120.40 115.38 2w3r s VAL 144 Ca 0.68 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2w3r s VAL 144 Cb -0.14 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.12 2w3r s VAL 144 CO 0.56 0.51 -0.20 -0.63 0.00 0.00 0.00 175.10 175.35 2w3r s ILE 145 N 0.82 1.82 0.06 2.22 1.01 -1.26 -0.12 121.20 125.74 2w3r s ILE 145 Ca -0.05 -0.85 0.09 0.00 0.00 0.00 0.00 60.65 59.83 2w3r s ILE 145 Cb -0.15 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.68 2w3r s ILE 145 CO -0.00 0.50 -0.23 0.26 0.00 0.00 0.00 174.94 175.48 2w3r s TRP 146 N 0.69 2.43 -0.06 3.97 0.51 -0.71 -4.94 118.94 120.82 2w3r s TRP 146 Ca -0.12 -0.34 -0.05 0.00 -2.12 0.00 0.00 56.10 53.48 2w3r s TRP 146 Cb -0.16 -1.40 0.02 0.00 -0.81 0.00 0.00 33.47 31.13 2w3r s TRP 146 CO 0.02 0.22 0.16 0.00 -0.51 0.00 0.00 176.95 176.85 2w3r s ALA 147 N -0.91 -0.37 -0.21 0.98 0.00 -1.26 -1.94 121.76 118.05 2w3r s ALA 147 Ca 0.14 0.55 0.01 0.00 0.00 0.00 0.00 51.96 52.66 2w3r s ALA 147 Cb -0.10 -0.34 0.05 0.00 0.00 0.00 0.00 23.12 22.72 2w3r s ALA 147 CO 0.04 -0.11 -0.10 0.50 0.00 0.00 0.00 175.76 176.10 2w3r s ARG 148 N 0.47 2.02 3.36 0.00 3.52 -0.56 -5.00 118.95 122.75 2w3r s ARG 148 Ca -0.03 -0.91 0.00 0.00 -0.13 0.00 0.00 55.73 54.66 2w3r s ARG 148 Cb -0.05 -2.49 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 2w3r s ARG 148 CO -0.02 -0.46 0.00 0.41 -0.81 0.00 0.00 175.30 174.42 2w3r n GLY 149 N 4.66 0.13 2.94 8.12 0.00 -1.26 -1.89 105.19 117.89 2w3r n GLY 149 Ca -0.14 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 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 4.48 0.12 1.61 -1.08 -1.26 -4.91 116.67 111.63 2w3r s ASP 150 Ca 0.00 -1.90 -0.17 0.00 -0.52 0.00 0.00 52.55 49.96 2w3r s ASP 150 Cb 0.00 -1.39 -0.03 0.00 -1.46 0.00 0.00 42.92 40.03 2w3r s ASP 150 CO 0.00 -0.37 1.63 -0.37 0.52 0.00 0.00 175.17 176.58 2w3r h VAL 151 N 6.59 1.21 -0.39 1.11 -1.51 -1.88 -2.73 116.25 118.65 2w3r h VAL 151 Ca -0.08 -0.70 0.08 0.00 -1.23 0.00 0.00 66.70 64.77 2w3r h VAL 151 Cb 1.02 1.02 -0.08 0.00 -2.13 0.00 0.00 31.29 31.13 2w3r h VAL 151 CO 0.50 0.24 -0.13 -0.08 -1.23 0.00 0.00 177.57 176.86 2w3r h GLU 152 N 0.40 -0.05 0.16 5.19 4.57 -1.99 0.97 114.58 123.83 2w3r h GLU 152 Ca 0.11 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.30 2w3r h GLU 152 Cb 0.26 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 2w3r h GLU 152 CO -0.00 -0.03 -0.23 1.15 -1.18 0.00 0.00 179.01 178.72 2w3r h THR 153 N -0.05 0.49 -0.63 0.32 2.02 -1.98 -2.03 112.91 111.05 2w3r h THR 153 Ca 0.19 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.37 2w3r h THR 153 Cb 0.34 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 2w3r h THR 153 CO -0.43 0.00 0.38 0.00 0.37 0.00 0.00 175.52 175.84 2w3r h ALA 154 N 0.29 0.80 -0.03 6.16 0.00 -1.07 -2.27 119.26 123.15 2w3r h ALA 154 Ca 0.02 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2w3r h ALA 154 Cb 0.45 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w3r h ALA 154 CO -0.10 0.27 -0.35 -0.07 0.00 0.00 0.00 179.25 179.01 2w3r h LEU 155 N 0.85 0.06 -0.61 0.00 3.38 -0.79 -0.95 115.31 117.24 2w3r h LEU 155 Ca 0.23 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 2w3r h LEU 155 Cb -0.03 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2w3r h LEU 155 CO -0.04 0.40 0.19 0.00 0.09 0.00 0.00 178.44 179.08 2w3r h ALA 156 N 1.60 0.80 -0.41 1.53 0.00 -0.79 -3.04 119.26 118.95 2w3r h ALA 156 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2w3r h ALA 156 Cb 0.64 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2w3r h ALA 156 CO 0.05 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.18 2w3r n GLY 157 N -0.71 1.42 3.72 0.00 0.00 -1.03 -4.97 105.19 103.61 2w3r n GLY 157 Ca 0.04 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.46 3.73 0.26 4.61 0.00 -0.39 -4.91 121.76 123.61 2w3r s ALA 158 Ca 0.38 1.30 0.02 0.00 0.00 0.00 0.00 51.96 53.66 2w3r s ALA 158 Cb 0.21 -3.61 0.35 0.00 0.00 0.00 0.00 23.12 20.07 2w3r s ALA 158 CO 0.29 -0.77 1.67 0.00 0.00 0.00 0.00 175.76 176.95 2w3r h ALA 159 N 6.91 1.01 -3.81 0.00 0.00 -1.84 -3.44 119.26 118.10 2w3r h ALA 159 Ca -0.42 -0.40 -0.41 0.00 0.00 0.00 0.00 54.91 53.68 2w3r h ALA 159 Cb 1.20 -0.11 -0.26 0.00 0.00 0.00 0.00 17.79 18.63 2w3r h ALA 159 CO 0.91 0.60 -0.78 -1.01 0.00 0.00 0.00 179.25 178.96 2w3r s HIS 160 N -4.31 1.00 -0.02 0.00 3.76 -1.09 -4.97 115.29 109.66 2w3r s HIS 160 Ca -0.06 -0.29 -0.07 0.00 -0.15 0.00 0.00 55.06 54.48 2w3r s HIS 160 Cb 0.13 -0.61 0.01 0.00 1.11 0.00 0.00 32.58 33.22 2w3r s HIS 160 CO 0.80 -0.00 0.16 -1.17 -0.85 0.00 0.00 174.74 173.68 2w3r s LEU 161 N -0.81 1.42 -0.04 0.89 0.20 -1.26 -1.10 118.68 117.97 2w3r s LEU 161 Ca 0.01 0.02 -0.02 0.00 0.69 0.00 0.00 54.13 54.83 2w3r s LEU 161 Cb -0.06 0.69 0.03 0.00 -0.43 0.00 0.00 46.19 46.42 2w3r s LEU 161 CO 0.00 -0.26 0.07 0.00 -0.29 0.00 0.00 176.35 175.88 2w3r s ALA 162 N -0.83 0.14 -0.07 5.97 0.00 -0.10 -4.95 121.76 121.92 2w3r s ALA 162 Ca -0.09 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.15 2w3r s ALA 162 Cb -0.05 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2w3r s ALA 162 CO 0.01 -0.44 -0.10 -1.21 0.00 0.00 0.00 175.76 174.02 2w3r s GLU 163 N 2.02 2.78 0.29 0.00 2.02 -1.26 -1.23 118.70 123.32 2w3r s GLU 163 Ca 0.03 -0.62 -0.19 0.00 0.02 0.00 0.00 54.97 54.20 2w3r s GLU 163 Cb -0.12 -2.53 0.06 0.00 0.10 0.00 0.00 34.13 31.64 2w3r s GLU 163 CO -0.03 0.57 0.88 0.20 0.02 0.00 0.00 175.26 176.89 2w3r s GLY 164 N -0.58 0.17 -0.29 -1.39 0.00 -0.67 -5.02 107.32 99.54 2w3r s GLY 164 Ca 0.08 -0.48 -0.16 0.00 0.00 0.00 0.00 44.72 44.17 2w3r s GLY 164 CO 0.02 0.58 0.81 0.00 0.00 0.00 0.00 173.10 174.51 2w3r s PHE 166 N 1.65 0.17 0.01 0.00 -0.00 -0.83 -4.99 117.98 113.98 2w3r s PHE 166 Ca -0.09 -0.47 -0.21 0.00 -0.00 0.00 0.00 56.93 56.16 2w3r s PHE 166 Cb -0.05 -0.11 -0.06 0.00 -0.00 0.00 0.00 43.02 42.80 2w3r s PHE 166 CO -0.18 -0.41 0.60 -1.21 -0.00 0.00 0.00 175.22 174.03 2w3r s GLU 167 N -2.80 4.31 -0.20 1.99 0.41 -1.26 -1.94 118.70 119.21 2w3r s GLU 167 Ca -0.03 0.75 0.01 0.00 -0.41 0.00 0.00 54.97 55.29 2w3r s GLU 167 Cb -0.00 -3.33 0.03 0.00 -1.78 0.00 0.00 34.13 29.05 2w3r s GLU 167 CO -0.05 0.40 -0.17 0.42 -0.49 0.00 0.00 175.26 175.36 2w3r s ILE 168 N -0.31 2.16 0.55 -1.63 1.01 0.15 -1.54 121.20 121.60 2w3r s ILE 168 Ca 0.31 -1.04 -0.15 0.00 0.00 0.00 0.00 60.65 59.77 2w3r s ILE 168 Cb -0.18 -1.98 -0.06 0.00 0.01 0.00 0.00 42.46 40.25 2w3r s ILE 168 CO 0.18 0.43 1.01 -0.83 0.00 0.00 0.00 174.94 175.73 2w3r s GLY 169 N 1.27 2.01 0.00 6.18 0.00 -1.14 0.34 107.32 115.97 2w3r s GLY 169 Ca 0.03 0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.93 2w3r s GLY 169 CO -0.11 0.47 0.00 0.61 0.00 0.00 0.00 173.10 174.07 2w3r n GLY 170 N -1.63 -2.05 3.55 0.20 0.00 -1.26 -4.65 105.19 99.34 2w3r n GLY 170 Ca 0.07 -1.46 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.45 0.70 -0.04 1.61 0.74 -1.25 -4.76 119.66 115.22 2w3r s GLN 171 Ca 0.00 1.01 -0.23 0.00 0.05 0.00 0.00 55.36 56.20 2w3r s GLN 171 Cb 0.00 0.24 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 2w3r s GLN 171 CO 0.00 -0.12 0.68 -2.00 -0.55 0.00 0.00 175.29 173.30 2w3r s GLU 172 N 0.96 4.42 0.10 1.67 2.56 -1.26 -0.79 118.70 126.36 2w3r s GLU 172 Ca -0.05 0.86 -0.29 0.00 0.00 0.00 0.00 54.97 55.49 2w3r s GLU 172 Cb -0.05 -3.41 -0.13 0.00 2.00 0.00 0.00 34.13 32.54 2w3r s GLU 172 CO -0.09 0.16 1.64 0.45 -0.56 0.00 0.00 175.26 176.87 2w3r h HIS 173 N 6.36 -0.72 -5.55 5.30 3.86 -1.96 -3.48 115.15 118.96 2w3r h HIS 173 Ca -0.42 0.00 -0.28 0.00 -1.16 0.00 0.00 60.37 58.51 2w3r h HIS 173 Cb 1.20 0.28 0.18 0.00 1.06 0.00 0.00 27.41 30.13 2w3r h HIS 173 CO 0.65 -0.40 -0.84 0.34 0.86 0.00 0.00 177.93 178.54 2w3r n PHE 174 N -5.39 -2.36 -2.29 2.45 7.35 -1.26 -5.00 117.46 110.96 2w3r n PHE 174 Ca -0.09 0.87 -0.41 0.00 -0.76 0.00 0.00 57.45 57.06 2w3r n PHE 174 Cb 0.30 -4.38 -0.03 0.00 0.35 0.00 0.00 39.48 35.72 2w3r n PHE 174 CO 0.00 0.00 0.00 1.52 -0.76 0.00 0.00 176.76 177.52 2w3r s TYR 175 N -3.39 3.32 0.27 -5.13 -0.85 -1.26 -4.96 117.35 105.35 2w3r s TYR 175 Ca 0.32 1.39 0.03 0.00 -0.52 0.00 0.00 57.07 58.28 2w3r s TYR 175 Cb -0.05 -3.51 0.37 0.00 0.38 0.00 0.00 41.96 39.15 2w3r s TYR 175 CO 0.74 -1.46 1.68 -0.07 -1.52 0.00 0.00 175.55 174.92 2w3r h LEU 176 N 4.76 0.45 -9.00 -3.49 -0.00 -1.86 -3.36 115.31 102.81 2w3r h LEU 176 Ca -0.46 -0.17 -0.61 0.00 -0.00 0.00 0.00 57.88 56.64 2w3r h LEU 176 Cb 1.22 -0.12 -0.12 0.00 -0.00 0.00 0.00 40.66 41.64 2w3r h LEU 176 CO 0.73 0.76 0.11 -0.70 -0.00 0.00 0.00 178.44 179.33 2w3r s GLU 177 N -4.34 4.11 0.40 1.13 2.12 -0.81 -5.08 118.70 116.23 2w3r s GLU 177 Ca -0.06 0.49 -0.07 0.00 0.36 0.00 0.00 54.97 55.69 2w3r s GLU 177 Cb 0.13 -3.64 0.10 0.00 0.26 0.00 0.00 34.13 30.98 2w3r s GLU 177 CO 0.79 -0.37 0.47 0.41 -0.54 0.00 0.00 175.26 176.02 2w3r n GLY 178 N 4.18 -1.75 3.75 -1.50 0.00 -1.26 -4.71 105.19 103.91 2w3r n GLY 178 Ca -0.02 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 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 -4.03 4.19 -0.20 1.61 -1.52 -1.26 -4.91 119.66 113.53 2w3r s GLN 179 Ca 0.28 2.45 -0.19 0.00 -1.95 0.00 0.00 55.36 55.95 2w3r s GLN 179 Cb -0.01 -3.06 0.05 0.00 -0.22 0.00 0.00 33.01 29.77 2w3r s GLN 179 CO 0.20 -0.52 0.54 0.00 -0.25 0.00 0.00 175.29 175.26 2w3r s ALA 180 N -0.12 -1.34 0.04 6.09 0.00 -1.26 -2.04 121.76 123.12 2w3r s ALA 180 Ca 0.60 1.50 -0.06 0.00 0.00 0.00 0.00 51.96 54.01 2w3r s ALA 180 Cb -0.45 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 2w3r s ALA 180 CO 0.47 -0.26 0.10 0.00 0.00 0.00 0.00 175.76 176.07 2w3r s ALA 181 N 0.22 -0.06 -0.10 0.00 0.00 -0.02 -0.42 121.76 121.38 2w3r s ALA 181 Ca -0.01 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.36 2w3r s ALA 181 Cb -0.04 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.39 2w3r s ALA 181 CO 0.01 -0.33 0.16 -1.17 0.00 0.00 0.00 175.76 174.44 2w3r s LEU 182 N -2.17 -0.06 -0.21 0.00 2.96 0.13 -1.05 118.68 118.27 2w3r s LEU 182 Ca -0.04 0.24 -0.07 0.00 -0.22 0.00 0.00 54.13 54.03 2w3r s LEU 182 Cb -0.01 0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.90 2w3r s LEU 182 CO -0.05 -0.26 0.07 0.00 -1.32 0.00 0.00 176.35 174.79 2w3r s ALA 183 N 2.29 3.28 -0.35 5.97 0.00 0.19 -1.00 121.76 132.14 2w3r s ALA 183 Ca 0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 2w3r s ALA 183 Cb -0.13 -2.00 0.09 0.00 0.00 0.00 0.00 23.12 21.09 2w3r s ALA 183 CO -0.06 -0.14 0.09 -0.51 0.00 0.00 0.00 175.76 175.13 2w3r s LEU 184 N 0.97 4.67 -0.11 0.00 1.43 0.59 -1.93 118.68 124.30 2w3r s LEU 184 Ca 0.04 -1.85 -0.31 0.00 -1.03 0.00 0.00 54.13 50.98 2w3r s LEU 184 Cb -0.14 -1.72 -0.09 0.00 0.03 0.00 0.00 46.19 44.27 2w3r s LEU 184 CO 0.03 -0.40 2.05 -0.81 0.23 0.00 0.00 176.35 177.45 2w3r n PRO 185 N 4.49 2.25 -3.94 1.29 -0.04 -1.26 -0.88 135.00 136.90 2w3r n PRO 185 Ca -0.04 0.76 -0.31 0.00 -0.04 0.00 0.00 63.50 63.87 2w3r n PRO 185 Cb 0.42 -2.94 -0.15 0.00 -0.04 0.00 0.00 33.50 30.79 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 5.88 2.55 0.00 0.55 0.00 -0.14 -4.94 121.76 125.66 2w3r s ALA 186 Ca 0.96 -2.32 0.00 0.00 0.00 0.00 0.00 51.96 50.60 2w3r s ALA 186 Cb -0.51 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 20.73 2w3r s ALA 186 CO 0.43 -1.69 0.00 -0.85 0.00 0.00 0.00 175.76 173.65 2w3r n GLU 187 N 4.39 0.00 0.00 0.00 0.28 -1.26 -1.58 120.64 122.47 2w3r n GLU 187 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.02 2w3r n GLU 187 Cb 0.42 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.29 2w3r n GLU 187 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2w3r n GLY 188 N 0.45 2.92 0.00 -1.84 0.00 -1.26 -4.97 105.19 100.49 2w3r n GLY 188 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 5.65 3.15 -0.02 0.00 -0.62 -5.07 105.19 108.28 2w3r n GLY 189 Ca 0.00 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.45 0.90 -0.19 1.61 -7.23 -0.76 -0.96 120.40 113.31 2w3r s VAL 190 Ca 0.00 -1.43 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 2w3r s VAL 190 Cb 0.00 -1.12 -0.01 0.00 0.56 0.00 0.00 36.38 35.80 2w3r s VAL 190 CO 0.00 -0.44 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.61 2w3r s VAL 191 N -1.92 3.46 -0.27 1.32 1.01 -0.06 -2.03 120.40 121.91 2w3r s VAL 191 Ca 0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 61.42 2w3r s VAL 191 Cb -0.06 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2w3r s VAL 191 CO 0.01 0.45 0.10 -0.63 0.00 0.00 0.00 175.10 175.03 2w3r s ILE 192 N 1.07 4.41 -0.15 2.22 -1.09 0.16 -0.30 121.20 127.53 2w3r s ILE 192 Ca 0.01 -0.26 -0.08 0.00 -2.23 0.00 0.00 60.65 58.10 2w3r s ILE 192 Cb -0.15 -3.13 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 2w3r s ILE 192 CO -0.00 0.24 0.12 -1.00 -1.23 0.00 0.00 174.94 173.07 2w3r s HIS 193 N 1.61 3.49 0.17 3.97 3.76 -0.17 -0.44 115.29 127.68 2w3r s HIS 193 Ca 0.06 0.42 -0.22 0.00 -0.15 0.00 0.00 55.06 55.16 2w3r s HIS 193 Cb -0.16 -2.00 0.06 0.00 1.11 0.00 0.00 32.58 31.59 2w3r s HIS 193 CO 0.05 0.55 0.60 0.00 -0.85 0.00 0.00 174.74 175.08 2w3r s SER 195 N -2.77 6.99 0.02 0.00 0.15 0.44 -4.71 113.70 113.83 2w3r s SER 195 Ca 0.02 -2.97 -0.03 0.00 0.70 0.00 0.00 55.95 53.68 2w3r s SER 195 Cb -0.01 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 62.01 2w3r s SER 195 CO -0.11 -0.57 0.03 -0.55 1.20 0.00 0.00 173.24 173.23 2w3r s SER 196 N 2.19 0.22 0.00 5.45 0.15 -1.26 -4.55 113.70 115.89 2w3r s SER 196 Ca 0.29 -0.51 0.25 0.00 0.70 0.00 0.00 55.95 56.67 2w3r s SER 196 Cb -0.08 0.16 0.42 0.00 -1.71 0.00 0.00 66.02 64.81 2w3r s SER 196 CO -0.07 -0.39 1.35 0.00 1.20 0.00 0.00 173.24 175.33 2w3r n GLN 197 N 1.22 0.47 -3.49 5.44 6.02 -0.39 -4.65 117.38 122.01 2w3r n GLN 197 Ca -0.22 -0.32 -0.28 0.00 -0.01 0.00 0.00 57.00 56.18 2w3r n GLN 197 Cb 0.57 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 30.22 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 -2.74 1.34 0.25 1.08 2.46 -1.26 -1.30 115.29 115.13 2w3r s HIS 198 Ca 0.16 -2.29 0.09 0.00 0.47 0.00 0.00 55.06 53.49 2w3r s HIS 198 Cb 0.18 -1.18 0.30 0.00 -0.13 0.00 0.00 32.58 31.74 2w3r s HIS 198 CO 0.64 -0.80 1.58 -1.35 -2.47 0.00 0.00 174.74 172.34 2w3r h PRO 199 N 6.00 0.06 -0.68 2.88 0.11 -1.91 -1.91 132.00 136.54 2w3r h PRO 199 Ca 0.19 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.19 2w3r h PRO 199 Cb 0.91 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 2w3r h PRO 199 CO 0.39 0.68 0.19 0.77 -0.21 0.00 0.00 178.00 179.82 2w3r h SER 200 N 0.05 1.01 -0.33 -2.05 0.02 -1.93 0.87 113.55 111.19 2w3r h SER 200 Ca -0.01 -0.22 -0.12 0.00 -0.84 0.00 0.00 61.79 60.60 2w3r h SER 200 Cb 1.14 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2w3r h SER 200 CO 0.09 0.96 -0.27 -0.08 -1.14 0.00 0.00 176.83 176.39 2w3r h GLU 201 N 1.00 0.77 -0.76 3.45 4.81 -1.83 -1.01 114.58 121.02 2w3r h GLU 201 Ca 0.22 -0.39 0.14 0.00 -0.13 0.00 0.00 59.36 59.20 2w3r h GLU 201 Cb 0.33 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.62 2w3r h GLU 201 CO -0.00 1.01 0.32 0.82 -0.73 0.00 0.00 179.01 180.43 2w3r h ILE 202 N 0.54 0.68 0.50 2.32 1.08 -1.06 0.62 117.51 122.19 2w3r h ILE 202 Ca 0.06 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.34 2w3r h ILE 202 Cb 0.84 0.16 0.00 0.00 -3.07 0.00 0.00 36.82 34.76 2w3r h ILE 202 CO 0.07 0.09 -0.24 -0.61 -0.69 0.00 0.00 178.15 176.77 2w3r h GLN 203 N 0.48 -0.65 -0.54 2.37 4.15 -0.63 -1.67 115.11 118.61 2w3r h GLN 203 Ca 0.42 0.04 0.11 0.00 0.77 0.00 0.00 58.65 59.99 2w3r h GLN 203 Cb 0.62 0.15 -0.10 0.00 0.21 0.00 0.00 27.48 28.36 2w3r h GLN 203 CO -0.39 -0.42 -0.08 1.25 -1.93 0.00 0.00 178.83 177.26 2w3r h HIS 204 N -0.69 -0.18 -0.17 3.99 2.76 -0.55 0.63 115.15 120.94 2w3r h HIS 204 Ca -0.07 0.05 -0.21 0.00 -2.20 0.00 0.00 60.37 57.93 2w3r h HIS 204 Cb 0.52 0.16 0.01 0.00 1.55 0.00 0.00 27.41 29.66 2w3r h HIS 204 CO -0.04 -0.19 -0.74 0.87 -1.30 0.00 0.00 177.93 176.53 2w3r h LYS 205 N 0.05 0.77 -0.41 5.26 1.79 -0.86 -2.25 116.57 120.91 2w3r h LYS 205 Ca 0.27 -0.60 -0.06 0.00 -2.18 0.00 0.00 60.65 58.08 2w3r h LYS 205 Cb 0.42 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 2w3r h LYS 205 CO -0.52 1.21 0.04 0.28 -1.08 0.00 0.00 179.45 179.39 2w3r h VAL 206 N 0.53 1.25 -0.51 0.50 2.07 -1.12 -1.91 116.25 117.07 2w3r h VAL 206 Ca -0.04 -0.93 0.08 0.00 0.82 0.00 0.00 66.70 66.63 2w3r h VAL 206 Cb 1.36 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 2w3r h VAL 206 CO 0.15 0.32 0.12 0.00 0.02 0.00 0.00 177.57 178.18 2w3r h ALA 207 N 0.92 0.58 -0.40 1.67 0.00 -0.80 -0.32 119.26 120.91 2w3r h ALA 207 Ca 0.12 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 207 Cb 0.41 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2w3r h ALA 207 CO 0.01 -0.29 -0.29 0.45 0.00 0.00 0.00 179.25 179.13 2w3r h HIS 208 N 0.26 1.01 0.00 0.00 -0.00 -1.34 0.13 115.15 115.20 2w3r h HIS 208 Ca 0.25 -0.26 -0.05 0.00 -0.00 0.00 0.00 60.37 60.31 2w3r h HIS 208 Cb 0.33 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 2w3r h HIS 208 CO -0.22 1.05 -0.24 0.00 -0.00 0.00 0.00 177.93 178.52 2w3r h ALA 209 N 0.93 1.13 -0.01 2.45 0.00 -0.94 -2.89 119.26 119.92 2w3r h ALA 209 Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2w3r h ALA 209 Cb 0.85 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2w3r h ALA 209 CO 0.07 0.30 -0.56 1.28 0.00 0.00 0.00 179.25 180.34 2w3r n LEU 210 N -3.56 1.88 -2.52 0.00 4.77 -0.17 -4.01 117.00 113.39 2w3r n LEU 210 Ca -0.01 -0.72 -0.16 0.00 -0.03 0.00 0.00 56.01 55.09 2w3r n LEU 210 Cb 0.38 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2w3r n LEU 210 CO 0.33 0.36 0.15 0.61 -1.33 0.00 0.00 177.39 177.52 2w3r n GLY 211 N 1.43 -0.05 3.38 -0.72 0.00 -0.32 -4.97 105.19 103.94 2w3r n GLY 211 Ca 0.08 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 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 -5.14 2.35 0.56 0.99 1.43 0.31 -5.03 118.68 114.14 2w3r s LEU 212 Ca 0.38 -0.77 -0.19 0.00 -1.03 0.00 0.00 54.13 52.51 2w3r s LEU 212 Cb -0.17 -1.14 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 2w3r s LEU 212 CO 0.46 0.14 1.14 0.00 0.23 0.00 0.00 176.35 178.32 2w3r s ALA 213 N -1.26 2.65 0.43 4.21 0.00 -1.26 -4.35 121.76 122.18 2w3r s ALA 213 Ca 0.15 0.81 0.17 0.00 0.00 0.00 0.00 51.96 53.09 2w3r s ALA 213 Cb -0.09 -3.37 1.08 0.00 0.00 0.00 0.00 23.12 20.74 2w3r s ALA 213 CO 0.07 -0.87 1.90 0.74 0.00 0.00 0.00 175.76 177.60 2w3r h PHE 214 N 1.03 0.48 0.00 0.00 -1.00 -1.93 -0.68 116.94 114.84 2w3r h PHE 214 Ca -0.50 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.30 2w3r h PHE 214 Cb 1.26 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.67 2w3r h PHE 214 CO 0.51 0.17 0.00 -2.39 -1.61 0.00 0.00 178.31 174.99 2w3r n HIS 215 N -4.48 0.00 0.23 -0.55 1.44 -1.26 -1.55 115.22 109.05 2w3r n HIS 215 Ca 0.16 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.93 2w3r n HIS 215 Cb 0.59 0.00 0.11 0.00 0.12 0.00 0.00 29.99 30.81 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 -0.88 2.54 -4.02 4.39 8.00 -0.26 -4.90 116.55 121.41 2w3r n ASP 216 Ca 0.09 -1.74 -0.31 0.00 0.71 0.00 0.00 54.79 53.53 2w3r n ASP 216 Cb 0.04 -0.12 -0.16 0.00 -0.02 0.00 0.00 41.12 40.86 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 -1.06 1.77 -0.19 2.53 1.01 -0.59 -1.83 120.40 122.03 2w3r s VAL 217 Ca 0.21 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 2w3r s VAL 217 Cb 0.13 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2w3r s VAL 217 CO 0.18 0.21 -0.02 -0.60 0.00 0.00 0.00 175.10 174.86 2w3r s ARG 218 N 1.35 3.58 -0.24 2.72 3.52 -0.86 -4.91 118.95 124.10 2w3r s ARG 218 Ca -0.01 -0.55 0.01 0.00 -0.13 0.00 0.00 55.73 55.05 2w3r s ARG 218 Cb -0.16 -3.00 0.04 0.00 -1.56 0.00 0.00 34.95 30.26 2w3r s ARG 218 CO -0.09 0.05 -0.10 0.08 -0.81 0.00 0.00 175.30 174.43 2w3r s VAL 219 N 0.88 2.46 -0.14 7.11 1.01 -1.26 0.38 120.40 130.84 2w3r s VAL 219 Ca 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 61.98 60.68 2w3r s VAL 219 Cb -0.14 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2w3r s VAL 219 CO 0.02 0.17 0.04 -1.61 0.00 0.00 0.00 175.10 173.71 2w3r s GLU 220 N 1.23 3.58 -0.16 2.72 2.02 0.41 -1.87 118.70 126.63 2w3r s GLU 220 Ca -0.02 -0.37 -0.04 0.00 0.02 0.00 0.00 54.97 54.56 2w3r s GLU 220 Cb -0.17 -3.04 0.07 0.00 0.10 0.00 0.00 34.13 31.09 2w3r s GLU 220 CO -0.06 0.45 0.14 1.41 0.02 0.00 0.00 175.26 177.22 2w3r s MET 221 N -0.16 0.09 -0.09 1.61 -2.45 0.85 -3.37 119.30 115.78 2w3r s MET 221 Ca 0.06 0.12 -0.06 0.00 -1.25 0.00 0.00 55.69 54.57 2w3r s MET 221 Cb -0.12 -1.35 -0.02 0.00 1.25 0.00 0.00 34.83 34.59 2w3r s MET 221 CO 0.02 -0.60 -0.11 -0.09 1.05 0.00 0.00 175.02 175.29 2w3r h ARG 222 N 8.38 0.00 -3.42 4.11 9.65 -1.84 0.14 114.38 131.40 2w3r h ARG 222 Ca -0.15 0.00 -0.14 0.00 -1.10 0.00 0.00 59.98 58.59 2w3r h ARG 222 Cb 1.14 0.00 -0.21 0.00 -1.39 0.00 0.00 29.97 29.52 2w3r h ARG 222 CO 0.26 0.00 -0.45 -0.98 2.80 0.00 0.00 179.97 181.60 2w3r s ARG 223 N -1.79 0.52 0.01 0.20 1.70 -1.26 -4.31 118.95 114.02 2w3r s ARG 223 Ca -0.09 -0.35 0.03 0.00 -0.47 0.00 0.00 55.73 54.85 2w3r s ARG 223 Cb 0.01 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 2w3r s ARG 223 CO 0.13 -0.13 -0.05 -1.64 -1.08 0.00 0.00 175.30 172.54 2w3r s MET 224 N -1.36 2.58 -0.84 3.89 -1.94 0.14 -4.71 119.30 117.07 2w3r s MET 224 Ca -0.14 -0.72 -0.05 0.00 -1.71 0.00 0.00 55.69 53.06 2w3r s MET 224 Cb -0.07 -2.53 0.03 0.00 2.01 0.00 0.00 34.83 34.27 2w3r s MET 224 CO 0.02 0.60 2.75 0.41 -0.01 0.00 0.00 175.02 178.79 2w3r n GLY 225 N 1.40 4.51 0.00 -0.03 0.00 -1.26 -4.40 105.19 105.41 2w3r n GLY 225 Ca -0.15 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.04 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 1.64 2.42 2.00 -0.02 0.00 -1.20 -1.93 105.19 108.09 2w3r n GLY 226 Ca 0.56 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 1.47 -0.30 2.56 -0.02 0.00 -1.26 -4.87 105.19 102.77 2w3r n GLY 227 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.25 -0.06 0.00 1.61 3.01 -1.26 -0.41 117.46 117.10 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 -3.12 0.00 0.00 -0.01 0.00 0.00 39.48 36.35 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 -0.17 3.36 0.00 1.37 0.00 -1.26 -0.79 105.19 107.70 2w3r n GLY 229 Ca -0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.58 -0.55 0.25 -0.02 0.00 0.45 -2.33 105.19 101.40 2w3r n GLY 230 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.11 0.75 0.06 1.61 5.02 -1.25 -4.39 118.16 118.86 2w3r n LYS 231 Ca 0.09 -1.89 -0.10 0.00 -2.02 0.00 0.00 58.31 54.39 2w3r n LYS 231 Cb 0.07 -1.07 0.03 0.00 -0.02 0.00 0.00 35.03 34.04 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 0.00 0.37 0.00 1.97 4.81 -1.82 -1.04 114.58 118.88 2w3r h GLU 232 Ca 0.00 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2w3r h GLU 232 Cb 1.16 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2w3r h GLU 232 CO 0.00 0.96 -0.19 -1.13 -0.73 0.00 0.00 179.01 177.93 2w3r n SER 233 N -3.82 0.91 0.30 1.04 3.41 -1.26 -4.51 113.62 109.69 2w3r n SER 233 Ca -0.04 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.77 2w3r n SER 233 Cb 0.72 0.08 1.06 0.00 -0.26 0.00 0.00 64.21 65.81 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 -1.80 -1.44 115.11 117.27 2w3r h GLN 234 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2w3r h GLN 234 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2w3r h GLN 234 CO 0.00 0.00 0.00 0.78 -0.95 0.00 0.00 178.83 178.66 2w3r h GLY 235 N 0.22 0.00 0.68 3.46 0.00 -1.83 -3.31 103.07 102.28 2w3r h GLY 235 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.40 2w3r h GLY 235 CO 0.00 0.00 0.47 3.43 0.00 0.00 0.00 176.54 180.44 2w3r h ASN 236 N 0.00 0.72 -0.61 0.19 -0.26 -1.58 -2.87 115.58 111.17 2w3r h ASN 236 Ca 0.00 0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.72 2w3r h ASN 236 Cb 0.56 -0.12 -0.03 0.00 -1.06 0.00 0.00 38.32 37.67 2w3r h ASN 236 CO 0.00 0.46 0.22 0.45 -1.06 0.00 0.00 177.43 177.49 2w3r h HIS 237 N 0.85 0.99 -0.11 1.19 3.86 -1.80 -1.65 115.15 118.48 2w3r h HIS 237 Ca 0.35 -0.08 -0.20 0.00 -1.16 0.00 0.00 60.37 59.28 2w3r h HIS 237 Cb 0.20 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.39 2w3r h HIS 237 CO -0.05 0.78 -0.71 -0.07 0.86 0.00 0.00 177.93 178.73 2w3r h LEU 238 N 0.94 0.82 -0.22 2.43 4.07 -1.76 -2.54 115.31 119.06 2w3r h LEU 238 Ca 0.21 -0.65 -0.01 0.00 0.08 0.00 0.00 57.88 57.51 2w3r h LEU 238 Cb 0.24 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 2w3r h LEU 238 CO -0.01 1.35 0.09 0.00 -1.08 0.00 0.00 178.44 178.78 2w3r h ALA 239 N 0.50 0.28 -0.28 1.53 0.00 -1.33 -0.27 119.26 119.69 2w3r h ALA 239 Ca -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2w3r h ALA 239 Cb 1.36 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2w3r h ALA 239 CO 0.15 -0.13 0.19 0.82 0.00 0.00 0.00 179.25 180.27 2w3r h ILE 240 N 0.20 1.07 -0.41 0.00 2.04 -1.39 -0.28 117.51 118.74 2w3r h ILE 240 Ca 0.07 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.83 2w3r h ILE 240 Cb 0.17 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2w3r h ILE 240 CO -0.01 0.07 0.21 0.00 0.00 0.00 0.00 178.15 178.43 2w3r h ALA 241 N 1.10 0.51 -0.18 1.87 0.00 -1.32 0.13 119.26 121.37 2w3r h ALA 241 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 241 Cb -0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2w3r h ALA 241 CO -0.02 -0.14 0.04 0.00 0.00 0.00 0.00 179.25 179.13 2w3r h ALA 243 N 0.85 0.77 -0.14 0.00 0.00 -0.80 0.84 119.26 120.78 2w3r h ALA 243 Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2w3r h ALA 243 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2w3r h ALA 243 CO 0.00 0.23 0.05 0.28 0.00 0.00 0.00 179.25 179.81 2w3r h VAL 244 N 0.82 1.15 -0.58 0.00 2.07 -0.69 -1.27 116.25 117.75 2w3r h VAL 244 Ca 0.22 -0.46 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 2w3r h VAL 244 Cb -0.05 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2w3r h VAL 244 CO -0.04 0.14 -0.01 0.00 0.02 0.00 0.00 177.57 177.67 2w3r h ALA 245 N 0.90 0.79 -0.66 1.67 0.00 -1.09 -2.35 119.26 118.50 2w3r h ALA 245 Ca 0.05 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 2w3r h ALA 245 Cb 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2w3r h ALA 245 CO -0.00 0.63 0.11 0.00 0.00 0.00 0.00 179.25 179.98 2w3r h ALA 246 N 0.97 0.88 0.19 0.00 0.00 -0.78 0.13 119.26 120.64 2w3r h ALA 246 Ca 0.16 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2w3r h ALA 246 Cb 0.57 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2w3r h ALA 246 CO 0.03 0.64 -0.29 -0.09 0.00 0.00 0.00 179.25 179.54 2w3r h ARG 247 N 1.02 -0.53 -0.44 0.00 2.43 -1.11 0.15 114.38 115.89 2w3r h ARG 247 Ca 0.20 0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 2w3r h ARG 247 Cb 0.44 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 2w3r h ARG 247 CO 0.01 -0.35 0.02 0.00 -1.51 0.00 0.00 179.97 178.13 2w3r h ALA 248 N 0.09 0.60 0.00 2.80 0.00 -1.19 -3.25 119.26 118.31 2w3r h ALA 248 Ca 0.01 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 2w3r h ALA 248 Cb 0.55 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2w3r h ALA 248 CO -0.13 0.38 -1.13 1.79 0.00 0.00 0.00 179.25 180.15 2w3r h THR 249 N 0.62 0.89 0.00 0.00 1.35 -0.77 -3.48 112.91 111.52 2w3r h THR 249 Ca 0.13 -2.45 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 2w3r h THR 249 Cb 0.47 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 2w3r h THR 249 CO 0.02 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 2w3r n GLY 250 N 1.37 0.75 3.62 5.82 0.00 0.51 -5.04 105.19 112.22 2w3r n GLY 250 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.12 2.23 0.24 1.61 0.52 -1.22 -4.95 118.95 117.26 2w3r s ARG 251 Ca 0.00 -1.22 -0.31 0.00 -0.52 0.00 0.00 55.73 53.68 2w3r s ARG 251 Cb 0.00 -2.24 -0.11 0.00 0.52 0.00 0.00 34.95 33.12 2w3r s ARG 251 CO 0.00 0.43 1.58 -2.14 0.02 0.00 0.00 175.30 175.19 2w3r s PRO 252 N -2.99 4.18 -0.10 3.54 0.02 -1.26 -4.31 135.00 134.08 2w3r s PRO 252 Ca 0.27 2.47 0.04 0.00 0.02 0.00 0.00 61.00 63.79 2w3r s PRO 252 Cb -0.09 -3.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.35 2w3r s PRO 252 CO 0.17 -0.60 -0.23 0.00 -0.33 0.00 0.00 177.00 176.01 2w3r s LYS 254 N 0.28 2.17 -0.05 0.00 2.20 0.64 -0.64 119.74 124.34 2w3r s LYS 254 Ca -0.16 -0.89 -0.01 0.00 -0.36 0.00 0.00 55.97 54.54 2w3r s LYS 254 Cb -0.17 -2.01 0.03 0.00 -1.51 0.00 0.00 37.83 34.17 2w3r s LYS 254 CO 0.08 0.49 0.03 1.41 -0.36 0.00 0.00 175.35 177.00 2w3r s MET 255 N -0.45 0.23 -0.02 4.03 1.75 -0.22 -1.06 119.30 123.56 2w3r s MET 255 Ca 0.06 0.23 0.03 0.00 -1.25 0.00 0.00 55.69 54.76 2w3r s MET 255 Cb -0.11 -0.66 -0.00 0.00 2.84 0.00 0.00 34.83 36.90 2w3r s MET 255 CO 0.00 -0.28 -0.11 -0.98 -0.65 0.00 0.00 175.02 173.00 2w3r s ARG 256 N 1.87 1.00 0.16 4.11 1.70 -1.26 -0.84 118.95 125.70 2w3r s ARG 256 Ca 0.02 -0.39 -0.30 0.00 -0.47 0.00 0.00 55.73 54.59 2w3r s ARG 256 Cb -0.12 -0.94 -0.07 0.00 -0.57 0.00 0.00 34.95 33.24 2w3r s ARG 256 CO -0.04 0.20 1.12 0.71 -1.08 0.00 0.00 175.30 176.22 2w3r s TYR 257 N -0.10 3.55 0.54 5.89 4.12 -0.86 -5.00 117.35 125.50 2w3r s TYR 257 Ca 0.01 1.55 -0.20 0.00 0.02 0.00 0.00 57.07 58.46 2w3r s TYR 257 Cb -0.06 -3.31 -0.06 0.00 -1.52 0.00 0.00 41.96 37.01 2w3r s TYR 257 CO 0.00 -0.74 1.14 0.34 0.02 0.00 0.00 175.55 176.30 2w3r s ASP 258 N 0.05 5.69 0.27 2.29 -1.08 -1.26 -4.72 116.67 117.92 2w3r s ASP 258 Ca 0.51 2.20 0.01 0.00 -0.52 0.00 0.00 52.55 54.75 2w3r s ASP 258 Cb -0.30 -2.58 0.62 0.00 -1.46 0.00 0.00 42.92 39.20 2w3r s ASP 258 CO 0.35 -1.24 1.73 -0.09 0.52 0.00 0.00 175.17 176.43 2w3r h ARG 259 N 1.20 0.48 0.28 4.34 9.65 -1.96 0.39 114.38 128.76 2w3r h ARG 259 Ca -0.50 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 2w3r h ARG 259 Cb 1.26 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 2w3r h ARG 259 CO 0.57 0.32 -0.13 -0.44 2.80 0.00 0.00 179.97 183.08 2w3r h ASP 260 N 0.49 -0.32 -0.21 -3.80 3.45 -1.93 -1.96 116.42 112.15 2w3r h ASP 260 Ca 0.50 -0.02 0.05 0.00 0.43 0.00 0.00 57.03 58.00 2w3r h ASP 260 Cb 0.85 0.08 -0.05 0.00 -0.56 0.00 0.00 39.33 39.65 2w3r h ASP 260 CO -0.45 -0.19 -0.11 0.44 -1.57 0.00 0.00 179.24 177.36 2w3r h ASP 261 N -0.42 -0.35 -0.21 6.45 5.19 -1.58 -2.45 116.42 123.04 2w3r h ASP 261 Ca -0.04 0.08 0.04 0.00 -0.62 0.00 0.00 57.03 56.50 2w3r h ASP 261 Cb 0.32 0.19 -0.07 0.00 0.18 0.00 0.00 39.33 39.95 2w3r h ASP 261 CO 0.06 -0.14 -0.50 -0.78 -3.12 0.00 0.00 179.24 174.76 2w3r h ASP 262 N -0.09 -1.62 0.21 6.45 3.58 -0.14 0.13 116.42 124.95 2w3r h ASP 262 Ca 0.11 0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.73 2w3r h ASP 262 Cb 0.26 0.65 -0.01 0.00 1.72 0.00 0.00 39.33 41.95 2w3r h ASP 262 CO -0.26 -0.45 -0.20 0.24 -2.88 0.00 0.00 179.24 175.70 2w3r h MET 263 N -0.50 0.00 0.21 0.28 2.86 -1.28 -0.86 114.93 115.64 2w3r h MET 263 Ca 0.06 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.39 2w3r h MET 263 Cb 0.65 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.33 2w3r h MET 263 CO -0.47 0.20 -1.43 0.28 1.06 0.00 0.00 176.91 176.54 2w3r h VAL 264 N 0.00 1.22 0.05 -2.22 2.07 -0.90 -3.39 116.25 113.08 2w3r h VAL 264 Ca -0.00 -2.60 -0.00 0.00 0.82 0.00 0.00 66.70 64.91 2w3r h VAL 264 Cb 0.35 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2w3r h VAL 264 CO 0.03 0.80 -0.02 0.40 0.02 0.00 0.00 177.57 178.79 2w3r h ILE 265 N 0.01 1.07 -3.90 4.57 2.04 -0.64 -3.44 117.51 117.22 2w3r h ILE 265 Ca -0.26 -1.62 -0.45 0.00 1.00 0.00 0.00 64.86 63.53 2w3r h ILE 265 Cb 2.03 1.95 0.16 0.00 -0.74 0.00 0.00 36.82 40.22 2w3r h ILE 265 CO 0.22 0.34 0.20 0.42 0.00 0.00 0.00 178.15 179.33 2w3r s THR 266 N -2.48 1.99 0.77 -0.27 -4.23 -0.34 -4.74 115.64 106.33 2w3r s THR 266 Ca -0.12 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.31 2w3r s THR 266 Cb -0.01 -2.54 0.17 0.00 1.34 0.00 0.00 72.50 71.46 2w3r s THR 266 CO 0.46 0.00 1.04 0.61 -0.54 0.00 0.00 174.62 176.19 2w3r n GLY 267 N -1.27 -0.41 3.44 3.99 0.00 -1.26 -4.73 105.19 104.96 2w3r n GLY 267 Ca 0.06 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.06 2w3r n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3r s LYS 268 N -5.22 1.87 0.34 1.61 1.02 -1.26 -4.78 119.74 113.32 2w3r s LYS 268 Ca 0.63 -1.81 -0.29 0.00 0.02 0.00 0.00 55.97 54.53 2w3r s LYS 268 Cb -0.03 0.42 -0.10 0.00 -0.52 0.00 0.00 37.83 37.60 2w3r s LYS 268 CO 0.43 -0.76 1.37 0.50 -0.92 0.00 0.00 175.35 175.98 2w3r s ARG 269 N -3.15 4.28 -0.16 1.68 3.52 0.03 -1.78 118.95 123.37 2w3r s ARG 269 Ca 0.33 2.33 -0.29 0.00 -0.13 0.00 0.00 55.73 57.96 2w3r s ARG 269 Cb 0.00 -3.04 -0.05 0.00 -1.56 0.00 0.00 34.95 30.30 2w3r s ARG 269 CO 0.22 -0.30 1.95 -1.01 -0.81 0.00 0.00 175.30 175.34 2w3r s HIS 270 N -1.05 1.52 0.46 5.12 3.76 -1.26 -3.78 115.29 120.05 2w3r s HIS 270 Ca 0.51 0.28 -0.22 0.00 -0.15 0.00 0.00 55.06 55.49 2w3r s HIS 270 Cb -0.42 -4.04 -0.09 0.00 1.11 0.00 0.00 32.58 29.14 2w3r s HIS 270 CO 0.55 -4.06 1.05 0.16 -0.85 0.00 0.00 174.74 171.59 2w3r s ASP 271 N 5.94 6.47 0.08 1.40 -4.77 -1.26 -4.66 116.67 119.87 2w3r s ASP 271 Ca 0.87 1.98 0.06 0.00 -3.30 0.00 0.00 52.55 52.16 2w3r s ASP 271 Cb -0.32 -2.57 -0.03 0.00 -1.09 0.00 0.00 42.92 38.91 2w3r s ASP 271 CO 0.35 -0.69 -0.15 -0.36 0.70 0.00 0.00 175.17 175.01 2w3r s PHE 272 N -1.85 1.34 -0.14 2.11 0.08 0.15 -1.93 117.98 117.73 2w3r s PHE 272 Ca 0.64 -0.47 -0.01 0.00 0.12 0.00 0.00 56.93 57.22 2w3r s PHE 272 Cb -0.19 -0.74 -0.01 0.00 -0.57 0.00 0.00 43.02 41.51 2w3r s PHE 272 CO 0.23 0.10 -0.12 0.50 -0.10 0.00 0.00 175.22 175.82 2w3r s ARG 273 N -1.90 3.37 -0.22 0.44 3.52 0.10 0.30 118.95 124.57 2w3r s ARG 273 Ca 0.01 -0.68 0.01 0.00 -0.13 0.00 0.00 55.73 54.94 2w3r s ARG 273 Cb -0.09 -2.68 0.05 0.00 -1.56 0.00 0.00 34.95 30.67 2w3r s ARG 273 CO 0.03 0.14 -0.09 0.42 -0.81 0.00 0.00 175.30 174.98 2w3r s ILE 274 N 0.54 1.72 -0.05 4.11 1.01 -0.82 -0.53 121.20 127.18 2w3r s ILE 274 Ca -0.08 -1.18 -0.10 0.00 0.00 0.00 0.00 60.65 59.30 2w3r s ILE 274 Cb -0.16 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 2w3r s ILE 274 CO 0.04 0.08 0.26 -0.60 0.00 0.00 0.00 174.94 174.71 2w3r s ARG 275 N 1.34 3.63 -0.03 2.79 3.52 -0.75 -1.97 118.95 127.49 2w3r s ARG 275 Ca -0.04 0.07 -0.07 0.00 -0.13 0.00 0.00 55.73 55.56 2w3r s ARG 275 Cb -0.17 -3.18 0.01 0.00 -1.56 0.00 0.00 34.95 30.05 2w3r s ARG 275 CO -0.07 0.72 0.15 1.52 -0.81 0.00 0.00 175.30 176.81 2w3r s TYR 276 N -1.10 -0.06 -0.12 5.12 -0.85 -0.14 -0.89 117.35 119.31 2w3r s TYR 276 Ca 0.21 0.12 -0.01 0.00 -0.52 0.00 0.00 57.07 56.87 2w3r s TYR 276 Cb -0.14 0.00 0.03 0.00 0.38 0.00 0.00 41.96 42.23 2w3r s TYR 276 CO 0.10 -0.20 -0.06 1.03 -1.52 0.00 0.00 175.55 174.90 2w3r s ARG 277 N -0.73 1.38 -0.04 -3.49 0.52 0.10 -1.68 118.95 115.01 2w3r s ARG 277 Ca -0.08 -0.25 0.04 0.00 -0.52 0.00 0.00 55.73 54.92 2w3r s ARG 277 Cb -0.05 -1.58 -0.00 0.00 0.52 0.00 0.00 34.95 33.84 2w3r s ARG 277 CO 0.01 -0.30 -0.15 -1.50 0.02 0.00 0.00 175.30 173.37 2w3r s ILE 278 N 1.73 1.31 0.07 1.52 2.07 -0.36 -0.07 121.20 127.47 2w3r s ILE 278 Ca 0.04 -0.64 0.08 0.00 -1.41 0.00 0.00 60.65 58.72 2w3r s ILE 278 Cb -0.13 -1.13 -0.03 0.00 0.13 0.00 0.00 42.46 41.30 2w3r s ILE 278 CO -0.08 0.38 -0.22 -0.83 -1.91 0.00 0.00 174.94 172.28 2w3r s GLY 279 N 0.11 1.25 0.22 1.50 0.00 -0.41 -0.93 107.32 109.06 2w3r s GLY 279 Ca -0.05 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.49 2w3r s GLY 279 CO 0.02 -1.15 0.04 0.00 0.00 0.00 0.00 173.10 172.01 2w3r s ALA 280 N -0.95 1.56 0.78 3.20 0.00 -0.26 -0.88 121.76 125.21 2w3r s ALA 280 Ca 0.08 -1.73 -0.11 0.00 0.00 0.00 0.00 51.96 50.20 2w3r s ALA 280 Cb -0.09 0.76 0.06 0.00 0.00 0.00 0.00 23.12 23.85 2w3r s ALA 280 CO 0.03 -0.37 1.09 0.34 0.00 0.00 0.00 175.76 176.84 2w3r s ASP 281 N -3.25 4.57 0.58 0.00 -1.08 0.52 -2.68 116.67 115.32 2w3r s ASP 281 Ca 0.30 1.48 0.35 0.00 -0.52 0.00 0.00 52.55 54.17 2w3r s ASP 281 Cb 0.07 -2.24 1.71 0.00 -1.46 0.00 0.00 42.92 41.00 2w3r s ASP 281 CO 0.09 -1.95 2.12 0.00 0.52 0.00 0.00 175.17 175.95 2w3r h ALA 282 N -1.07 1.07 0.00 3.66 0.00 -1.93 -0.82 119.26 120.16 2w3r h ALA 282 Ca -0.46 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2w3r h ALA 282 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2w3r h ALA 282 CO 0.57 0.05 -0.86 -1.13 0.00 0.00 0.00 179.25 177.88 2w3r n SER 283 N -3.23 0.72 0.00 0.00 3.41 -1.26 -4.97 113.62 108.29 2w3r n SER 283 Ca -0.01 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2w3r n SER 283 Cb 0.22 0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 2w3r n SER 283 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w3r n GLY 284 N 1.29 1.42 3.72 5.00 0.00 -0.31 -5.09 105.19 111.22 2w3r n GLY 284 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.38 4.17 0.34 1.61 -0.14 -1.26 -4.28 119.74 119.80 2w3r s LYS 285 Ca 0.00 2.48 -0.29 0.00 -1.36 0.00 0.00 55.97 56.81 2w3r s LYS 285 Cb 0.00 -3.10 -0.11 0.00 -1.68 0.00 0.00 37.83 32.94 2w3r s LYS 285 CO 0.00 -0.66 1.52 -0.51 -0.76 0.00 0.00 175.35 174.94 2w3r s LEU 286 N 0.86 4.33 -0.21 3.17 1.43 -1.26 0.19 118.68 127.19 2w3r s LEU 286 Ca 0.70 3.00 -0.13 0.00 -1.03 0.00 0.00 54.13 56.67 2w3r s LEU 286 Cb -0.47 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.01 2w3r s LEU 286 CO 0.34 -0.88 -0.30 0.18 0.23 0.00 0.00 176.35 175.92 2w3r n LEU 287 N 1.14 1.71 -3.84 1.79 4.77 -0.06 -4.52 117.00 118.00 2w3r n LEU 287 Ca 0.04 0.29 -0.09 0.00 -0.03 0.00 0.00 56.01 56.22 2w3r n LEU 287 Cb 0.39 -0.69 -0.07 0.00 -2.33 0.00 0.00 43.42 40.71 2w3r n LEU 287 CO 0.63 0.25 -0.07 -0.83 -1.33 0.00 0.00 177.39 176.04 2w3r s GLY 288 N -5.24 0.05 -0.13 -0.72 0.00 -1.20 -2.00 107.32 98.08 2w3r s GLY 288 Ca -0.31 -0.53 -0.04 0.00 0.00 0.00 0.00 44.72 43.84 2w3r s GLY 288 CO 0.40 -0.72 0.24 0.00 0.00 0.00 0.00 173.10 173.02 2w3r s ALA 289 N -3.71 -0.45 -0.18 3.20 0.00 0.37 -1.29 121.76 119.71 2w3r s ALA 289 Ca 0.04 0.77 -0.04 0.00 0.00 0.00 0.00 51.96 52.72 2w3r s ALA 289 Cb 0.04 -1.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 2w3r s ALA 289 CO -0.10 -0.71 -0.02 0.34 0.00 0.00 0.00 175.76 175.27 2w3r s ASP 290 N 2.39 4.76 0.01 0.00 2.15 0.90 -1.44 116.67 125.44 2w3r s ASP 290 Ca 0.03 -0.19 0.06 0.00 0.43 0.00 0.00 52.55 52.88 2w3r s ASP 290 Cb -0.13 -1.80 -0.02 0.00 -0.30 0.00 0.00 42.92 40.68 2w3r s ASP 290 CO -0.09 0.10 -0.19 -0.36 -0.17 0.00 0.00 175.17 174.46 2w3r s PHE 291 N 0.77 1.69 -0.18 -5.34 0.40 0.64 -0.72 117.98 115.25 2w3r s PHE 291 Ca -0.01 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 55.99 2w3r s PHE 291 Cb -0.14 -1.05 0.03 0.00 0.51 0.00 0.00 43.02 42.37 2w3r s PHE 291 CO 0.02 0.02 -0.12 0.08 0.70 0.00 0.00 175.22 175.93 2w3r s VAL 292 N -0.62 1.60 -0.32 -0.44 1.01 -0.07 -1.37 120.40 120.21 2w3r s VAL 292 Ca 0.07 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 2w3r s VAL 292 Cb -0.08 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2w3r s VAL 292 CO 0.00 0.29 0.24 -1.00 0.00 0.00 0.00 175.10 174.64 2w3r s HIS 293 N 1.44 3.23 -0.31 5.22 3.76 -0.29 -1.81 115.29 126.53 2w3r s HIS 293 Ca 0.01 -0.07 -0.08 0.00 -0.15 0.00 0.00 55.06 54.77 2w3r s HIS 293 Cb -0.15 -2.46 0.01 0.00 1.11 0.00 0.00 32.58 31.09 2w3r s HIS 293 CO -0.09 -0.30 0.12 -0.51 -0.85 0.00 0.00 174.74 173.11 2w3r s LEU 294 N 1.77 4.05 -0.08 0.89 1.43 0.31 0.54 118.68 127.58 2w3r s LEU 294 Ca 0.07 -0.69 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 2w3r s LEU 294 Cb -0.17 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 2w3r s LEU 294 CO 0.11 -0.22 -0.20 0.00 0.23 0.00 0.00 176.35 176.27 2w3r s ALA 295 N 1.54 2.37 -0.32 4.21 0.00 -0.39 0.02 121.76 129.20 2w3r s ALA 295 Ca 0.03 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.78 2w3r s ALA 295 Cb -0.17 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.05 2w3r s ALA 295 CO 0.04 0.37 0.79 0.50 0.00 0.00 0.00 175.76 177.46 2w3r s ARG 296 N -0.01 3.93 -0.06 0.00 3.52 -0.81 -1.33 118.95 124.18 2w3r s ARG 296 Ca -0.06 0.55 0.20 0.00 -0.13 0.00 0.00 55.73 56.28 2w3r s ARG 296 Cb -0.15 -3.74 -0.30 0.00 -1.56 0.00 0.00 34.95 29.20 2w3r s ARG 296 CO 0.05 -0.71 0.38 0.00 -0.81 0.00 0.00 175.30 174.20 2w3r n GLY 298 N 1.43 -1.87 0.23 0.00 0.00 -1.26 -0.52 105.19 103.21 2w3r n GLY 298 Ca -0.09 -1.61 -0.07 0.00 0.00 0.00 0.00 46.02 44.24 2w3r n GLY 298 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2w3r h TRP 299 N 0.00 0.70 -2.35 1.61 5.08 -0.26 -2.99 115.95 117.73 2w3r h TRP 299 Ca 0.00 -0.20 -0.60 0.00 1.08 0.00 0.00 58.89 59.18 2w3r h TRP 299 Cb 0.00 -0.15 -0.13 0.00 -3.00 0.00 0.00 29.16 25.88 2w3r h TRP 299 CO 0.00 0.88 -0.73 -1.54 -1.28 0.00 0.00 178.44 175.78 2w3r s SER 300 N -6.84 3.91 0.08 0.11 1.04 -1.26 -4.91 113.70 105.83 2w3r s SER 300 Ca -0.08 -0.87 -0.36 0.00 0.48 0.00 0.00 55.95 55.13 2w3r s SER 300 Cb 0.12 -0.49 -0.18 0.00 0.10 0.00 0.00 66.02 65.57 2w3r s SER 300 CO 0.83 0.04 1.58 0.00 0.98 0.00 0.00 173.24 176.66 2w3r h ALA 301 N 2.29 -1.16 -0.73 5.32 0.00 -1.90 -3.44 119.26 119.64 2w3r h ALA 301 Ca -0.42 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2w3r h ALA 301 Cb 1.25 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2w3r h ALA 301 CO 0.59 -1.18 0.00 -3.47 0.00 0.00 0.00 179.25 175.19 2w3r n ASP 302 N -5.59 0.00 -0.80 0.00 -0.08 -1.26 -1.93 116.55 106.89 2w3r n ASP 302 Ca -0.14 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.17 2w3r n ASP 302 Cb 0.47 0.00 0.20 0.00 2.34 0.00 0.00 41.12 44.14 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 3.46 -0.04 -2.67 4.77 -1.26 -3.87 117.00 117.40 2w3r n LEU 303 Ca 0.00 -3.55 -0.05 0.00 -0.03 0.00 0.00 56.01 52.38 2w3r n LEU 303 Cb 0.00 -0.56 0.15 0.00 -2.33 0.00 0.00 43.42 40.68 2w3r n LEU 303 CO 0.00 1.09 0.75 0.28 -1.33 0.00 0.00 177.39 178.18 2w3r h SER 304 N 0.98 0.64 0.79 -1.43 0.02 -1.61 -2.18 113.55 110.76 2w3r h SER 304 Ca 0.09 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 2w3r h SER 304 Cb 1.36 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 63.74 2w3r h SER 304 CO 0.21 0.84 -0.38 0.25 -1.14 0.00 0.00 176.83 176.60 2w3r h LEU 305 N 0.57 -0.90 -1.20 5.07 6.46 -1.86 -1.81 115.31 121.63 2w3r h LEU 305 Ca 0.09 0.02 -0.08 0.00 -0.12 0.00 0.00 57.88 57.78 2w3r h LEU 305 Cb 0.66 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.81 2w3r h LEU 305 CO 0.05 -0.61 -0.38 1.55 -0.62 0.00 0.00 178.44 178.43 2w3r h PRO 306 N -1.14 0.03 0.35 5.25 0.13 -1.94 -1.89 132.00 132.80 2w3r h PRO 306 Ca -0.11 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 2w3r h PRO 306 Cb 0.83 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.95 2w3r h PRO 306 CO 0.18 0.41 -0.22 0.28 -0.23 0.00 0.00 178.00 178.42 2w3r h VAL 307 N 0.03 0.53 -0.21 1.56 2.07 -1.34 -1.39 116.25 117.50 2w3r h VAL 307 Ca -0.00 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 2w3r h VAL 307 Cb 0.69 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2w3r h VAL 307 CO 0.05 0.00 -0.25 0.00 0.02 0.00 0.00 177.57 177.39 2w3r h ASP 309 N 0.35 -0.85 -0.07 0.00 3.32 -1.19 -0.69 116.42 117.29 2w3r h ASP 309 Ca 0.05 0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 2w3r h ASP 309 Cb 0.64 0.39 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 2w3r h ASP 309 CO 0.05 -0.30 -0.05 -0.09 -1.72 0.00 0.00 179.24 177.13 2w3r h ARG 310 N -0.28 0.28 -0.52 3.56 2.43 -0.54 0.38 114.38 119.70 2w3r h ARG 310 Ca 0.13 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2w3r h ARG 310 Cb 0.49 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 2w3r h ARG 310 CO -0.40 0.35 0.30 0.00 -1.51 0.00 0.00 179.97 178.72 2w3r h ALA 311 N 1.68 0.66 -0.31 2.80 0.00 -0.65 -2.34 119.26 121.11 2w3r h ALA 311 Ca 0.06 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2w3r h ALA 311 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2w3r h ALA 311 CO 0.01 0.16 -0.01 0.52 0.00 0.00 0.00 179.25 179.93 2w3r h MET 312 N 0.69 0.55 -0.75 0.00 2.86 -0.24 -2.15 114.93 115.89 2w3r h MET 312 Ca 0.18 -0.18 0.16 0.00 -2.06 0.00 0.00 59.70 57.80 2w3r h MET 312 Cb 0.01 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.57 2w3r h MET 312 CO -0.03 0.70 0.51 -0.07 1.06 0.00 0.00 176.91 179.08 2w3r h LEU 313 N 0.35 0.34 -2.05 1.22 4.07 -0.85 -2.29 115.31 116.10 2w3r h LEU 313 Ca 0.09 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2w3r h LEU 313 Cb 0.46 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.15 2w3r h LEU 313 CO 0.02 0.17 0.00 1.41 -1.08 0.00 0.00 178.44 178.96 2w3r n HIS 314 N -4.46 0.23 0.42 1.13 8.25 -0.89 -4.44 115.22 115.45 2w3r n HIS 314 Ca 0.15 -0.14 0.03 0.00 -0.26 0.00 0.00 57.72 57.50 2w3r n HIS 314 Cb 0.57 -0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.83 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 1.19 1.74 0.62 -1.41 0.00 -0.82 -0.92 120.51 120.90 2w3r n ALA 315 Ca 0.14 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.66 2w3r n ALA 315 Cb 0.52 -1.08 0.04 0.00 0.00 0.00 0.00 19.45 18.92 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 -0.88 0.63 0.00 0.00 5.75 -1.26 -4.56 116.55 116.22 2w3r n ASP 316 Ca 0.04 -0.25 0.00 0.00 -0.01 0.00 0.00 54.79 54.57 2w3r n ASP 316 Cb 0.02 0.74 0.00 0.00 -1.03 0.00 0.00 41.12 40.85 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 1.38 3.60 1.21 6.12 0.00 -0.10 -2.09 105.19 115.31 2w3r n GLY 317 Ca 0.02 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 6.26 4.43 -4.16 1.61 7.64 -1.26 -4.60 113.62 123.54 2w3r n SER 318 Ca 0.00 -3.02 -0.26 0.00 1.01 0.00 0.00 58.87 56.60 2w3r n SER 318 Cb 0.00 -0.59 -0.16 0.00 -1.01 0.00 0.00 64.21 62.45 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 -2.83 1.77 -0.05 1.43 1.51 -0.89 -3.19 117.35 115.11 2w3r s TYR 319 Ca 0.46 -0.47 -0.30 0.00 -1.01 0.00 0.00 57.07 55.76 2w3r s TYR 319 Cb 0.37 -1.17 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 2w3r s TYR 319 CO 0.11 -0.13 1.14 0.12 -1.11 0.00 0.00 175.55 175.67 2w3r s PHE 320 N -0.10 3.33 -0.19 2.71 5.36 -0.98 -4.87 117.98 123.23 2w3r s PHE 320 Ca -0.01 1.35 -0.00 0.00 -0.96 0.00 0.00 56.93 57.31 2w3r s PHE 320 Cb -0.11 -3.34 0.05 0.00 -0.34 0.00 0.00 43.02 39.28 2w3r s PHE 320 CO 0.02 -0.96 -0.04 0.08 -1.46 0.00 0.00 175.22 172.86 2w3r s VAL 321 N 1.93 1.16 0.26 3.12 1.01 -1.26 -4.78 120.40 121.85 2w3r s VAL 321 Ca 0.54 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 2w3r s VAL 321 Cb -0.23 -1.43 0.24 0.00 0.00 0.00 0.00 36.38 34.96 2w3r s VAL 321 CO 0.22 -0.01 1.79 -0.65 0.00 0.00 0.00 175.10 176.46 2w3r h PRO 322 N 8.08 0.74 -4.52 2.72 0.11 -1.79 -3.39 132.00 133.94 2w3r h PRO 322 Ca -0.21 -0.04 -0.54 0.00 0.11 0.00 0.00 66.00 65.32 2w3r h PRO 322 Cb 1.10 -0.17 -0.35 0.00 0.11 0.00 0.00 31.00 31.70 2w3r h PRO 322 CO 0.40 0.49 -0.82 0.00 -0.21 0.00 0.00 178.00 177.86 2w3r s ALA 323 N -5.98 1.39 -0.20 -0.75 0.00 -0.85 -4.53 121.76 110.84 2w3r s ALA 323 Ca -0.12 -0.53 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 2w3r s ALA 323 Cb 0.21 -0.72 0.08 0.00 0.00 0.00 0.00 23.12 22.70 2w3r s ALA 323 CO 0.79 -0.06 0.45 -1.17 0.00 0.00 0.00 175.76 175.77 2w3r s LEU 324 N 0.99 -0.56 -0.01 0.00 0.20 -0.79 -0.48 118.68 118.04 2w3r s LEU 324 Ca -0.08 1.05 0.06 0.00 0.69 0.00 0.00 54.13 55.84 2w3r s LEU 324 Cb -0.15 1.49 -0.02 0.00 -0.43 0.00 0.00 46.19 47.09 2w3r s LEU 324 CO -0.00 -0.22 -0.18 -0.60 -0.29 0.00 0.00 176.35 175.05 2w3r s ARG 325 N 2.26 1.44 -0.03 1.98 3.52 -0.52 -1.50 118.95 126.09 2w3r s ARG 325 Ca -0.05 -0.68 0.04 0.00 -0.13 0.00 0.00 55.73 54.91 2w3r s ARG 325 Cb -0.11 -1.41 -0.01 0.00 -1.56 0.00 0.00 34.95 31.87 2w3r s ARG 325 CO -0.14 0.38 -0.16 0.42 -0.81 0.00 0.00 175.30 175.00 2w3r s ILE 326 N -0.48 1.29 -0.31 4.11 1.01 -0.82 -0.26 121.20 125.74 2w3r s ILE 326 Ca 0.07 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 60.08 2w3r s ILE 326 Cb -0.07 -1.10 0.09 0.00 0.01 0.00 0.00 42.46 41.39 2w3r s ILE 326 CO -0.00 0.37 0.03 -0.70 0.00 0.00 0.00 174.94 174.64 2w3r s GLU 327 N -0.11 1.42 -0.34 2.79 2.12 -0.47 -1.74 118.70 122.37 2w3r s GLU 327 Ca 0.00 -1.52 -0.14 0.00 0.36 0.00 0.00 54.97 53.67 2w3r s GLU 327 Cb -0.09 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.46 2w3r s GLU 327 CO 0.01 -0.86 0.29 0.45 -0.54 0.00 0.00 175.26 174.61 2w3r s SER 328 N 1.15 6.11 -0.29 -1.70 0.15 0.82 -1.14 113.70 118.80 2w3r s SER 328 Ca 0.06 -0.30 -0.11 0.00 0.70 0.00 0.00 55.95 56.30 2w3r s SER 328 Cb -0.19 -2.16 -0.04 0.00 -1.71 0.00 0.00 66.02 61.92 2w3r s SER 328 CO -0.11 -0.27 0.19 -1.00 1.20 0.00 0.00 173.24 173.25 2w3r s HIS 329 N 1.86 3.21 -0.97 3.44 3.76 0.19 -1.04 115.29 125.73 2w3r s HIS 329 Ca 0.09 -0.00 -0.10 0.00 -0.15 0.00 0.00 55.06 54.90 2w3r s HIS 329 Cb -0.17 -2.39 0.25 0.00 1.11 0.00 0.00 32.58 31.38 2w3r s HIS 329 CO 0.11 -0.22 0.93 -0.98 -0.85 0.00 0.00 174.74 173.73 2w3r s ARG 330 N 1.74 3.84 -0.05 1.40 3.03 -1.26 -1.26 118.95 126.39 2w3r s ARG 330 Ca 0.07 -2.94 -0.27 0.00 2.03 0.00 0.00 55.73 54.62 2w3r s ARG 330 Cb -0.16 -4.42 -0.03 0.00 -1.03 0.00 0.00 34.95 29.31 2w3r s ARG 330 CO 0.10 -1.26 0.85 -0.51 -1.13 0.00 0.00 175.30 173.35 2w3r s LEU 331 N -0.74 4.33 0.01 -1.89 1.43 -0.44 -0.43 118.68 120.95 2w3r s LEU 331 Ca 0.25 1.41 -0.26 0.00 -1.03 0.00 0.00 54.13 54.50 2w3r s LEU 331 Cb -0.10 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 2w3r s LEU 331 CO -0.09 -0.21 0.83 -0.60 0.23 0.00 0.00 176.35 176.51 2w3r s ARG 332 N 1.03 4.52 0.10 1.70 3.52 -0.52 -1.44 118.95 127.87 2w3r s ARG 332 Ca 0.44 1.15 0.03 0.00 -0.13 0.00 0.00 55.73 57.23 2w3r s ARG 332 Cb -0.19 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.75 2w3r s ARG 332 CO 0.22 0.13 -0.09 0.95 -0.81 0.00 0.00 175.30 175.70 2w3r s THR 333 N 0.46 0.89 -0.40 4.11 -4.23 -1.13 -4.59 115.64 110.74 2w3r s THR 333 Ca 0.43 -1.75 -0.06 0.00 -1.18 0.00 0.00 61.69 59.13 2w3r s THR 333 Cb -0.20 -1.47 -0.12 0.00 1.34 0.00 0.00 72.50 72.05 2w3r s THR 333 CO 0.24 -0.66 3.20 0.59 -0.54 0.00 0.00 174.62 177.45 2w3r n ASN 334 N 0.34 6.19 -4.07 3.99 4.13 0.97 -1.01 115.26 125.80 2w3r n ASN 334 Ca -0.15 -2.77 -0.20 0.00 1.68 0.00 0.00 54.58 53.15 2w3r n ASN 334 Cb 0.59 -1.37 -0.09 0.00 -1.54 0.00 0.00 39.78 37.37 2w3r n ASN 334 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2w3r s THR 335 N -0.09 0.45 0.07 3.41 -4.23 -1.26 -4.39 115.64 109.59 2w3r s THR 335 Ca 0.64 -2.00 -0.37 0.00 -1.18 0.00 0.00 61.69 58.78 2w3r s THR 335 Cb 0.32 -2.53 -0.18 0.00 1.34 0.00 0.00 72.50 71.45 2w3r s THR 335 CO -0.09 0.00 1.06 0.00 -0.54 0.00 0.00 174.62 175.06 2w3r n GLN 336 N -0.62 0.39 -2.02 3.99 3.00 -1.26 -1.80 117.38 119.06 2w3r n GLN 336 Ca -0.00 0.14 -0.39 0.00 -0.01 0.00 0.00 57.00 56.73 2w3r n GLN 336 Cb 0.65 -1.60 -0.03 0.00 0.00 0.00 0.00 30.24 29.26 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 -0.04 5.38 0.41 1.08 0.15 -1.26 -4.10 113.70 115.33 2w3r s SER 337 Ca 0.84 0.56 -0.27 0.00 0.70 0.00 0.00 55.95 57.78 2w3r s SER 337 Cb -1.10 -2.53 -0.10 0.00 -1.71 0.00 0.00 66.02 60.58 2w3r s SER 337 CO 0.54 -2.25 1.46 0.20 1.20 0.00 0.00 173.24 174.39 2w3r s ASN 338 N 7.76 6.11 0.00 5.45 0.01 0.32 -3.98 114.94 130.61 2w3r s ASN 338 Ca 0.71 2.99 0.00 0.00 -0.71 0.00 0.00 52.86 55.84 2w3r s ASN 338 Cb -0.15 -2.66 0.00 0.00 0.41 0.00 0.00 41.25 38.85 2w3r s ASN 338 CO 0.24 -1.02 0.00 1.07 -1.51 0.00 0.00 177.10 175.87 2w3r n THR 339 N 0.13 0.00 -2.64 1.60 5.66 -0.73 -4.37 114.28 113.94 2w3r n THR 339 Ca 0.03 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.65 2w3r n THR 339 Cb 0.40 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.13 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 3.21 -0.17 1.79 0.00 -1.26 -4.58 121.76 118.74 2w3r s ALA 340 Ca 0.00 0.66 -0.11 0.00 0.00 0.00 0.00 51.96 52.51 2w3r s ALA 340 Cb 0.00 -3.24 0.06 0.00 0.00 0.00 0.00 23.12 19.93 2w3r s ALA 340 CO 0.00 -0.02 0.42 0.12 0.00 0.00 0.00 175.76 176.28 2w3r s PHE 341 N -1.52 -0.59 0.00 0.00 5.99 -1.26 -3.59 117.98 117.02 2w3r s PHE 341 Ca 0.51 1.28 0.00 0.00 0.00 0.00 0.00 56.93 58.72 2w3r s PHE 341 Cb -0.23 0.25 0.00 0.00 0.00 0.00 0.00 43.02 43.05 2w3r s PHE 341 CO 0.29 -0.32 0.00 -2.13 -0.00 0.00 0.00 175.22 173.06 2w3r n ARG 342 N 3.94 0.00 0.00 10.12 0.63 0.03 0.15 116.66 131.53 2w3r n ARG 342 Ca -0.21 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 2w3r n ARG 342 Cb 0.56 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.47 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 3.10 3.26 5.14 0.00 -1.26 -4.88 105.19 110.55 2w3r n GLY 343 Ca 0.00 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.47 0.00 1.61 7.35 0.40 -2.11 117.46 122.24 2w3r n PHE 344 Ca 0.00 0.86 0.00 0.00 -0.76 0.00 0.00 57.45 57.55 2w3r n PHE 344 Cb 0.00 -4.11 0.00 0.00 0.35 0.00 0.00 39.48 35.72 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 -1.26 2.39 0.41 7.13 0.00 -1.26 -4.47 105.19 108.13 2w3r n GLY 345 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.72 0.53 -0.02 0.00 -1.60 -2.51 103.07 98.76 2w3r h GLY 346 Ca 0.00 0.59 0.08 0.00 0.00 0.00 0.00 47.33 48.00 2w3r h GLY 346 CO 0.00 -0.18 0.32 -2.55 0.00 0.00 0.00 176.54 174.13 2w3r h PRO 347 N -0.39 0.56 0.36 4.80 0.11 -1.89 0.53 132.00 136.08 2w3r h PRO 347 Ca 0.11 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 2w3r h PRO 347 Cb 0.61 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 2w3r h PRO 347 CO -0.54 0.37 -0.49 1.96 -0.21 0.00 0.00 178.00 179.09 2w3r h GLN 348 N 0.57 -0.86 -0.68 1.05 7.50 -1.90 0.41 115.11 121.20 2w3r h GLN 348 Ca 0.32 0.06 0.11 0.00 0.50 0.00 0.00 58.65 59.64 2w3r h GLN 348 Cb 0.30 0.20 -0.08 0.00 0.05 0.00 0.00 27.48 27.94 2w3r h GLN 348 CO -0.24 -0.57 0.27 0.78 -1.50 0.00 0.00 178.83 177.56 2w3r h GLY 349 N -0.89 0.99 1.51 3.46 0.00 -0.98 -1.14 103.07 106.02 2w3r h GLY 349 Ca -0.04 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.05 2w3r h GLY 349 CO -0.13 -0.04 -0.25 0.00 0.00 0.00 0.00 176.54 176.12 2w3r h ALA 350 N 1.47 1.03 0.00 3.60 0.00 -0.68 -2.95 119.26 121.73 2w3r h ALA 350 Ca 0.35 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 350 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2w3r h ALA 350 CO -0.34 0.58 -0.28 1.25 0.00 0.00 0.00 179.25 180.46 2w3r h LEU 351 N 0.50 0.00 -0.34 0.00 5.85 0.99 -1.74 115.31 120.57 2w3r h LEU 351 Ca 0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2w3r h LEU 351 Cb 0.69 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 2w3r h LEU 351 CO 0.05 0.28 0.17 1.23 -0.34 0.00 0.00 178.44 179.83 2w3r h GLY 352 N 1.50 0.52 1.22 3.75 0.00 -1.11 -1.80 103.07 107.15 2w3r h GLY 352 Ca -0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 47.33 46.94 2w3r h GLY 352 CO 0.04 0.24 -0.30 1.98 0.00 0.00 0.00 176.54 178.49 2w3r h MET 353 N 0.41 0.87 -0.37 4.80 1.85 -1.40 -2.12 114.93 118.98 2w3r h MET 353 Ca 0.12 -0.41 -0.15 0.00 -0.61 0.00 0.00 59.70 58.65 2w3r h MET 353 Cb 0.10 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.11 2w3r h MET 353 CO -0.02 1.05 -0.35 0.93 -0.40 0.00 0.00 176.91 178.13 2w3r h GLU 354 N 0.74 0.84 -0.37 0.39 4.39 -1.30 0.20 114.58 119.47 2w3r h GLU 354 Ca 0.08 -0.42 -0.06 0.00 0.34 0.00 0.00 59.36 59.30 2w3r h GLU 354 Cb 0.86 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2w3r h GLU 354 CO 0.08 1.06 0.00 -0.09 -1.16 0.00 0.00 179.01 178.90 2w3r h ARG 355 N 0.70 0.65 0.18 2.33 1.12 -1.32 -1.51 114.38 116.52 2w3r h ARG 355 Ca 0.07 -0.21 0.00 0.00 -1.11 0.00 0.00 59.98 58.73 2w3r h ARG 355 Cb 0.91 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.80 2w3r h ARG 355 CO 0.08 0.75 -0.16 0.00 -3.11 0.00 0.00 179.97 177.54 2w3r h ALA 356 N 0.87 -0.33 -0.04 2.80 0.00 -1.20 0.09 119.26 121.45 2w3r h ALA 356 Ca 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2w3r h ALA 356 Cb 0.46 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2w3r h ALA 356 CO 0.02 -0.70 -0.23 0.97 0.00 0.00 0.00 179.25 179.31 2w3r h ILE 357 N -0.36 1.18 -0.13 0.00 2.10 -0.98 -0.82 117.51 118.52 2w3r h ILE 357 Ca -0.00 -0.87 -0.02 0.00 1.08 0.00 0.00 64.86 65.05 2w3r h ILE 357 Cb 0.33 1.41 -0.00 0.00 -1.09 0.00 0.00 36.82 37.46 2w3r h ILE 357 CO -0.03 0.25 0.00 -0.08 -1.08 0.00 0.00 178.15 177.22 2w3r h GLU 358 N 0.06 0.23 -0.69 2.19 4.57 -0.89 -0.53 114.58 119.52 2w3r h GLU 358 Ca 0.01 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2w3r h GLU 358 Cb 0.44 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2w3r h GLU 358 CO 0.03 0.46 0.43 1.25 -1.18 0.00 0.00 179.01 180.00 2w3r h HIS 359 N -0.04 0.90 -0.74 0.92 2.76 -0.59 -0.68 115.15 117.67 2w3r h HIS 359 Ca 0.04 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.23 2w3r h HIS 359 Cb 0.36 -0.30 -0.04 0.00 1.55 0.00 0.00 27.41 28.98 2w3r h HIS 359 CO 0.03 0.60 0.48 1.25 -1.30 0.00 0.00 177.93 178.99 2w3r h LEU 360 N 0.94 0.81 0.01 0.26 5.85 -1.10 0.12 115.31 122.20 2w3r h LEU 360 Ca 0.25 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 2w3r h LEU 360 Cb -0.05 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.79 2w3r h LEU 360 CO -0.05 0.57 -0.00 0.00 -0.34 0.00 0.00 178.44 178.62 2w3r h ALA 361 N 1.30 -0.01 -0.08 1.25 0.00 -0.47 -2.13 119.26 119.12 2w3r h ALA 361 Ca 0.29 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2w3r h ALA 361 Cb -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2w3r h ALA 361 CO -0.09 -0.45 -0.18 0.00 0.00 0.00 0.00 179.25 178.52 2w3r h ARG 362 N -0.11 0.13 -0.19 0.00 2.47 -0.98 -1.67 114.38 114.03 2w3r h ARG 362 Ca -0.00 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 2w3r h ARG 362 Cb 0.11 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 2w3r h ARG 362 CO 0.00 0.31 0.10 0.78 0.56 0.00 0.00 179.97 181.72 2w3r h GLY 363 N 0.73 0.29 -3.07 0.04 0.00 -0.39 -3.10 103.07 97.56 2w3r h GLY 363 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2w3r h GLY 363 CO 0.03 0.13 0.00 1.15 0.00 0.00 0.00 176.54 177.85 2w3r n MET 364 N -4.89 4.09 -3.38 4.80 0.00 -0.83 -4.94 117.12 111.97 2w3r n MET 364 Ca -0.04 -2.65 -0.24 0.00 0.00 0.00 0.00 57.70 54.77 2w3r n MET 364 Cb 0.08 -2.07 0.05 0.00 0.00 0.00 0.00 33.22 31.28 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 0.68 -0.53 3.42 3.17 0.00 -1.00 -4.99 105.19 105.95 2w3r n GLY 365 Ca 0.24 0.18 -0.27 0.00 0.00 0.00 0.00 46.02 46.17 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 -6.08 1.52 -0.04 1.61 3.52 -0.66 -5.04 118.95 113.78 2w3r s ARG 366 Ca 0.46 -1.52 -0.30 0.00 -0.13 0.00 0.00 55.73 54.25 2w3r s ARG 366 Cb -0.21 -1.85 -0.06 0.00 -1.56 0.00 0.00 34.95 31.26 2w3r s ARG 366 CO 0.57 0.40 1.78 0.34 -0.81 0.00 0.00 175.30 177.59 2w3r s ASP 367 N -2.64 6.52 0.38 -2.12 2.15 -1.26 -4.43 116.67 115.27 2w3r s ASP 367 Ca 0.20 2.32 0.09 0.00 0.43 0.00 0.00 52.55 55.60 2w3r s ASP 367 Cb -0.08 -2.53 0.85 0.00 -0.30 0.00 0.00 42.92 40.86 2w3r s ASP 367 CO 0.10 -1.04 1.92 -0.65 -0.17 0.00 0.00 175.17 175.33 2w3r h PRO 368 N 10.23 0.62 -0.24 4.34 0.11 -1.95 -0.42 132.00 144.69 2w3r h PRO 368 Ca -0.42 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 2w3r h PRO 368 Cb 1.20 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2w3r h PRO 368 CO 0.95 0.41 -0.19 0.00 -0.21 0.00 0.00 178.00 178.97 2w3r h ALA 369 N 1.62 1.23 0.07 -0.75 0.00 -1.90 -1.49 119.26 118.04 2w3r h ALA 369 Ca 0.37 -0.30 -0.29 0.00 0.00 0.00 0.00 54.91 54.70 2w3r h ALA 369 Cb 0.56 -0.12 0.03 0.00 0.00 0.00 0.00 17.79 18.25 2w3r h ALA 369 CO -0.14 0.50 -1.17 1.49 0.00 0.00 0.00 179.25 179.93 2w3r h GLU 370 N 0.39 0.66 -0.54 0.00 4.22 -1.51 -1.55 114.58 116.24 2w3r h GLU 370 Ca 0.07 -0.81 -0.08 0.00 0.08 0.00 0.00 59.36 58.62 2w3r h GLU 370 Cb 0.56 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2w3r h GLU 370 CO 0.04 1.36 0.02 1.25 -2.18 0.00 0.00 179.01 179.51 2w3r h LEU 371 N 0.32 0.88 -0.18 1.64 5.85 -1.20 -2.46 115.31 120.15 2w3r h LEU 371 Ca -0.17 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.26 2w3r h LEU 371 Cb 1.83 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.63 2w3r h LEU 371 CO 0.23 0.92 -0.16 0.03 -0.34 0.00 0.00 178.44 179.12 2w3r h ARG 372 N 0.85 0.43 -0.84 1.25 3.08 -1.29 -2.95 114.38 114.91 2w3r h ARG 372 Ca 0.16 -0.22 0.10 0.00 0.07 0.00 0.00 59.98 60.09 2w3r h ARG 372 Cb 0.47 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.46 2w3r h ARG 372 CO 0.02 0.78 0.55 0.00 -1.07 0.00 0.00 179.97 180.25 2w3r h ALA 373 N 0.64 1.71 0.00 0.04 0.00 -1.23 -0.44 119.26 119.99 2w3r h ALA 373 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2w3r h ALA 373 Cb 0.69 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2w3r h ALA 373 CO 0.04 0.11 -0.08 1.25 0.00 0.00 0.00 179.25 180.57 2w3r h LEU 374 N 0.79 0.00 -2.12 0.00 5.85 -1.39 -3.33 115.31 115.11 2w3r h LEU 374 Ca 0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.11 2w3r h LEU 374 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2w3r h LEU 374 CO -0.16 0.08 0.00 0.59 -0.34 0.00 0.00 178.44 178.61 2w3r n ASN 375 N -3.19 2.03 -4.59 1.25 3.02 -0.21 -4.93 115.26 108.63 2w3r n ASN 375 Ca 0.01 -1.64 -0.30 0.00 -0.03 0.00 0.00 54.58 52.62 2w3r n ASN 375 Cb 0.37 -0.07 0.20 0.00 -0.61 0.00 0.00 39.78 39.68 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 -0.76 1.60 1.17 3.10 2.99 -0.96 -2.33 117.98 122.79 2w3r s PHE 376 Ca 0.10 1.43 -0.15 0.00 0.00 0.00 0.00 56.93 58.31 2w3r s PHE 376 Cb 0.06 -3.20 0.27 0.00 0.00 0.00 0.00 43.02 40.15 2w3r s PHE 376 CO 0.08 -3.25 1.04 0.71 -0.00 0.00 0.00 175.22 173.80 2w3r s TYR 377 N -2.60 1.16 0.29 0.36 1.51 -1.19 -4.39 117.35 112.48 2w3r s TYR 377 Ca 0.67 0.91 -0.12 0.00 -1.01 0.00 0.00 57.07 57.52 2w3r s TYR 377 Cb -0.23 -3.17 -0.08 0.00 -0.11 0.00 0.00 41.96 38.37 2w3r s TYR 377 CO 0.61 -3.79 0.65 -0.51 -1.11 0.00 0.00 175.55 171.41 2w3r s ASP 378 N -3.10 6.69 0.73 2.29 1.01 -1.26 -4.81 116.67 118.23 2w3r s ASP 378 Ca 0.68 1.11 -0.14 0.00 0.71 0.00 0.00 52.55 54.91 2w3r s ASP 378 Cb -0.19 -2.30 0.04 0.00 1.01 0.00 0.00 42.92 41.48 2w3r s ASP 378 CO 0.60 -0.16 1.16 -2.84 0.21 0.00 0.00 175.17 174.14 2w3r s PRO 379 N -2.96 2.23 0.48 8.23 0.02 -1.26 -4.31 135.00 137.44 2w3r s PRO 379 Ca 0.51 1.55 -0.21 0.00 0.02 0.00 0.00 61.00 62.87 2w3r s PRO 379 Cb -0.11 -1.86 -0.10 0.00 0.02 0.00 0.00 34.50 32.45 2w3r s PRO 379 CO 0.20 -1.72 0.77 -2.30 -0.33 0.00 0.00 177.00 173.61 2w3r n PRO 380 N -2.89 0.88 -1.45 5.54 -0.02 -1.26 -4.96 135.00 130.84 2w3r n PRO 380 Ca 0.12 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2w3r n PRO 380 Cb 0.51 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 2w3r n PRO 380 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2w3r n GLU 381 N 0.02 -4.03 -1.14 -0.52 4.71 -1.26 -5.13 120.64 113.30 2w3r n GLU 381 Ca 0.11 2.91 0.12 0.00 -0.01 0.00 0.00 57.16 60.30 2w3r n GLU 381 Cb 0.42 -3.19 -0.05 0.00 -1.01 0.00 0.00 31.44 27.62 2w3r n GLU 381 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2w3r n LYS 398 N 0.39 -2.10 -2.79 3.49 3.00 -1.26 -5.17 118.16 113.72 2w3r n LYS 398 Ca 0.00 1.59 -0.37 0.00 -0.00 0.00 0.00 58.31 59.53 2w3r n LYS 398 Cb 0.00 -2.67 -0.06 0.00 0.00 0.00 0.00 35.03 32.29 2w3r n LYS 398 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2w3r s LYS 399 N -3.39 4.59 0.21 1.64 0.00 -1.26 -5.03 119.74 116.51 2w3r s LYS 399 Ca 0.00 1.32 -0.30 0.00 0.00 0.00 0.00 55.97 57.00 2w3r s LYS 399 Cb 0.00 -2.84 -0.08 0.00 0.00 0.00 0.00 37.83 34.91 2w3r s LYS 399 CO 0.00 0.30 1.16 0.99 0.00 0.00 0.00 175.35 177.81 2w3r s THR 400 N -1.58 3.59 0.37 3.79 2.01 -1.26 -5.00 115.64 117.56 2w3r s THR 400 Ca 0.49 1.39 -0.28 0.00 0.31 0.00 0.00 61.69 63.61 2w3r s THR 400 Cb -0.19 -3.89 -0.11 0.00 0.01 0.00 0.00 72.50 68.32 2w3r s THR 400 CO 0.24 0.25 1.36 0.00 -0.69 0.00 0.00 174.62 175.79 2w3r n GLN 401 N 2.18 2.30 -3.71 4.92 6.02 -1.26 -4.82 117.38 123.01 2w3r n GLN 401 Ca 0.03 0.81 -0.20 0.00 -0.01 0.00 0.00 57.00 57.63 2w3r n GLN 401 Cb 0.45 -2.47 -0.01 0.00 1.02 0.00 0.00 30.24 29.22 2w3r n GLN 401 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2w3r s THR 402 N -1.12 4.49 0.98 5.09 -4.23 -1.26 -2.02 115.64 117.56 2w3r s THR 402 Ca 0.56 -1.04 -0.15 0.00 -1.18 0.00 0.00 61.69 59.88 2w3r s THR 402 Cb -0.52 -3.56 0.18 0.00 1.34 0.00 0.00 72.50 69.94 2w3r s THR 402 CO 0.62 -0.23 1.19 0.42 -0.54 0.00 0.00 174.62 176.07 2w3r s THR 403 N -2.11 1.92 -0.33 3.99 -4.23 0.14 -4.78 115.64 110.23 2w3r s THR 403 Ca 0.40 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 61.12 2w3r s THR 403 Cb -0.09 -2.78 0.21 0.00 1.34 0.00 0.00 72.50 71.18 2w3r s THR 403 CO 0.30 0.00 1.64 0.00 -0.54 0.00 0.00 174.62 176.02 2w3r n HIS 404 N -3.94 0.71 -1.05 3.99 1.44 -1.26 -0.82 115.22 114.29 2w3r n HIS 404 Ca 0.10 0.34 0.01 0.00 -2.01 0.00 0.00 57.72 56.16 2w3r n HIS 404 Cb 0.59 -1.05 0.30 0.00 0.12 0.00 0.00 29.99 29.96 2w3r n HIS 404 CO 0.00 0.00 0.00 2.48 -2.81 0.00 0.00 176.34 176.01 2w3r n TYR 405 N -2.21 1.84 -3.13 -1.40 0.18 -1.26 -4.60 117.16 106.58 2w3r n TYR 405 Ca -0.00 -1.07 -0.14 0.00 1.88 0.00 0.00 57.90 58.56 2w3r n TYR 405 Cb 0.09 -0.54 0.06 0.00 -0.38 0.00 0.00 39.34 38.58 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 -0.21 -0.12 3.03 -7.48 0.00 0.00 -2.63 105.19 97.78 2w3r n GLY 406 Ca 0.33 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.39 2.21 0.40 1.61 0.74 -1.25 -4.40 119.66 113.57 2w3r s GLN 407 Ca 0.18 -0.54 -0.27 0.00 0.05 0.00 0.00 55.36 54.79 2w3r s GLN 407 Cb -0.08 -1.96 -0.10 0.00 1.10 0.00 0.00 33.01 31.96 2w3r s GLN 407 CO 0.52 -0.15 1.34 0.39 -0.55 0.00 0.00 175.29 176.83 2w3r n GLU 408 N 4.51 2.16 -3.76 1.67 1.02 -1.26 0.25 120.64 125.23 2w3r n GLU 408 Ca -0.18 0.76 -0.34 0.00 -0.02 0.00 0.00 57.16 57.39 2w3r n GLU 408 Cb 0.51 -2.46 -0.10 0.00 -0.02 0.00 0.00 31.44 29.37 2w3r n GLU 408 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2w3r s VAL 409 N -1.16 3.59 -1.54 2.62 1.01 -0.86 -4.86 120.40 119.20 2w3r s VAL 409 Ca 0.58 -3.46 0.26 0.00 0.00 0.00 0.00 61.98 59.36 2w3r s VAL 409 Cb -0.51 -3.32 0.20 0.00 0.00 0.00 0.00 36.38 32.75 2w3r s VAL 409 CO 0.60 -0.94 1.54 0.00 0.00 0.00 0.00 175.10 176.30 2w3r n ALA 410 N 2.89 3.20 -0.27 5.51 0.00 -1.26 -4.25 120.51 126.32 2w3r n ALA 410 Ca 0.13 -0.38 0.03 0.00 0.00 0.00 0.00 53.44 53.21 2w3r n ALA 410 Cb 0.36 -1.14 0.04 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.90 2.09 -4.63 0.00 5.75 -1.26 -4.18 116.55 113.42 2w3r n ASP 411 Ca 0.10 -2.28 -0.43 0.00 -0.01 0.00 0.00 54.79 52.18 2w3r n ASP 411 Cb 0.34 -0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 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 6.45 0.27 -0.34 0.00 0.24 -1.26 -4.04 118.33 119.65 2w3r n VAL 413 Ca 0.19 -0.63 0.03 0.00 -2.04 0.00 0.00 64.34 61.88 2w3r n VAL 413 Cb 0.45 1.03 0.18 0.00 -1.47 0.00 0.00 33.84 34.03 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 2.02 0.91 -0.28 1.34 3.38 -1.92 -1.95 115.31 118.80 2w3r h LEU 414 Ca 0.00 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.04 2w3r h LEU 414 Cb 0.51 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 2w3r h LEU 414 CO 0.00 0.55 -0.54 1.23 0.09 0.00 0.00 178.44 179.77 2w3r h GLY 415 N 1.03 -1.00 0.83 0.83 0.00 -1.87 0.14 103.07 103.03 2w3r h GLY 415 Ca 0.42 0.68 -0.07 0.00 0.00 0.00 0.00 47.33 48.37 2w3r h GLY 415 CO -0.20 -0.16 -0.12 -2.09 0.00 0.00 0.00 176.54 173.97 2w3r h GLU 416 N -0.48 0.47 -0.29 4.80 4.81 -1.90 -3.19 114.58 118.80 2w3r h GLU 416 Ca 0.06 -0.21 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2w3r h GLU 416 Cb 0.64 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.98 2w3r h GLU 416 CO -0.52 0.76 0.13 1.25 -0.73 0.00 0.00 179.01 179.90 2w3r h LEU 417 N 0.18 0.18 -0.89 1.64 6.46 -1.06 -2.22 115.31 119.59 2w3r h LEU 417 Ca 0.05 0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.78 2w3r h LEU 417 Cb 0.62 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.50 2w3r h LEU 417 CO 0.03 0.14 0.23 0.58 -0.62 0.00 0.00 178.44 178.81 2w3r h VAL 418 N 0.28 1.25 -0.62 1.05 2.07 -0.82 -2.04 116.25 117.41 2w3r h VAL 418 Ca 0.12 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 2w3r h VAL 418 Cb 0.05 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2w3r h VAL 418 CO -0.10 0.33 0.22 0.74 0.02 0.00 0.00 177.57 178.79 2w3r h THR 419 N 1.01 1.24 -0.49 2.57 2.02 -1.48 -1.37 112.91 116.42 2w3r h THR 419 Ca 0.23 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.59 2w3r h THR 419 Cb 0.26 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 2w3r h THR 419 CO -0.01 0.30 0.13 -0.09 0.37 0.00 0.00 175.52 176.22 2w3r h ARG 420 N 0.87 0.77 -0.07 6.66 2.43 -1.18 -2.80 114.38 121.07 2w3r h ARG 420 Ca 0.20 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2w3r h ARG 420 Cb 0.24 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2w3r h ARG 420 CO -0.01 0.74 0.04 1.25 -1.51 0.00 0.00 179.97 180.48 2w3r h LEU 421 N 0.66 0.08 -0.41 3.80 5.85 -1.13 -1.90 115.31 122.25 2w3r h LEU 421 Ca 0.15 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.93 2w3r h LEU 421 Cb 0.31 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 2w3r h LEU 421 CO -0.00 0.06 0.11 1.56 -0.34 0.00 0.00 178.44 179.82 2w3r h GLN 422 N 0.09 0.24 -0.26 1.25 4.20 -1.21 0.14 115.11 119.57 2w3r h GLN 422 Ca 0.02 -0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.58 2w3r h GLN 422 Cb -0.01 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 2w3r h GLN 422 CO -0.01 0.16 -0.40 0.87 -0.67 0.00 0.00 178.83 178.79 2w3r h LYS 423 N 0.25 0.72 0.00 1.46 1.79 -1.40 0.42 116.57 119.82 2w3r h LYS 423 Ca 0.19 -0.43 -0.08 0.00 -2.18 0.00 0.00 60.65 58.15 2w3r h LYS 423 Cb 0.21 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2w3r h LYS 423 CO -0.23 1.06 -0.37 0.66 -1.08 0.00 0.00 179.45 179.49 2w3r h SER 424 N 0.45 0.00 -0.08 0.86 4.64 -1.24 -2.44 113.55 115.74 2w3r h SER 424 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2w3r h SER 424 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2w3r h SER 424 CO 0.09 0.37 0.00 0.00 -0.87 0.00 0.00 176.83 176.42 2w3r n ALA 425 N -2.27 2.56 -3.59 5.18 0.00 0.48 -4.95 120.51 117.92 2w3r n ALA 425 Ca 0.00 -0.46 -0.22 0.00 0.00 0.00 0.00 53.44 52.77 2w3r n ALA 425 Cb 0.54 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.90 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 0.15 -3.54 0.21 0.00 4.05 -0.65 -4.91 115.26 110.57 2w3r n ASN 426 Ca 0.18 -0.65 -0.15 0.00 0.45 0.00 0.00 54.58 54.41 2w3r n ASN 426 Cb 0.32 -4.74 -0.08 0.00 1.23 0.00 0.00 39.78 36.51 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 -2.16 -0.44 -0.46 1.20 3.57 -0.43 -1.74 116.94 116.48 2w3r h PHE 427 Ca -0.59 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 60.82 2w3r h PHE 427 Cb 1.36 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.23 2w3r h PHE 427 CO 0.48 -0.23 -0.04 1.15 -2.23 0.00 0.00 178.31 177.44 2w3r h THR 428 N -0.54 1.27 -0.08 4.41 2.02 -1.92 -1.11 112.91 116.95 2w3r h THR 428 Ca -0.05 -1.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.01 2w3r h THR 428 Cb 0.41 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2w3r h THR 428 CO 0.08 0.39 0.03 0.74 0.37 0.00 0.00 175.52 177.13 2w3r h THR 429 N 0.68 1.15 -0.72 3.16 2.02 -1.96 -2.60 112.91 114.65 2w3r h THR 429 Ca 0.13 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 66.85 2w3r h THR 429 Cb 0.56 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 2w3r h THR 429 CO 0.03 0.13 0.48 0.03 0.37 0.00 0.00 175.52 176.56 2w3r h ARG 430 N -0.04 0.94 -0.60 6.66 3.08 -1.22 -1.34 114.38 121.86 2w3r h ARG 430 Ca 0.03 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2w3r h ARG 430 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2w3r h ARG 430 CO -0.00 0.62 0.08 -0.09 -1.07 0.00 0.00 179.97 179.51 2w3r h ARG 431 N 0.97 0.99 -0.31 0.04 2.43 -1.12 -2.01 114.38 115.38 2w3r h ARG 431 Ca 0.27 -0.26 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 2w3r h ARG 431 Cb -0.10 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 2w3r h ARG 431 CO -0.06 0.93 -0.25 0.00 -1.51 0.00 0.00 179.97 179.08 2w3r h ALA 432 N 1.15 0.45 -0.41 2.80 0.00 -1.04 -2.74 119.26 119.47 2w3r h ALA 432 Ca 0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2w3r h ALA 432 Cb 0.43 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2w3r h ALA 432 CO 0.01 0.44 0.20 0.93 0.00 0.00 0.00 179.25 180.83 2w3r h GLU 433 N 0.47 0.56 -0.28 0.00 5.08 -1.15 -2.63 114.58 116.64 2w3r h GLU 433 Ca 0.06 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2w3r h GLU 433 Cb 0.81 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2w3r h GLU 433 CO 0.07 0.44 -0.06 0.82 -1.00 0.00 0.00 179.01 179.28 2w3r h ILE 434 N 0.57 1.28 -0.25 3.13 2.04 -1.29 -1.69 117.51 121.30 2w3r h ILE 434 Ca 0.15 -1.07 0.05 0.00 1.00 0.00 0.00 64.86 64.99 2w3r h ILE 434 Cb 0.05 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 2w3r h ILE 434 CO -0.02 0.34 -0.08 0.00 0.00 0.00 0.00 178.15 178.39 2w3r h ALA 435 N 0.78 0.14 -0.14 1.87 0.00 -1.17 0.19 119.26 120.94 2w3r h ALA 435 Ca 0.07 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2w3r h ALA 435 Cb 0.53 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2w3r h ALA 435 CO 0.03 -0.49 0.02 0.00 0.00 0.00 0.00 179.25 178.81 2w3r h ALA 436 N 1.21 0.13 -0.52 0.00 0.00 -1.49 -2.85 119.26 115.74 2w3r h ALA 436 Ca 0.12 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2w3r h ALA 436 Cb 0.21 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2w3r h ALA 436 CO -0.27 -0.43 0.35 2.35 0.00 0.00 0.00 179.25 181.25 2w3r h TRP 437 N 0.07 0.61 0.00 0.00 7.01 -0.55 -2.00 115.95 121.10 2w3r h TRP 437 Ca 0.06 0.01 -0.09 0.00 2.11 0.00 0.00 58.89 60.99 2w3r h TRP 437 Cb 0.06 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 2w3r h TRP 437 CO -0.13 0.37 -0.42 -0.91 -2.79 0.00 0.00 178.44 174.56 2w3r h ASN 438 N 0.64 0.00 -0.01 2.65 2.35 -0.44 -2.84 115.58 117.93 2w3r h ASN 438 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2w3r h ASN 438 Cb 0.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.39 2w3r h ASN 438 CO -0.05 0.42 0.00 -1.54 -1.65 0.00 0.00 177.43 174.61 2w3r n SER 439 N -3.67 0.85 -0.01 5.81 3.41 -0.76 -3.42 113.62 115.83 2w3r n SER 439 Ca -0.01 -1.28 0.08 0.00 -0.26 0.00 0.00 58.87 57.40 2w3r n SER 439 Cb 0.51 -0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.34 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 -0.34 0.00 -4.26 6.66 -1.04 -1.09 -5.00 114.28 109.22 2w3r n THR 440 Ca 0.21 -0.33 -0.23 0.00 -2.04 0.00 0.00 64.05 61.66 2w3r n THR 440 Cb 0.25 0.23 -0.07 0.00 -1.82 0.00 0.00 70.33 68.92 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 -3.65 4.71 0.00 8.00 -0.87 -1.13 -5.03 114.94 116.97 2w3r s ASN 441 Ca -0.04 -0.58 0.00 0.00 -1.57 0.00 0.00 52.86 50.67 2w3r s ASN 441 Cb 0.10 -0.94 0.00 0.00 -0.02 0.00 0.00 41.25 40.39 2w3r s ASN 441 CO 0.64 -0.01 0.00 -2.11 -2.57 0.00 0.00 177.10 173.06 2w3r n ARG 442 N -0.95 0.00 -0.00 -0.60 1.85 -1.26 -4.79 116.66 110.91 2w3r n ARG 442 Ca -0.07 0.00 0.03 0.00 -1.00 0.00 0.00 57.85 56.81 2w3r n ARG 442 Cb 0.59 -0.45 -0.04 0.00 -1.05 0.00 0.00 32.46 31.51 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 0.00 0.00 -4.53 8.89 -1.04 -1.26 -4.87 114.28 111.47 2w3r n THR 443 Ca 0.00 -0.12 -0.25 0.00 -2.04 0.00 0.00 64.05 61.64 2w3r n THR 443 Cb 0.25 0.37 -0.14 0.00 -1.82 0.00 0.00 70.33 68.99 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 -3.37 2.21 -0.02 -4.42 1.43 -1.26 -0.15 118.68 113.10 2w3r s LEU 444 Ca -0.02 -0.58 -0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2w3r s LEU 444 Cb 0.03 -0.96 0.01 0.00 0.03 0.00 0.00 46.19 45.30 2w3r s LEU 444 CO 0.21 0.13 0.07 0.00 0.23 0.00 0.00 176.35 176.99 2w3r s ALA 445 N -0.92 -0.17 0.00 4.21 0.00 -1.06 -4.69 121.76 119.14 2w3r s ALA 445 Ca 0.07 0.17 -0.02 0.00 0.00 0.00 0.00 51.96 52.19 2w3r s ALA 445 Cb -0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 2w3r s ALA 445 CO 0.03 -0.04 0.16 1.03 0.00 0.00 0.00 175.76 176.94 2w3r s ARG 446 N -0.01 3.36 -0.01 0.00 0.52 -1.26 -1.36 118.95 120.18 2w3r s ARG 446 Ca -0.01 -0.37 0.02 0.00 -0.52 0.00 0.00 55.73 54.85 2w3r s ARG 446 Cb -0.01 -3.04 -0.00 0.00 0.52 0.00 0.00 34.95 32.42 2w3r s ARG 446 CO 0.00 0.66 -0.08 0.20 0.02 0.00 0.00 175.30 176.11 2w3r s GLY 447 N -1.98 0.42 0.01 -3.53 0.00 0.11 -4.37 107.32 97.98 2w3r s GLY 447 Ca 0.27 -0.30 0.02 0.00 0.00 0.00 0.00 44.72 44.72 2w3r s GLY 447 CO 0.19 -0.14 -0.08 -1.50 0.00 0.00 0.00 173.10 171.57 2w3r s ILE 448 N 0.04 0.58 -0.08 0.90 2.07 -1.26 0.16 121.20 123.60 2w3r s ILE 448 Ca -0.00 -0.53 -0.29 0.00 -1.41 0.00 0.00 60.65 58.42 2w3r s ILE 448 Cb -0.06 -0.53 0.07 0.00 0.13 0.00 0.00 42.46 42.07 2w3r s ILE 448 CO -0.00 0.01 0.67 0.00 -1.91 0.00 0.00 174.94 173.71 2w3r s ALA 449 N -0.50 -1.72 -0.17 1.50 0.00 -0.97 -4.71 121.76 115.20 2w3r s ALA 449 Ca -0.00 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.31 2w3r s ALA 449 Cb -0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 2w3r s ALA 449 CO 0.00 -0.36 -0.10 -1.17 0.00 0.00 0.00 175.76 174.14 2w3r s LEU 450 N -0.97 2.80 -0.03 0.00 0.20 -1.26 -1.74 118.68 117.68 2w3r s LEU 450 Ca -0.10 -0.34 0.06 0.00 0.69 0.00 0.00 54.13 54.44 2w3r s LEU 450 Cb -0.01 -1.66 -0.01 0.00 -0.43 0.00 0.00 46.19 44.07 2w3r s LEU 450 CO 0.08 0.10 -0.20 -0.94 -0.29 0.00 0.00 176.35 175.10 2w3r s SER 451 N 0.77 2.44 0.20 3.68 1.04 -0.53 -4.88 113.70 116.42 2w3r s SER 451 Ca -0.04 -0.39 0.05 0.00 0.48 0.00 0.00 55.95 56.05 2w3r s SER 451 Cb -0.15 -0.43 -0.03 0.00 0.10 0.00 0.00 66.02 65.50 2w3r s SER 451 CO 0.01 0.23 0.24 -2.16 0.98 0.00 0.00 173.24 172.54 2w3r s PRO 452 N -0.30 3.18 -0.03 4.02 0.04 -1.26 -1.57 135.00 139.07 2w3r s PRO 452 Ca 0.03 -0.81 0.06 0.00 0.04 0.00 0.00 61.00 60.32 2w3r s PRO 452 Cb -0.10 -2.77 -0.02 0.00 0.04 0.00 0.00 34.50 31.65 2w3r s PRO 452 CO 0.01 0.46 -0.20 0.08 0.04 0.00 0.00 177.00 177.38 2w3r s VAL 453 N -1.89 2.52 -0.20 -0.36 1.01 0.46 -4.81 120.40 117.14 2w3r s VAL 453 Ca 0.33 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 2w3r s VAL 453 Cb -0.10 -1.93 0.06 0.00 0.00 0.00 0.00 36.38 34.42 2w3r s VAL 453 CO 0.26 0.59 0.07 -0.75 0.00 0.00 0.00 175.10 175.27 2w3r s LYS 454 N -0.66 0.38 -0.16 2.72 2.20 -1.25 -2.77 119.74 120.19 2w3r s LYS 454 Ca 0.10 -0.32 0.01 0.00 -0.36 0.00 0.00 55.97 55.40 2w3r s LYS 454 Cb -0.10 -1.92 0.02 0.00 -1.51 0.00 0.00 37.83 34.32 2w3r s LYS 454 CO -0.00 -0.70 -0.19 0.12 -0.36 0.00 0.00 175.35 174.22 2w3r s PHE 455 N 1.98 2.57 0.24 4.03 5.36 0.48 -4.91 117.98 127.73 2w3r s PHE 455 Ca 0.02 -1.46 -0.30 0.00 -0.96 0.00 0.00 56.93 54.23 2w3r s PHE 455 Cb -0.17 -1.80 -0.09 0.00 -0.34 0.00 0.00 43.02 40.63 2w3r s PHE 455 CO -0.11 -0.73 1.06 0.20 -1.46 0.00 0.00 175.22 174.17 2w3r s GLY 456 N 1.25 3.03 -0.17 13.12 0.00 -1.26 0.03 107.32 123.32 2w3r s GLY 456 Ca 0.03 0.80 -0.02 0.00 0.00 0.00 0.00 44.72 45.52 2w3r s GLY 456 CO -0.10 1.46 -0.08 -0.42 0.00 0.00 0.00 173.10 173.96 2w3r s ILE 457 N -0.92 3.35 0.00 0.90 -1.09 -0.61 -4.94 121.20 117.90 2w3r s ILE 457 Ca 0.45 -0.53 0.00 0.00 -2.23 0.00 0.00 60.65 58.34 2w3r s ILE 457 Cb -0.30 -2.47 0.00 0.00 -1.58 0.00 0.00 42.46 38.11 2w3r s ILE 457 CO 0.37 0.48 0.00 -1.20 -1.23 0.00 0.00 174.94 173.36 2w3r n SER 458 N 4.05 0.00 -4.64 3.58 7.64 -1.26 -1.69 113.62 121.30 2w3r n SER 458 Ca -0.18 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.26 2w3r n SER 458 Cb 0.52 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.68 2w3r n SER 458 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2w3r n PHE 459 N -1.64 2.29 0.29 1.43 3.01 -1.26 -4.83 117.46 116.75 2w3r n PHE 459 Ca 0.00 -0.20 0.18 0.00 1.01 0.00 0.00 57.45 58.44 2w3r n PHE 459 Cb 0.00 -2.74 0.99 0.00 -0.01 0.00 0.00 39.48 37.71 2w3r n PHE 459 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2w3r h THR 460 N 6.06 0.00 -3.19 4.37 1.35 -1.95 -3.25 112.91 116.30 2w3r h THR 460 Ca -0.46 0.00 -0.69 0.00 -0.55 0.00 0.00 66.41 64.70 2w3r h THR 460 Cb 1.25 0.80 -0.19 0.00 -1.73 0.00 0.00 68.15 68.29 2w3r h THR 460 CO 0.95 0.00 0.02 -0.22 -0.25 0.00 0.00 175.52 176.02 2w3r s LEU 461 N -5.65 5.14 0.30 3.87 1.98 -1.26 -4.99 118.68 118.08 2w3r s LEU 461 Ca -0.04 -1.07 0.10 0.00 -2.89 0.00 0.00 54.13 50.23 2w3r s LEU 461 Cb 0.10 -2.39 0.47 0.00 0.66 0.00 0.00 46.19 45.04 2w3r s LEU 461 CO 0.33 -0.91 1.69 0.74 -1.89 0.00 0.00 176.35 176.31 2w3r h THR 462 N 5.86 1.36 0.00 3.68 2.02 -1.96 -2.79 112.91 121.08 2w3r h THR 462 Ca -0.28 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.15 2w3r h THR 462 Cb 1.10 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 2w3r h THR 462 CO 0.98 0.51 0.00 1.12 0.37 0.00 0.00 175.52 178.50 2w3r h HIS 463 N 0.05 0.00 0.00 3.16 2.07 -1.94 -2.86 115.15 115.63 2w3r h HIS 463 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2w3r h HIS 463 Cb 0.92 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.90 2w3r h HIS 463 CO 0.00 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.79 2w3r h LEU 464 N 0.00 0.00 -5.25 6.12 3.38 -1.84 -3.36 115.31 114.37 2w3r h LEU 464 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 2w3r h LEU 464 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2w3r h LEU 464 CO 0.00 0.00 2.25 0.59 0.09 0.00 0.00 178.44 181.37 2w3r n ASN 465 N -2.99 4.84 -3.98 -0.43 3.02 -1.08 -4.67 115.26 109.97 2w3r n ASN 465 Ca 0.01 -2.29 -0.11 0.00 -0.03 0.00 0.00 54.58 52.15 2w3r n ASN 465 Cb 0.30 -1.08 -0.12 0.00 -0.61 0.00 0.00 39.78 38.27 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 3.09 0.32 0.06 3.52 -2.07 -1.26 -1.85 119.66 121.47 2w3r s GLN 466 Ca 0.41 -0.48 -0.07 0.00 -1.82 0.00 0.00 55.36 53.41 2w3r s GLN 466 Cb 0.12 -0.08 -0.01 0.00 -1.09 0.00 0.00 33.01 31.95 2w3r s GLN 466 CO -0.03 0.01 0.13 0.00 -1.32 0.00 0.00 175.29 174.08 2w3r s ALA 467 N -0.99 -0.08 0.03 2.60 0.00 -0.32 -4.42 121.76 118.58 2w3r s ALA 467 Ca -0.09 -0.66 -0.04 0.00 0.00 0.00 0.00 51.96 51.17 2w3r s ALA 467 Cb -0.07 0.37 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 2w3r s ALA 467 CO -0.00 -0.42 0.06 0.20 0.00 0.00 0.00 175.76 175.59 2w3r s GLY 468 N -2.61 0.20 0.07 0.00 0.00 -1.26 -0.83 107.32 102.89 2w3r s GLY 468 Ca 0.02 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.19 2w3r s GLY 468 CO -0.09 -0.68 -0.05 0.00 0.00 0.00 0.00 173.10 172.29 2w3r s ALA 469 N -2.28 0.72 -0.11 3.20 0.00 0.12 -2.19 121.76 121.22 2w3r s ALA 469 Ca -0.08 -1.25 -0.03 0.00 0.00 0.00 0.00 51.96 50.60 2w3r s ALA 469 Cb -0.03 0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.34 2w3r s ALA 469 CO -0.03 -0.29 0.06 -1.17 0.00 0.00 0.00 175.76 174.32 2w3r s LEU 470 N -2.90 0.39 -0.05 0.00 2.96 0.93 -0.25 118.68 119.76 2w3r s LEU 470 Ca 0.08 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.72 2w3r s LEU 470 Cb 0.06 -0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.45 2w3r s LEU 470 CO -0.07 -0.28 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.89 2w3r s VAL 471 N 2.10 3.48 -0.05 1.68 1.01 -0.39 -1.62 120.40 126.61 2w3r s VAL 471 Ca 0.03 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.44 2w3r s VAL 471 Cb -0.14 -2.42 -0.00 0.00 0.00 0.00 0.00 36.38 33.82 2w3r s VAL 471 CO -0.06 0.56 -0.16 -1.10 0.00 0.00 0.00 175.10 174.34 2w3r s GLN 472 N -0.89 1.78 -0.15 2.72 -1.52 -0.46 -2.13 119.66 119.02 2w3r s GLN 472 Ca 0.13 -0.57 0.02 0.00 -1.95 0.00 0.00 55.36 52.98 2w3r s GLN 472 Cb -0.11 -1.52 0.01 0.00 -0.22 0.00 0.00 33.01 31.16 2w3r s GLN 472 CO 0.02 0.20 -0.19 0.42 -0.25 0.00 0.00 175.29 175.49 2w3r s ILE 473 N 0.15 2.28 0.40 1.08 1.01 -0.23 -0.39 121.20 125.50 2w3r s ILE 473 Ca -0.06 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.71 2w3r s ILE 473 Cb -0.12 -1.93 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 2w3r s ILE 473 CO 0.03 0.54 0.59 -0.31 0.00 0.00 0.00 174.94 175.79 2w3r s TYR 474 N 0.84 3.25 -0.18 3.97 1.51 -0.41 -4.79 117.35 121.54 2w3r s TYR 474 Ca -0.06 0.13 0.28 0.00 -1.01 0.00 0.00 57.07 56.41 2w3r s TYR 474 Cb -0.15 -2.15 1.25 0.00 -0.11 0.00 0.00 41.96 40.80 2w3r s TYR 474 CO -0.02 -0.17 1.83 1.79 -1.11 0.00 0.00 175.55 177.87 2w3r h THR 475 N 0.60 0.00 0.00 -0.71 1.35 -1.94 0.10 112.91 112.32 2w3r h THR 475 Ca -0.47 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 2w3r h THR 475 Cb 1.25 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2w3r h THR 475 CO 0.57 0.00 -0.03 -2.24 -0.25 0.00 0.00 175.52 173.57 2w3r h ASP 476 N 0.00 0.00 0.00 5.36 -0.00 -1.95 -3.38 116.42 116.46 2w3r h ASP 476 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.03 57.02 2w3r h ASP 476 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.63 2w3r h ASP 476 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 2w3r n GLY 477 N 1.28 0.84 3.88 7.15 0.00 0.36 -4.75 105.19 113.96 2w3r n GLY 477 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.22 6.47 -0.05 1.61 1.04 -1.25 -4.82 113.70 114.47 2w3r s SER 478 Ca 0.00 1.09 0.06 0.00 0.48 0.00 0.00 55.95 57.59 2w3r s SER 478 Cb 0.00 -2.31 -0.01 0.00 0.10 0.00 0.00 66.02 63.80 2w3r s SER 478 CO 0.00 -0.44 -0.24 -0.69 0.98 0.00 0.00 173.24 172.85 2w3r s VAL 479 N -2.45 1.99 -0.36 5.02 1.01 0.80 -1.28 120.40 125.12 2w3r s VAL 479 Ca 0.50 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 2w3r s VAL 479 Cb -0.10 -1.67 0.08 0.00 0.00 0.00 0.00 36.38 34.68 2w3r s VAL 479 CO 0.34 0.56 0.11 0.00 0.00 0.00 0.00 175.10 176.11 2w3r s ALA 480 N -0.26 3.01 -0.16 5.51 0.00 0.47 -0.11 121.76 130.22 2w3r s ALA 480 Ca -0.00 -2.18 -0.12 0.00 0.00 0.00 0.00 51.96 49.66 2w3r s ALA 480 Cb -0.13 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.74 2w3r s ALA 480 CO 0.02 -1.56 0.23 -1.17 0.00 0.00 0.00 175.76 173.28 2w3r s LEU 481 N 1.20 4.26 -0.02 0.00 2.96 -0.05 -1.35 118.68 125.69 2w3r s LEU 481 Ca 0.03 0.44 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 2w3r s LEU 481 Cb -0.21 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.24 2w3r s LEU 481 CO -0.03 0.18 -0.02 0.21 -1.32 0.00 0.00 176.35 175.37 2w3r s ASN 482 N 0.15 0.47 0.29 3.68 3.84 -0.64 -1.25 114.94 121.48 2w3r s ASN 482 Ca 0.14 -0.06 0.00 0.00 0.21 0.00 0.00 52.86 53.16 2w3r s ASN 482 Cb -0.12 -0.16 -0.02 0.00 -0.55 0.00 0.00 41.25 40.39 2w3r s ASN 482 CO 0.02 -0.03 0.31 -1.38 -2.79 0.00 0.00 177.10 173.24 2w3r s HIS 483 N 0.48 1.26 -0.02 0.43 -3.43 -1.26 -0.05 115.29 112.70 2w3r s HIS 483 Ca -0.05 -1.39 0.21 0.00 -0.80 0.00 0.00 55.06 53.03 2w3r s HIS 483 Cb -0.08 -0.40 0.57 0.00 -1.43 0.00 0.00 32.58 31.23 2w3r s HIS 483 CO -0.01 -0.90 1.67 0.78 -2.00 0.00 0.00 174.74 174.29 2w3r h GLY 484 N 2.27 0.00 -2.87 -1.38 0.00 -1.79 -3.44 103.07 95.87 2w3r h GLY 484 Ca -0.29 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.52 2w3r h GLY 484 CO 0.41 0.00 0.53 -0.32 0.00 0.00 0.00 176.54 177.17 2w3r s GLY 485 N -4.34 2.83 -0.12 4.60 0.00 -1.26 -4.90 107.32 104.13 2w3r s GLY 485 Ca 0.02 1.07 -0.04 0.00 0.00 0.00 0.00 44.72 45.77 2w3r s GLY 485 CO 0.68 1.56 0.02 -0.51 0.00 0.00 0.00 173.10 174.85 2w3r s THR 486 N -1.44 4.45 -0.36 0.90 -4.23 -1.26 -4.78 115.64 108.91 2w3r s THR 486 Ca 0.64 -0.18 -0.24 0.00 -1.18 0.00 0.00 61.69 60.73 2w3r s THR 486 Cb -0.33 -2.92 0.01 0.00 1.34 0.00 0.00 72.50 70.60 2w3r s THR 486 CO 0.40 0.55 0.83 -0.70 -0.54 0.00 0.00 174.62 175.17 2w3r s GLU 487 N -0.38 3.79 0.00 3.99 2.56 -1.26 -4.86 118.70 122.54 2w3r s GLU 487 Ca 0.08 0.41 0.03 0.00 0.00 0.00 0.00 54.97 55.49 2w3r s GLU 487 Cb -0.12 -3.81 0.07 0.00 2.00 0.00 0.00 34.13 32.27 2w3r s GLU 487 CO 0.02 -0.88 0.95 0.00 -0.56 0.00 0.00 175.26 174.79 2w3r n MET 488 N 6.54 2.03 0.00 4.30 0.00 -1.26 -0.69 117.12 128.04 2w3r n MET 488 Ca 0.04 -1.40 0.00 0.00 0.00 0.00 0.00 57.70 56.34 2w3r n MET 488 Cb 0.48 -1.07 0.00 0.00 0.00 0.00 0.00 33.22 32.63 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 -0.11 1.26 0.00 3.17 0.00 -1.26 -3.27 105.19 104.98 2w3r n GLY 489 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.19 0.58 -2.13 1.61 0.00 -1.26 -4.84 117.38 111.15 2w3r n GLN 490 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 57.00 56.91 2w3r n GLN 490 Cb 0.00 -1.44 -0.01 0.00 0.00 0.00 0.00 30.24 28.79 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 0.16 0.04 0.25 2.61 0.00 -1.26 -4.95 105.19 102.05 2w3r n GLY 491 Ca 0.12 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 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 0.81 -0.65 0.99 5.85 -1.91 -2.90 115.31 117.50 2w3r h LEU 492 Ca -0.22 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 2w3r h LEU 492 Cb 1.14 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 2w3r h LEU 492 CO 0.26 0.88 0.18 0.45 -0.34 0.00 0.00 178.44 179.87 2w3r h HIS 493 N 0.72 1.07 -0.37 1.25 3.86 -1.93 -1.01 115.15 118.73 2w3r h HIS 493 Ca 0.15 -0.12 0.02 0.00 -1.16 0.00 0.00 60.37 59.26 2w3r h HIS 493 Cb 0.42 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 2w3r h HIS 493 CO 0.03 0.88 0.20 0.00 0.86 0.00 0.00 177.93 179.90 2w3r h ALA 494 N 1.07 0.46 -0.58 2.45 0.00 -1.91 -0.40 119.26 120.35 2w3r h ALA 494 Ca 0.21 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2w3r h ALA 494 Cb 0.33 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2w3r h ALA 494 CO -0.00 -0.15 0.38 0.87 0.00 0.00 0.00 179.25 180.35 2w3r h LYS 495 N 0.41 0.75 -0.64 0.00 1.57 -1.28 0.35 116.57 117.73 2w3r h LYS 495 Ca 0.15 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 2w3r h LYS 495 Cb 0.03 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 2w3r h LYS 495 CO -0.08 0.49 0.12 0.52 -0.57 0.00 0.00 179.45 179.93 2w3r h MET 496 N 0.77 1.03 0.26 3.15 2.86 -0.91 -1.58 114.93 120.50 2w3r h MET 496 Ca 0.22 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2w3r h MET 496 Cb -0.07 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.46 2w3r h MET 496 CO -0.06 0.93 -0.14 0.28 1.06 0.00 0.00 176.91 178.98 2w3r h VAL 497 N 0.97 0.71 -0.95 -2.22 2.07 -0.65 -1.70 116.25 114.47 2w3r h VAL 497 Ca 0.20 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.90 2w3r h VAL 497 Cb 0.40 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.79 2w3r h VAL 497 CO 0.01 0.00 0.60 1.56 0.02 0.00 0.00 177.57 179.76 2w3r h GLN 498 N -0.38 0.64 -0.01 1.57 4.20 -0.60 0.17 115.11 120.70 2w3r h GLN 498 Ca -0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2w3r h GLN 498 Cb 0.30 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2w3r h GLN 498 CO 0.04 0.42 -0.01 0.28 -0.67 0.00 0.00 178.83 178.89 2w3r h VAL 499 N 0.66 1.41 -0.41 -0.54 2.07 -1.16 -2.32 116.25 115.96 2w3r h VAL 499 Ca 0.51 -1.24 0.05 0.00 0.82 0.00 0.00 66.70 66.84 2w3r h VAL 499 Cb 0.91 2.23 -0.05 0.00 -1.52 0.00 0.00 31.29 32.87 2w3r h VAL 499 CO -0.26 0.33 0.14 0.00 0.02 0.00 0.00 177.57 177.79 2w3r h ALA 500 N 0.48 0.48 -0.70 1.67 0.00 -0.50 -0.04 119.26 120.66 2w3r h ALA 500 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2w3r h ALA 500 Cb 0.54 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2w3r h ALA 500 CO 0.00 -0.25 0.38 0.00 0.00 0.00 0.00 179.25 179.38 2w3r h ALA 501 N 1.27 1.35 0.14 0.00 0.00 -0.76 -1.64 119.26 119.63 2w3r h ALA 501 Ca 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2w3r h ALA 501 Cb 0.19 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2w3r h ALA 501 CO -0.20 0.53 -0.07 0.00 0.00 0.00 0.00 179.25 179.51 2w3r h ALA 502 N 1.44 -0.19 0.00 0.00 0.00 -0.85 -0.88 119.26 118.79 2w3r h ALA 502 Ca 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2w3r h ALA 502 Cb 0.03 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2w3r h ALA 502 CO -0.04 -0.46 -0.04 0.28 0.00 0.00 0.00 179.25 178.99 2w3r h VAL 503 N -0.47 0.17 0.00 0.00 2.07 -0.74 -2.33 116.25 114.95 2w3r h VAL 503 Ca -0.02 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2w3r h VAL 503 Cb 0.37 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2w3r h VAL 503 CO 0.03 0.04 -0.99 0.18 0.02 0.00 0.00 177.57 176.85 2w3r n LEU 504 N -3.23 0.80 -2.09 2.57 4.77 -0.64 -4.72 117.00 114.45 2w3r n LEU 504 Ca -0.01 -0.45 -0.13 0.00 -0.03 0.00 0.00 56.01 55.38 2w3r n LEU 504 Cb 0.23 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2w3r n LEU 504 CO 0.26 0.20 0.08 0.61 -1.33 0.00 0.00 177.39 177.21 2w3r n GLY 505 N 1.44 0.05 3.36 -0.72 0.00 -0.44 -4.66 105.19 104.21 2w3r n GLY 505 Ca 0.03 -0.19 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.06 1.77 0.18 -0.61 -4.36 -0.59 -0.85 121.20 113.67 2w3r s ILE 506 Ca 0.27 -2.22 -0.31 0.00 -0.26 0.00 0.00 60.65 58.13 2w3r s ILE 506 Cb -0.12 -2.09 -0.10 0.00 1.25 0.00 0.00 42.46 41.40 2w3r s ILE 506 CO 0.33 -0.56 1.56 -0.62 0.24 0.00 0.00 174.94 175.89 2w3r s ASP 507 N -3.34 6.58 0.54 4.36 -1.08 -1.26 -4.57 116.67 117.90 2w3r s ASP 507 Ca 0.23 2.64 0.41 0.00 -0.52 0.00 0.00 52.55 55.31 2w3r s ASP 507 Cb -0.01 -2.60 1.60 0.00 -1.46 0.00 0.00 42.92 40.46 2w3r s ASP 507 CO 0.08 -0.82 1.71 -0.65 0.52 0.00 0.00 175.17 176.01 2w3r h PRO 508 N 6.55 0.02 -0.00 4.34 0.10 -1.92 0.74 132.00 141.83 2w3r h PRO 508 Ca -0.43 -0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.67 2w3r h PRO 508 Cb 1.21 -0.00 -0.00 0.00 0.10 0.00 0.00 31.00 32.30 2w3r h PRO 508 CO 0.90 0.01 0.01 0.28 0.10 0.00 0.00 178.00 179.30 2w3r h VAL 509 N 0.02 0.32 0.00 3.15 2.07 -1.99 -0.34 116.25 119.48 2w3r h VAL 509 Ca 0.72 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.24 2w3r h VAL 509 Cb 2.82 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 2w3r h VAL 509 CO -0.05 0.00 0.00 1.56 0.02 0.00 0.00 177.57 179.10 2w3r h GLN 510 N 0.00 0.00 -5.28 1.57 1.08 -1.21 -3.44 115.11 107.83 2w3r h GLN 510 Ca 0.00 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.59 2w3r h GLN 510 Cb 0.01 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 27.32 2w3r h GLN 510 CO -0.00 0.00 -0.38 0.08 -0.95 0.00 0.00 178.83 177.58 2w3r s VAL 511 N -3.36 5.31 -0.17 -0.54 1.01 -0.14 -0.14 120.40 122.37 2w3r s VAL 511 Ca 0.05 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.44 2w3r s VAL 511 Cb 0.07 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2w3r s VAL 511 CO 0.60 0.33 -0.16 -0.60 0.00 0.00 0.00 175.10 175.27 2w3r s ARG 512 N 0.97 3.16 0.05 2.72 6.06 0.85 -4.97 118.95 127.78 2w3r s ARG 512 Ca 0.13 -0.77 -0.29 0.00 -2.50 0.00 0.00 55.73 52.30 2w3r s ARG 512 Cb -0.14 -2.64 -0.05 0.00 0.06 0.00 0.00 34.95 32.19 2w3r s ARG 512 CO 0.05 -0.08 0.93 -1.50 -2.50 0.00 0.00 175.30 172.19 2w3r s ILE 513 N 1.04 4.71 0.32 4.11 1.10 -1.26 -0.87 121.20 130.35 2w3r s ILE 513 Ca -0.01 1.97 0.06 0.00 -0.51 0.00 0.00 60.65 62.17 2w3r s ILE 513 Cb -0.15 -4.28 -0.01 0.00 0.15 0.00 0.00 42.46 38.17 2w3r s ILE 513 CO -0.04 0.26 0.44 0.42 -2.11 0.00 0.00 174.94 173.91 2w3r s THR 514 N 0.43 4.16 0.54 4.00 -4.23 -0.38 -4.93 115.64 115.23 2w3r s THR 514 Ca 0.47 -1.03 -0.20 0.00 -1.18 0.00 0.00 61.69 59.75 2w3r s THR 514 Cb -0.22 -3.44 -0.05 0.00 1.34 0.00 0.00 72.50 70.13 2w3r s THR 514 CO 0.27 -0.18 1.20 0.00 -0.54 0.00 0.00 174.62 175.38 2w3r s ALA 515 N -2.16 2.73 -0.40 3.99 0.00 -1.26 -4.79 121.76 119.87 2w3r s ALA 515 Ca 0.43 1.00 -0.28 0.00 0.00 0.00 0.00 51.96 53.12 2w3r s ALA 515 Cb -0.09 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2w3r s ALA 515 CO 0.30 -0.98 1.95 0.99 0.00 0.00 0.00 175.76 178.02 2w3r s THR 516 N -1.57 3.32 -0.11 0.00 2.01 0.48 -4.83 115.64 114.95 2w3r s THR 516 Ca 0.72 0.29 0.01 0.00 0.31 0.00 0.00 61.69 63.02 2w3r s THR 516 Cb -0.30 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 2w3r s THR 516 CO 0.34 -0.41 -0.14 -0.62 -0.69 0.00 0.00 174.62 173.11 2w3r s ASP 517 N 7.67 4.00 0.47 3.53 3.68 -1.26 -0.11 116.67 134.65 2w3r s ASP 517 Ca 0.82 -0.29 0.26 0.00 2.13 0.00 0.00 52.55 55.47 2w3r s ASP 517 Cb -0.21 -1.40 0.77 0.00 -1.45 0.00 0.00 42.92 40.63 2w3r s ASP 517 CO 0.30 0.21 1.76 0.71 0.13 0.00 0.00 175.17 178.29 2w3r h THR 518 N 5.12 0.14 -0.01 1.71 1.35 -1.58 -2.29 112.91 117.36 2w3r h THR 518 Ca -0.31 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 2w3r h THR 518 Cb 1.20 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.44 2w3r h THR 518 CO 0.54 0.07 -0.09 -1.54 -0.25 0.00 0.00 175.52 174.24 2w3r n SER 519 N -3.14 0.95 -0.13 5.36 3.41 -1.26 -3.71 113.62 115.10 2w3r n SER 519 Ca 0.02 -1.06 -0.24 0.00 -0.26 0.00 0.00 58.87 57.33 2w3r n SER 519 Cb 0.45 0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.31 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 -0.45 0.62 -3.87 4.33 5.02 -1.04 -4.91 118.16 117.86 2w3r n LYS 520 Ca 0.17 0.21 -0.28 0.00 -2.02 0.00 0.00 58.31 56.39 2w3r n LYS 520 Cb 0.31 -1.51 -0.17 0.00 -0.02 0.00 0.00 35.03 33.64 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 -2.51 1.00 0.52 -0.18 1.01 -0.89 -4.81 120.40 114.53 2w3r s VAL 521 Ca -0.37 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2w3r s VAL 521 Cb 0.12 -1.18 0.03 0.00 0.00 0.00 0.00 36.38 35.35 2w3r s VAL 521 CO 0.54 0.14 0.73 -2.16 0.00 0.00 0.00 175.10 174.35 2w3r s PRO 522 N 1.69 2.65 -1.32 2.72 0.04 -1.24 -4.40 135.00 135.13 2w3r s PRO 522 Ca 0.01 -0.83 -0.06 0.00 0.04 0.00 0.00 61.00 60.16 2w3r s PRO 522 Cb -0.15 -2.54 0.04 0.00 0.04 0.00 0.00 34.50 31.89 2w3r s PRO 522 CO -0.08 -0.59 0.43 0.09 0.04 0.00 0.00 177.00 176.90 2w3r n ASN 523 N -2.23 -4.40 -4.82 6.66 3.02 -1.26 -4.93 115.26 107.30 2w3r n ASN 523 Ca 0.07 -0.26 -0.33 0.00 -0.03 0.00 0.00 54.58 54.03 2w3r n ASN 523 Cb 0.59 -3.63 -0.07 0.00 -0.61 0.00 0.00 39.78 36.07 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 -2.95 4.43 0.63 3.41 -4.23 -1.26 -5.02 115.64 110.65 2w3r s THR 524 Ca 0.30 1.42 -0.08 0.00 -1.18 0.00 0.00 61.69 62.16 2w3r s THR 524 Cb -0.15 -3.61 0.01 0.00 1.34 0.00 0.00 72.50 70.09 2w3r s THR 524 CO 0.37 -0.34 0.96 -0.44 -0.54 0.00 0.00 174.62 174.64 2w3r s SER 525 N -2.26 5.52 0.54 3.99 0.01 -1.26 -4.63 113.70 115.61 2w3r s SER 525 Ca 0.61 0.82 -0.21 0.00 1.31 0.00 0.00 55.95 58.48 2w3r s SER 525 Cb -0.09 -1.75 -0.05 0.00 0.21 0.00 0.00 66.02 64.34 2w3r s SER 525 CO 0.15 -1.16 1.26 0.00 0.41 0.00 0.00 173.24 173.89 2w3r n ALA 526 N -2.72 1.20 -2.52 1.44 0.00 -1.26 -4.90 120.51 111.75 2w3r n ALA 526 Ca 0.05 0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.21 2w3r n ALA 526 Cb 0.58 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.71 2w3r n ALA 526 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2w3r s THR 527 N -1.32 3.81 0.39 0.00 2.01 -0.42 -4.86 115.64 115.25 2w3r s THR 527 Ca 0.72 -0.33 -0.16 0.00 0.31 0.00 0.00 61.69 62.24 2w3r s THR 527 Cb -0.43 -4.93 0.06 0.00 0.01 0.00 0.00 72.50 67.21 2w3r s THR 527 CO 0.49 -1.84 0.81 0.00 -0.69 0.00 0.00 174.62 173.40 2w3r s ALA 528 N 5.60 -0.74 -1.66 7.40 0.00 -1.26 -4.94 121.76 126.16 2w3r s ALA 528 Ca 0.44 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2w3r s ALA 528 Cb -0.03 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.75 2w3r s ALA 528 CO -0.00 -0.99 0.00 0.00 0.00 0.00 0.00 175.76 174.77 2w3r n ALA 529 N -0.55 -0.24 -1.33 0.00 0.00 -1.26 -1.81 120.51 115.33 2w3r n ALA 529 Ca -0.09 0.25 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 2w3r n ALA 529 Cb 0.60 -1.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.08 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 -1.28 -5.74 -0.33 0.00 7.64 -1.26 -4.29 113.62 108.36 2w3r n SER 530 Ca -0.16 0.28 0.14 0.00 1.01 0.00 0.00 58.87 60.14 2w3r n SER 530 Cb 0.64 -4.23 0.59 0.00 -1.01 0.00 0.00 64.21 60.20 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 -1.20 1.07 0.20 6.43 3.41 -0.75 -4.35 113.62 118.42 2w3r n SER 531 Ca -0.11 -1.25 -0.15 0.00 -0.26 0.00 0.00 58.87 57.10 2w3r n SER 531 Cb 0.60 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.51 1.37 5.00 0.00 -1.89 -2.13 103.07 109.81 2w3r h GLY 532 Ca 0.00 0.22 -0.21 0.00 0.00 0.00 0.00 47.33 47.34 2w3r h GLY 532 CO 0.00 -0.20 -0.78 0.00 0.00 0.00 0.00 176.54 175.56 2w3r h ALA 533 N 0.16 0.43 0.91 3.60 0.00 -1.95 -2.87 119.26 119.53 2w3r h ALA 533 Ca -0.03 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 2w3r h ALA 533 Cb 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2w3r h ALA 533 CO 0.03 0.72 -0.48 -0.44 0.00 0.00 0.00 179.25 179.08 2w3r h ASP 534 N 0.41 -1.16 0.02 0.00 5.19 -1.78 -1.79 116.42 117.31 2w3r h ASP 534 Ca -0.05 0.05 -0.07 0.00 -0.62 0.00 0.00 57.03 56.34 2w3r h ASP 534 Cb 1.39 0.32 0.01 0.00 0.18 0.00 0.00 39.33 41.22 2w3r h ASP 534 CO 0.15 -0.78 -0.29 0.24 -3.12 0.00 0.00 179.24 175.44 2w3r h MET 535 N -1.27 0.17 -0.11 3.56 2.86 -1.51 -2.88 114.93 115.75 2w3r h MET 535 Ca -0.12 -0.20 -0.09 0.00 -2.06 0.00 0.00 59.70 57.22 2w3r h MET 535 Cb 0.99 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 2w3r h MET 535 CO 0.18 0.98 -0.35 -0.91 1.06 0.00 0.00 176.91 177.87 2w3r h ASN 536 N -0.55 0.23 -0.27 1.22 2.35 -1.67 -1.16 115.58 115.73 2w3r h ASN 536 Ca -0.04 -0.09 0.05 0.00 -0.55 0.00 0.00 56.30 55.67 2w3r h ASN 536 Cb 1.09 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.36 2w3r h ASN 536 CO 0.06 0.57 -0.00 1.23 -1.65 0.00 0.00 177.43 177.64 2w3r h GLY 537 N 1.12 0.26 0.83 2.83 0.00 -1.35 0.30 103.07 107.06 2w3r h GLY 537 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2w3r h GLY 537 CO 0.05 -0.06 0.04 -0.33 0.00 0.00 0.00 176.54 176.24 2w3r h MET 538 N 0.08 0.23 -0.87 4.80 2.86 -1.32 -1.04 114.93 119.67 2w3r h MET 538 Ca 0.13 -0.05 0.07 0.00 -2.06 0.00 0.00 59.70 57.79 2w3r h MET 538 Cb 0.17 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.73 2w3r h MET 538 CO -0.22 0.38 0.54 0.00 1.06 0.00 0.00 176.91 178.67 2w3r h ALA 539 N 0.84 1.22 -0.09 6.32 0.00 -0.89 0.15 119.26 126.81 2w3r h ALA 539 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2w3r h ALA 539 Cb 0.25 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2w3r h ALA 539 CO 0.00 0.25 0.02 0.28 0.00 0.00 0.00 179.25 179.80 2w3r h VAL 540 N 0.95 1.19 -0.97 0.00 2.07 -0.33 -2.68 116.25 116.48 2w3r h VAL 540 Ca 0.39 -0.57 0.13 0.00 0.82 0.00 0.00 66.70 67.47 2w3r h VAL 540 Cb 0.23 1.41 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 2w3r h VAL 540 CO -0.19 0.16 0.61 0.50 0.02 0.00 0.00 177.57 178.67 2w3r h LYS 541 N -0.06 0.85 -0.69 1.57 3.64 -0.60 -2.14 116.57 119.13 2w3r h LYS 541 Ca 0.03 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2w3r h LYS 541 Cb 0.24 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2w3r h LYS 541 CO -0.00 0.56 0.30 0.22 -2.27 0.00 0.00 179.45 178.26 2w3r h ASP 542 N 0.88 0.94 0.60 4.20 3.58 -0.52 -1.54 116.42 124.55 2w3r h ASP 542 Ca 0.49 -0.16 -0.13 0.00 0.42 0.00 0.00 57.03 57.65 2w3r h ASP 542 Cb 0.60 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 2w3r h ASP 542 CO -0.25 0.83 -0.61 0.00 -2.88 0.00 0.00 179.24 176.33 2w3r h ALA 543 N 1.14 0.99 0.23 -0.78 0.00 -1.10 -2.87 119.26 116.86 2w3r h ALA 543 Ca 0.23 -0.56 -0.30 0.00 0.00 0.00 0.00 54.91 54.29 2w3r h ALA 543 Cb 0.17 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.90 2w3r h ALA 543 CO -0.02 0.76 -1.33 0.00 0.00 0.00 0.00 179.25 178.65 2w3r h GLU 545 N 0.02 0.29 -0.15 0.00 5.08 -1.37 0.47 114.58 118.92 2w3r h GLU 545 Ca -0.23 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2w3r h GLU 545 Cb 2.04 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.24 2w3r h GLU 545 CO 0.24 0.38 0.08 1.15 -1.00 0.00 0.00 179.01 179.86 2w3r h THR 546 N 0.28 1.12 -0.15 1.13 2.02 -1.51 0.01 112.91 115.80 2w3r h THR 546 Ca 0.06 -0.33 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 2w3r h THR 546 Cb 0.31 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2w3r h THR 546 CO 0.01 0.11 -0.15 -0.07 0.37 0.00 0.00 175.52 175.79 2w3r h LEU 547 N 0.13 0.40 -1.08 2.58 3.38 -1.09 -1.12 115.31 118.50 2w3r h LEU 547 Ca 0.05 -0.48 0.10 0.00 0.09 0.00 0.00 57.88 57.65 2w3r h LEU 547 Cb 0.10 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 2w3r h LEU 547 CO -0.01 0.79 0.62 -0.09 0.09 0.00 0.00 178.44 179.84 2w3r h ARG 548 N 0.01 0.96 -0.29 1.13 2.43 -0.11 -1.73 114.38 116.79 2w3r h ARG 548 Ca 0.03 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 2w3r h ARG 548 Cb 0.68 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2w3r h ARG 548 CO 0.04 0.64 0.00 0.78 -1.51 0.00 0.00 179.97 179.91 2w3r h GLY 549 N 0.99 0.55 1.02 2.80 0.00 -0.80 -1.25 103.07 106.39 2w3r h GLY 549 Ca 0.45 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 2w3r h GLY 549 CO -0.21 0.37 0.45 3.21 0.00 0.00 0.00 176.54 180.37 2w3r h ARG 550 N 0.30 1.18 -0.09 4.80 3.08 -0.76 -0.98 114.38 121.91 2w3r h ARG 550 Ca 0.08 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2w3r h ARG 550 Cb 0.43 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 2w3r h ARG 550 CO 0.01 0.87 -0.04 -0.07 -1.07 0.00 0.00 179.97 179.68 2w3r h LEU 551 N 1.18 0.19 -0.98 3.04 3.38 -1.29 -2.63 115.31 118.20 2w3r h LEU 551 Ca 0.30 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2w3r h LEU 551 Cb 0.04 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2w3r h LEU 551 CO -0.05 0.55 0.49 0.00 0.09 0.00 0.00 178.44 179.52 2w3r h ALA 552 N 0.65 1.22 -0.72 1.53 0.00 -1.06 -0.12 119.26 120.77 2w3r h ALA 552 Ca 0.02 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 552 Cb 0.47 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2w3r h ALA 552 CO 0.01 0.64 0.48 0.78 0.00 0.00 0.00 179.25 181.16 2w3r h GLY 553 N 1.23 1.02 0.97 0.00 0.00 -1.20 0.83 103.07 105.91 2w3r h GLY 553 Ca 0.31 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2w3r h GLY 553 CO -0.05 0.37 -0.17 -2.75 0.00 0.00 0.00 176.54 173.94 2w3r h PHE 554 N 0.98 -0.43 -0.27 5.60 3.57 -0.93 -1.26 116.94 124.19 2w3r h PHE 554 Ca 0.26 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.81 2w3r h PHE 554 Cb -0.11 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 2w3r h PHE 554 CO -0.02 -0.25 -0.08 0.28 -2.23 0.00 0.00 178.31 176.01 2w3r h VAL 555 N -0.50 0.70 -0.65 1.41 2.07 -0.91 -0.14 116.25 118.23 2w3r h VAL 555 Ca -0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.49 2w3r h VAL 555 Cb 0.38 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2w3r h VAL 555 CO 0.08 0.00 0.42 0.00 0.02 0.00 0.00 177.57 178.09 2w3r h ALA 556 N 1.25 0.84 0.18 1.67 0.00 -0.73 0.18 119.26 122.66 2w3r h ALA 556 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2w3r h ALA 556 Cb 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2w3r h ALA 556 CO -0.29 0.20 -0.09 0.00 0.00 0.00 0.00 179.25 179.07 2w3r h ALA 557 N 1.27 -0.24 -0.67 0.00 0.00 -0.97 0.60 119.26 119.25 2w3r h ALA 557 Ca 0.25 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2w3r h ALA 557 Cb -0.03 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2w3r h ALA 557 CO -0.08 -0.55 0.44 -0.09 0.00 0.00 0.00 179.25 178.96 2w3r h ARG 558 N -0.41 0.63 -0.38 0.00 1.12 -0.60 -1.91 114.38 112.83 2w3r h ARG 558 Ca -0.02 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.81 2w3r h ARG 558 Cb 0.32 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.14 2w3r h ARG 558 CO 0.04 0.42 0.00 0.39 -3.11 0.00 0.00 179.97 177.71 2w3r n GLU 559 N -4.48 2.97 -3.37 0.20 -0.58 0.58 -5.04 120.64 110.93 2w3r n GLU 559 Ca 0.10 -2.36 -0.30 0.00 -0.42 0.00 0.00 57.16 54.18 2w3r n GLU 559 Cb 0.25 -1.49 0.03 0.00 -0.57 0.00 0.00 31.44 29.66 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 0.39 -0.35 1.46 0.62 0.00 0.18 -4.96 105.19 102.53 2w3r n GLY 560 Ca 0.16 1.12 -0.02 0.00 0.00 0.00 0.00 46.02 47.28 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 -1.40 3.11 0.30 0.00 0.00 -1.26 -4.49 121.76 118.01 2w3r s ALA 562 Ca 0.08 0.83 0.09 0.00 0.00 0.00 0.00 51.96 52.95 2w3r s ALA 562 Cb -0.01 -3.33 0.46 0.00 0.00 0.00 0.00 23.12 20.24 2w3r s ALA 562 CO 0.03 -0.38 1.68 0.00 0.00 0.00 0.00 175.76 177.10 2w3r h ALA 563 N 2.56 1.10 0.00 0.00 0.00 -1.92 -2.90 119.26 118.10 2w3r h ALA 563 Ca -0.48 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 53.97 2w3r h ALA 563 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2w3r h ALA 563 CO 0.62 0.63 0.00 2.89 0.00 0.00 0.00 179.25 183.39 2w3r n ARG 564 N -3.96 0.66 0.00 0.00 1.85 -1.26 -2.07 116.66 111.88 2w3r n ARG 564 Ca -0.02 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 56.91 2w3r n ARG 564 Cb 0.52 -1.12 -0.05 0.00 -1.05 0.00 0.00 32.46 30.76 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 -0.62 1.17 -4.61 2.89 8.00 -1.09 -4.91 116.55 117.37 2w3r n ASP 565 Ca 0.04 -1.08 -0.43 0.00 0.71 0.00 0.00 54.79 54.03 2w3r n ASP 565 Cb 0.02 0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 41.84 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 -2.26 4.58 -0.23 2.53 1.01 -0.88 -4.53 120.40 120.63 2w3r s VAL 566 Ca 0.10 1.31 -0.09 0.00 0.00 0.00 0.00 61.98 63.29 2w3r s VAL 566 Cb 0.13 -4.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 2w3r s VAL 566 CO 0.55 -0.50 0.13 -0.63 0.00 0.00 0.00 175.10 174.64 2w3r s ILE 567 N 3.48 5.13 -0.26 2.22 1.01 0.31 -4.90 121.20 128.18 2w3r s ILE 567 Ca 0.39 0.10 -0.07 0.00 0.00 0.00 0.00 60.65 61.07 2w3r s ILE 567 Cb -0.12 -3.37 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 2w3r s ILE 567 CO 0.18 0.37 0.07 -0.36 0.00 0.00 0.00 174.94 175.20 2w3r s PHE 568 N 0.94 3.10 -0.28 3.97 0.40 -1.26 -0.60 117.98 124.24 2w3r s PHE 568 Ca 0.06 -0.59 -0.21 0.00 -0.60 0.00 0.00 56.93 55.59 2w3r s PHE 568 Cb -0.13 -2.25 0.12 0.00 0.51 0.00 0.00 43.02 41.27 2w3r s PHE 568 CO 0.03 -0.43 0.94 0.34 0.70 0.00 0.00 175.22 176.80 2w3r s ASP 569 N 1.58 -0.56 -1.42 1.36 3.68 -0.91 -4.48 116.67 115.92 2w3r s ASP 569 Ca 0.05 0.99 -0.06 0.00 2.13 0.00 0.00 52.55 55.67 2w3r s ASP 569 Cb -0.16 1.10 0.04 0.00 -1.45 0.00 0.00 42.92 42.45 2w3r s ASP 569 CO 0.03 -0.17 0.74 0.00 0.13 0.00 0.00 175.17 175.91 2w3r n ALA 570 N 2.94 -1.74 -1.05 3.66 0.00 -0.74 -1.76 120.51 121.83 2w3r n ALA 570 Ca -0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.21 2w3r n ALA 570 Cb 0.57 -2.75 -0.01 0.00 0.00 0.00 0.00 19.45 17.26 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 -1.68 0.46 3.29 0.00 0.00 -0.03 -4.96 105.19 102.27 2w3r n GLY 571 Ca -0.17 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.17 1.27 -0.12 1.61 -1.52 -0.72 -2.16 119.66 116.85 2w3r s GLN 572 Ca 0.00 -1.10 0.03 0.00 -1.95 0.00 0.00 55.36 52.34 2w3r s GLN 572 Cb 0.00 -1.50 0.00 0.00 -0.22 0.00 0.00 33.01 31.29 2w3r s GLN 572 CO 0.00 0.36 -0.22 0.08 -0.25 0.00 0.00 175.29 175.27 2w3r s VAL 573 N -1.01 2.20 -0.10 1.09 1.01 -0.46 -2.14 120.40 120.99 2w3r s VAL 573 Ca 0.08 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2w3r s VAL 573 Cb -0.10 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.44 2w3r s VAL 573 CO 0.03 0.55 -0.10 -1.10 0.00 0.00 0.00 175.10 174.48 2w3r s GLN 574 N 0.48 1.68 -0.19 2.72 -0.21 0.23 -1.57 119.66 122.79 2w3r s GLN 574 Ca -0.15 -0.35 -0.25 0.00 0.02 0.00 0.00 55.36 54.63 2w3r s GLN 574 Cb -0.17 -1.57 0.07 0.00 1.00 0.00 0.00 33.01 32.33 2w3r s GLN 574 CO 0.06 -0.14 0.67 0.00 -2.12 0.00 0.00 175.29 173.75 2w3r s ALA 575 N 1.26 -1.67 -1.46 6.09 0.00 -0.73 -0.53 121.76 124.73 2w3r s ALA 575 Ca -0.03 1.71 -0.07 0.00 0.00 0.00 0.00 51.96 53.57 2w3r s ALA 575 Cb -0.14 -0.79 0.01 0.00 0.00 0.00 0.00 23.12 22.20 2w3r s ALA 575 CO -0.04 -0.33 0.92 0.43 0.00 0.00 0.00 175.76 176.74 2w3r n SER 576 N 2.21 -6.23 -2.16 0.00 7.64 -1.26 -1.90 113.62 111.92 2w3r n SER 576 Ca -0.15 -0.43 -0.19 0.00 1.01 0.00 0.00 58.87 59.10 2w3r n SER 576 Cb 0.56 -4.96 -0.03 0.00 -1.01 0.00 0.00 64.21 58.76 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 -1.78 0.17 3.07 0.23 0.00 -1.26 -4.98 105.19 100.64 2w3r n GLY 577 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 -4.63 1.75 -0.02 1.61 1.02 -0.80 -5.14 119.74 113.53 2w3r s LYS 578 Ca 0.00 -0.50 0.07 0.00 0.02 0.00 0.00 55.97 55.56 2w3r s LYS 578 Cb 0.00 -1.47 -0.02 0.00 -0.52 0.00 0.00 37.83 35.82 2w3r s LYS 578 CO 0.00 0.12 -0.24 -1.54 -0.92 0.00 0.00 175.35 172.76 2w3r s SER 579 N 0.39 3.20 0.40 2.83 1.04 -1.26 -1.77 113.70 118.52 2w3r s SER 579 Ca -0.10 -0.44 0.04 0.00 0.48 0.00 0.00 55.95 55.93 2w3r s SER 579 Cb -0.14 -0.41 -0.05 0.00 0.10 0.00 0.00 66.02 65.53 2w3r s SER 579 CO 0.03 0.32 0.06 0.26 0.98 0.00 0.00 173.24 174.89 2w3r s TRP 580 N -0.64 1.99 0.39 5.02 0.51 -0.61 -4.97 118.94 120.63 2w3r s TRP 580 Ca 0.10 -1.00 -0.18 0.00 -2.12 0.00 0.00 56.10 52.91 2w3r s TRP 580 Cb -0.10 -1.40 -0.10 0.00 -0.81 0.00 0.00 33.47 31.06 2w3r s TRP 580 CO -0.01 0.04 0.86 1.03 -0.51 0.00 0.00 176.95 178.37 2w3r s ARG 581 N -3.81 4.10 0.19 4.98 0.52 -1.26 -1.35 118.95 122.32 2w3r s ARG 581 Ca 0.27 0.90 -0.12 0.00 -0.52 0.00 0.00 55.73 56.26 2w3r s ARG 581 Cb 0.06 -2.29 0.21 0.00 0.52 0.00 0.00 34.95 33.46 2w3r s ARG 581 CO 0.13 0.03 1.71 0.35 0.02 0.00 0.00 175.30 177.55 2w3r h PHE 582 N 1.96 0.17 -0.99 -0.53 3.57 -1.74 -0.88 116.94 118.50 2w3r h PHE 582 Ca -0.48 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.15 2w3r h PHE 582 Cb 1.18 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.84 2w3r h PHE 582 CO 0.62 -0.01 0.62 0.00 -2.23 0.00 0.00 178.31 177.31 2w3r h ALA 583 N 1.41 1.45 -0.05 2.41 0.00 -1.86 -1.14 119.26 121.49 2w3r h ALA 583 Ca 0.26 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2w3r h ALA 583 Cb 0.36 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2w3r h ALA 583 CO -0.34 0.26 0.02 0.93 0.00 0.00 0.00 179.25 180.12 2w3r h GLU 584 N 1.02 0.08 -0.80 0.00 5.08 -1.56 -1.56 114.58 116.84 2w3r h GLU 584 Ca 0.47 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.82 2w3r h GLU 584 Cb 0.40 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2w3r h GLU 584 CO -0.24 0.26 0.53 0.82 -1.00 0.00 0.00 179.01 179.38 2w3r h ILE 585 N -0.12 1.20 0.06 3.13 1.08 -0.74 0.41 117.51 122.54 2w3r h ILE 585 Ca 0.02 -0.37 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 2w3r h ILE 585 Cb 0.22 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 2w3r h ILE 585 CO -0.00 0.20 -0.03 0.58 -0.69 0.00 0.00 178.15 178.21 2w3r h VAL 586 N 1.08 1.20 -0.86 1.67 2.07 -1.10 -0.38 116.25 119.94 2w3r h VAL 586 Ca 0.29 -0.97 0.08 0.00 0.82 0.00 0.00 66.70 66.93 2w3r h VAL 586 Cb -0.12 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 2w3r h VAL 586 CO -0.06 0.24 0.56 0.00 0.02 0.00 0.00 177.57 178.32 2w3r h ALA 587 N 0.37 1.61 -0.10 1.67 0.00 -1.15 0.20 119.26 121.86 2w3r h ALA 587 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2w3r h ALA 587 Cb 0.45 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2w3r h ALA 587 CO 0.01 0.24 0.06 0.00 0.00 0.00 0.00 179.25 179.57 2w3r h ALA 588 N 1.55 0.13 -0.27 0.00 0.00 -0.79 -2.53 119.26 117.35 2w3r h ALA 588 Ca 0.38 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 2w3r h ALA 588 Cb 0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 588 CO -0.15 -0.38 -0.04 0.00 0.00 0.00 0.00 179.25 178.68 2w3r h ALA 589 N 1.03 1.43 -0.01 0.00 0.00 0.21 -1.06 119.26 120.86 2w3r h ALA 589 Ca 0.04 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2w3r h ALA 589 Cb -0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2w3r h ALA 589 CO -0.01 0.40 -0.06 -0.92 0.00 0.00 0.00 179.25 178.66 2w3r h TYR 590 N 0.40 -0.16 -0.84 0.00 3.20 -0.46 -1.55 116.97 117.56 2w3r h TYR 590 Ca 0.09 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.99 2w3r h TYR 590 Cb 0.34 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.63 2w3r h TYR 590 CO 0.01 -0.10 0.55 0.52 -1.64 0.00 0.00 178.16 177.50 2w3r h MET 591 N -0.11 1.04 0.00 1.82 2.86 -1.02 -0.65 114.93 118.86 2w3r h MET 591 Ca 0.03 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2w3r h MET 591 Cb 0.14 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.57 2w3r h MET 591 CO -0.07 0.69 0.00 0.00 1.06 0.00 0.00 176.91 178.58 2w3r n ALA 592 N -2.34 1.72 -3.11 6.32 0.00 -0.44 -4.90 120.51 117.76 2w3r n ALA 592 Ca 0.10 -0.06 -0.14 0.00 0.00 0.00 0.00 53.44 53.35 2w3r n ALA 592 Cb 0.08 -1.18 0.07 0.00 0.00 0.00 0.00 19.45 18.41 2w3r n ALA 592 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2w3r n ARG 593 N -1.24 -2.55 -5.12 0.00 1.74 -0.25 -5.05 116.66 104.19 2w3r n ARG 593 Ca 0.06 0.78 -0.32 0.00 -0.77 0.00 0.00 57.85 57.60 2w3r n ARG 593 Cb 0.08 -5.44 -0.15 0.00 -1.02 0.00 0.00 32.46 25.93 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 -3.35 2.44 0.05 0.55 1.01 -0.82 -5.04 121.20 116.03 2w3r s ILE 594 Ca 0.36 -0.94 -0.31 0.00 0.00 0.00 0.00 60.65 59.77 2w3r s ILE 594 Cb -0.05 -1.91 -0.07 0.00 0.01 0.00 0.00 42.46 40.44 2w3r s ILE 594 CO 0.67 0.57 1.49 -0.55 0.00 0.00 0.00 174.94 177.12 2w3r s SER 595 N -0.37 6.75 -0.32 3.58 0.15 -1.26 -4.63 113.70 117.61 2w3r s SER 595 Ca 0.03 2.29 0.09 0.00 0.70 0.00 0.00 55.95 59.06 2w3r s SER 595 Cb -0.12 -2.57 0.57 0.00 -1.71 0.00 0.00 66.02 62.19 2w3r s SER 595 CO 0.02 -0.77 1.60 0.18 1.20 0.00 0.00 173.24 175.47 2w3r n LEU 596 N 5.17 4.89 -4.14 3.45 4.77 -1.26 -4.93 117.00 124.95 2w3r n LEU 596 Ca 0.14 -3.59 -0.23 0.00 -0.03 0.00 0.00 56.01 52.29 2w3r n LEU 596 Cb 0.42 -0.68 -0.15 0.00 -2.33 0.00 0.00 43.42 40.68 2w3r n LEU 596 CO 0.60 1.10 -0.49 -0.55 -1.33 0.00 0.00 177.39 176.72 2w3r s SER 597 N -2.04 1.83 -0.28 -1.43 0.15 -1.26 -1.06 113.70 109.61 2w3r s SER 597 Ca 0.48 -0.29 -0.19 0.00 0.70 0.00 0.00 55.95 56.65 2w3r s SER 597 Cb 0.42 -0.20 0.09 0.00 -1.71 0.00 0.00 66.02 64.62 2w3r s SER 597 CO 0.05 0.18 0.76 0.00 1.20 0.00 0.00 173.24 175.44 2w3r s ALA 598 N -0.39 -1.92 0.49 5.45 0.00 -0.90 -5.02 121.76 119.46 2w3r s ALA 598 Ca 0.06 2.26 -0.04 0.00 0.00 0.00 0.00 51.96 54.24 2w3r s ALA 598 Cb -0.06 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 2w3r s ALA 598 CO -0.00 -0.35 0.77 0.95 0.00 0.00 0.00 175.76 177.12 2w3r s THR 599 N 1.20 4.59 0.01 0.00 -4.23 -1.26 -1.26 115.64 114.68 2w3r s THR 599 Ca -0.07 0.02 -0.00 0.00 -1.18 0.00 0.00 61.69 60.46 2w3r s THR 599 Cb -0.05 -3.74 -0.01 0.00 1.34 0.00 0.00 72.50 70.04 2w3r s THR 599 CO -0.13 -0.69 -0.00 -0.83 -0.54 0.00 0.00 174.62 172.42 2w3r s GLY 600 N -4.15 0.09 0.02 3.99 0.00 0.66 -4.23 107.32 103.69 2w3r s GLY 600 Ca 0.48 -0.21 0.01 0.00 0.00 0.00 0.00 44.72 45.00 2w3r s GLY 600 CO 0.43 -0.24 -0.04 -0.12 0.00 0.00 0.00 173.10 173.13 2w3r s PHE 601 N -0.57 0.34 -0.01 1.90 5.36 -1.26 0.14 117.98 123.87 2w3r s PHE 601 Ca -0.06 -0.43 -0.05 0.00 -0.96 0.00 0.00 56.93 55.42 2w3r s PHE 601 Cb -0.04 -0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.42 2w3r s PHE 601 CO -0.00 -0.13 0.10 -0.47 -1.46 0.00 0.00 175.22 173.26 2w3r s TYR 602 N -1.19 0.02 -0.04 10.12 5.04 -0.01 -4.62 117.35 126.68 2w3r s TYR 602 Ca -0.12 -0.05 -0.01 0.00 -2.44 0.00 0.00 57.07 54.46 2w3r s TYR 602 Cb -0.08 -0.04 0.03 0.00 0.35 0.00 0.00 41.96 42.22 2w3r s TYR 602 CO -0.01 -0.19 0.07 0.00 -1.34 0.00 0.00 175.55 174.08 2w3r s ALA 603 N -0.90 -0.02 -0.08 3.97 0.00 -1.26 -1.18 121.76 122.29 2w3r s ALA 603 Ca -0.10 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 2w3r s ALA 603 Cb -0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2w3r s ALA 603 CO 0.01 -0.15 1.37 0.99 0.00 0.00 0.00 175.76 177.99 2w3r s THR 604 N 1.17 3.97 0.86 0.00 2.01 -0.77 -5.02 115.64 117.86 2w3r s THR 604 Ca -0.08 1.25 -0.11 0.00 0.31 0.00 0.00 61.69 63.05 2w3r s THR 604 Cb -0.13 -3.80 0.15 0.00 0.01 0.00 0.00 72.50 68.73 2w3r s THR 604 CO -0.04 -0.06 1.20 -2.16 -0.69 0.00 0.00 174.62 172.86 2w3r s PRO 605 N 3.12 1.23 0.00 4.92 0.04 -1.26 -4.46 135.00 138.59 2w3r s PRO 605 Ca 0.61 -0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.20 2w3r s PRO 605 Cb -0.27 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2w3r s PRO 605 CO 0.22 -1.96 0.00 1.63 0.04 0.00 0.00 177.00 176.94 2w3r n LYS 606 N -3.41 -0.03 -3.50 4.56 5.02 -1.26 -4.88 118.16 114.66 2w3r n LYS 606 Ca 0.13 0.01 -0.38 0.00 -2.02 0.00 0.00 58.31 56.05 2w3r n LYS 606 Cb 0.60 -2.98 -0.09 0.00 -0.02 0.00 0.00 35.03 32.54 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 4.06 -0.30 -0.35 1.43 -1.26 -4.84 118.68 117.42 2w3r s LEU 607 Ca 0.00 0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 2w3r s LEU 607 Cb 0.00 -2.29 0.18 0.00 0.03 0.00 0.00 46.19 44.11 2w3r s LEU 607 CO 0.00 -0.08 0.69 -0.55 0.23 0.00 0.00 176.35 176.64 2w3r s SER 608 N 1.49 -1.19 -0.07 2.29 0.15 -0.22 -5.02 113.70 111.13 2w3r s SER 608 Ca 0.12 0.82 -0.11 0.00 0.70 0.00 0.00 55.95 57.48 2w3r s SER 608 Cb -0.15 2.03 0.02 0.00 -1.71 0.00 0.00 66.02 66.21 2w3r s SER 608 CO 0.09 -0.22 0.27 -1.66 1.20 0.00 0.00 173.24 172.92 2w3r s TRP 609 N 2.87 -0.24 -0.24 3.44 1.48 -1.26 0.11 118.94 125.10 2w3r s TRP 609 Ca 0.15 0.54 -0.17 0.00 -1.06 0.00 0.00 56.10 55.55 2w3r s TRP 609 Cb -0.14 0.08 -0.03 0.00 -1.16 0.00 0.00 33.47 32.23 2w3r s TRP 609 CO -0.19 -0.22 0.49 0.34 -4.06 0.00 0.00 176.95 173.31 2w3r s ASP 610 N -0.37 6.45 0.01 -2.66 3.68 0.32 -4.95 116.67 119.15 2w3r s ASP 610 Ca -0.05 0.54 -0.22 0.00 2.13 0.00 0.00 52.55 54.95 2w3r s ASP 610 Cb -0.03 -2.27 -0.18 0.00 -1.45 0.00 0.00 42.92 38.99 2w3r s ASP 610 CO 0.01 -0.22 1.24 -0.09 0.13 0.00 0.00 175.17 176.24 2w3r h ARG 611 N 7.81 0.29 -0.02 4.34 2.43 -1.97 -1.86 114.38 125.39 2w3r h ARG 611 Ca -0.31 -0.20 -0.23 0.00 -0.81 0.00 0.00 59.98 58.43 2w3r h ARG 611 Cb 1.15 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.73 2w3r h ARG 611 CO 0.71 0.80 -0.93 -0.07 -1.51 0.00 0.00 179.97 178.97 2w3r h LEU 612 N -0.18 0.67 0.00 3.80 3.38 -1.95 -3.06 115.31 117.97 2w3r h LEU 612 Ca -0.00 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.45 2w3r h LEU 612 Cb 0.80 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2w3r h LEU 612 CO 0.04 1.31 -0.09 0.54 0.09 0.00 0.00 178.44 180.33 2w3r n ARG 613 N -3.80 0.02 -3.16 1.13 1.74 -1.25 -4.92 116.66 106.43 2w3r n ARG 613 Ca -0.08 0.02 -0.20 0.00 -0.77 0.00 0.00 57.85 56.82 2w3r n ARG 613 Cb 0.83 -1.52 0.05 0.00 -1.02 0.00 0.00 32.46 30.79 2w3r n ARG 613 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w3r n GLY 614 N 1.48 -0.36 3.21 -0.13 0.00 -0.76 -4.89 105.19 103.75 2w3r n GLY 614 Ca 0.07 0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 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 -5.82 0.94 0.00 1.61 -1.52 -0.86 -4.43 119.66 109.59 2w3r s GLN 615 Ca 0.38 -1.18 0.00 0.00 -1.95 0.00 0.00 55.36 52.61 2w3r s GLN 615 Cb -0.17 -0.77 0.00 0.00 -0.22 0.00 0.00 33.01 31.85 2w3r s GLN 615 CO 0.46 0.14 0.00 0.41 -0.25 0.00 0.00 175.29 176.06 2w3r n GLY 616 N 0.63 0.63 2.82 3.09 0.00 -1.08 0.12 105.19 111.40 2w3r n GLY 616 Ca -0.16 -2.10 -0.30 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.66 1.22 0.28 1.61 3.52 0.12 -4.13 118.95 120.91 2w3r s ARG 617 Ca 0.00 -1.75 0.19 0.00 -0.13 0.00 0.00 55.73 54.04 2w3r s ARG 617 Cb 0.00 -2.53 0.10 0.00 -1.56 0.00 0.00 34.95 30.95 2w3r s ARG 617 CO 0.00 -1.05 1.32 -1.00 -0.81 0.00 0.00 175.30 173.76 2w3r h PRO 618 N 7.34 0.00 -6.55 5.12 0.13 -1.91 -0.56 132.00 135.57 2w3r h PRO 618 Ca -0.07 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.37 2w3r h PRO 618 Cb 0.97 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.86 2w3r h PRO 618 CO 0.51 0.24 -0.83 -0.06 -0.23 0.00 0.00 178.00 177.63 2w3r s PHE 619 N -3.09 2.51 0.05 1.56 2.99 -1.26 -4.69 117.98 116.04 2w3r s PHE 619 Ca 0.03 -0.30 -0.19 0.00 0.00 0.00 0.00 56.93 56.47 2w3r s PHE 619 Cb 0.07 -1.50 -0.13 0.00 0.00 0.00 0.00 43.02 41.46 2w3r s PHE 619 CO 0.74 0.16 1.36 1.25 -0.00 0.00 0.00 175.22 178.72 2w3r h LEU 620 N 4.97 0.47 -8.36 -0.37 5.85 -1.67 -3.48 115.31 112.72 2w3r h LEU 620 Ca -0.46 -0.48 -0.21 0.00 0.84 0.00 0.00 57.88 57.57 2w3r h LEU 620 Cb 1.14 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.00 2w3r h LEU 620 CO 0.47 0.86 -0.02 -0.72 -0.34 0.00 0.00 178.44 178.69 2w3r s TYR 621 N -4.29 0.80 -0.07 1.25 -0.85 -1.26 -4.95 117.35 107.98 2w3r s TYR 621 Ca -0.14 -1.18 0.05 0.00 -0.52 0.00 0.00 57.07 55.28 2w3r s TYR 621 Cb 0.06 0.23 -0.00 0.00 0.38 0.00 0.00 41.96 42.63 2w3r s TYR 621 CO 0.77 -1.32 -0.22 -0.06 -1.52 0.00 0.00 175.55 173.20 2w3r s PHE 622 N -2.64 2.21 0.13 -3.49 0.40 -1.26 -1.57 117.98 111.76 2w3r s PHE 622 Ca 0.26 -0.73 -0.21 0.00 -0.60 0.00 0.00 56.93 55.64 2w3r s PHE 622 Cb -0.02 -1.48 -0.07 0.00 0.51 0.00 0.00 43.02 41.96 2w3r s PHE 622 CO 0.18 -0.26 0.66 0.00 0.70 0.00 0.00 175.22 176.50 2w3r s ALA 623 N 0.08 3.52 0.24 5.36 0.00 0.10 -4.86 121.76 126.20 2w3r s ALA 623 Ca -0.08 0.15 0.08 0.00 0.00 0.00 0.00 51.96 52.11 2w3r s ALA 623 Cb -0.14 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.16 2w3r s ALA 623 CO 0.05 0.36 -0.12 0.71 0.00 0.00 0.00 175.76 176.75 2w3r s TYR 624 N -1.19 1.86 0.00 0.00 1.51 -1.26 -0.39 117.35 117.88 2w3r s TYR 624 Ca 0.33 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 2w3r s TYR 624 Cb -0.20 -0.93 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 2w3r s TYR 624 CO 0.22 0.37 0.00 0.41 -1.11 0.00 0.00 175.55 175.44 2w3r n GLY 625 N -0.48 0.28 3.42 0.71 0.00 -1.12 -0.19 105.19 107.81 2w3r n GLY 625 Ca -0.07 -0.90 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 2w3r n GLY 625 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3r s ALA 626 N -2.00 -1.40 -0.01 4.61 0.00 -0.71 -0.40 121.76 121.85 2w3r s ALA 626 Ca 0.00 0.96 0.01 0.00 0.00 0.00 0.00 51.96 52.93 2w3r s ALA 626 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.13 2w3r s ALA 626 CO 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 175.76 175.42 2w3r s ALA 627 N -1.20 0.18 -0.24 0.00 0.00 -0.61 -1.76 121.76 118.13 2w3r s ALA 627 Ca -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 2w3r s ALA 627 Cb -0.02 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2w3r s ALA 627 CO 0.08 0.00 -0.04 0.42 0.00 0.00 0.00 175.76 176.22 2w3r s ILE 628 N 0.27 3.17 -0.09 0.00 1.01 0.06 -1.45 121.20 124.17 2w3r s ILE 628 Ca -0.02 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 59.85 2w3r s ILE 628 Cb -0.04 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2w3r s ILE 628 CO -0.01 0.27 -0.15 -0.89 0.00 0.00 0.00 174.94 174.16 2w3r s THR 629 N 1.40 2.96 -0.12 2.92 2.01 -0.71 -0.86 115.64 123.24 2w3r s THR 629 Ca 0.03 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.29 2w3r s THR 629 Cb -0.16 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 2w3r s THR 629 CO -0.03 0.55 -0.06 -0.70 -0.69 0.00 0.00 174.62 173.69 2w3r s GLU 630 N -0.10 3.25 0.16 4.92 2.12 0.10 -2.30 118.70 126.86 2w3r s GLU 630 Ca -0.02 -0.55 0.04 0.00 0.36 0.00 0.00 54.97 54.79 2w3r s GLU 630 Cb -0.14 -2.74 -0.05 0.00 0.26 0.00 0.00 34.13 31.47 2w3r s GLU 630 CO 0.04 0.41 -0.07 0.14 -0.54 0.00 0.00 175.26 175.24 2w3r s VAL 631 N -0.13 1.01 -0.07 3.70 -7.23 0.12 -0.22 120.40 117.60 2w3r s VAL 631 Ca 0.02 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 2w3r s VAL 631 Cb -0.13 -1.94 0.01 0.00 0.56 0.00 0.00 36.38 34.88 2w3r s VAL 631 CO 0.03 -0.66 -0.15 0.68 -0.31 0.00 0.00 175.10 174.68 2w3r s VAL 632 N -3.43 1.34 0.18 1.32 -7.23 -0.58 -0.72 120.40 111.28 2w3r s VAL 632 Ca 0.19 -0.61 0.09 0.00 -1.81 0.00 0.00 61.98 59.84 2w3r s VAL 632 Cb 0.04 -1.19 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 2w3r s VAL 632 CO 0.01 0.40 -0.12 0.27 -0.31 0.00 0.00 175.10 175.35 2w3r s ILE 633 N 0.48 3.04 -0.18 -0.62 -4.36 -0.46 -1.50 121.20 117.60 2w3r s ILE 633 Ca -0.13 -1.69 -0.18 0.00 -0.26 0.00 0.00 60.65 58.39 2w3r s ILE 633 Cb -0.15 -2.49 -0.04 0.00 1.25 0.00 0.00 42.46 41.03 2w3r s ILE 633 CO 0.04 -0.09 0.47 -0.62 0.24 0.00 0.00 174.94 174.98 2w3r s ASP 634 N -2.73 6.55 0.00 4.36 2.15 0.23 -2.56 116.67 124.66 2w3r s ASP 634 Ca 0.24 0.65 0.28 0.00 0.43 0.00 0.00 52.55 54.15 2w3r s ASP 634 Cb -0.09 -2.27 1.52 0.00 -0.30 0.00 0.00 42.92 41.78 2w3r s ASP 634 CO 0.14 -0.11 1.99 0.54 -0.17 0.00 0.00 175.17 177.56 2w3r n ARG 635 N 4.46 0.60 -0.08 4.34 1.74 0.79 -1.85 116.66 126.66 2w3r n ARG 635 Ca -0.06 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 56.93 2w3r n ARG 635 Cb 0.51 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.36 2w3r n ARG 635 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2w3r n LEU 636 N -1.17 2.11 -0.01 0.55 4.77 -1.26 -4.83 117.00 117.16 2w3r n LEU 636 Ca 0.16 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2w3r n LEU 636 Cb 0.17 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 2w3r n LEU 636 CO 0.19 0.65 -0.54 0.35 -1.33 0.00 0.00 177.39 176.71 2w3r n THR 637 N -2.84 0.07 -0.00 -5.08 -2.24 -1.25 -5.02 114.28 97.91 2w3r n THR 637 Ca -0.27 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2w3r n THR 637 Cb 0.85 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 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 2.63 0.27 3.71 3.38 0.00 -0.77 -4.44 105.19 109.97 2w3r n GLY 638 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2w3r n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w3r n GLU 639 N -2.00 1.72 -3.68 1.61 1.02 -1.26 -4.36 120.64 113.69 2w3r n GLU 639 Ca 0.00 0.62 -0.11 0.00 -0.02 0.00 0.00 57.16 57.65 2w3r n GLU 639 Cb 0.00 -2.45 -0.06 0.00 -0.02 0.00 0.00 31.44 28.92 2w3r n GLU 639 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2w3r s ASN 640 N -0.77 -0.20 -0.05 1.62 2.20 -1.26 0.77 114.94 117.25 2w3r s ASN 640 Ca 0.67 -0.25 -0.05 0.00 -0.94 0.00 0.00 52.86 52.30 2w3r s ASN 640 Cb -0.46 0.43 0.01 0.00 -2.00 0.00 0.00 41.25 39.24 2w3r s ASN 640 CO 0.53 -0.76 0.14 -0.60 -2.94 0.00 0.00 177.10 173.47 2w3r s ARG 641 N -3.28 0.18 -0.35 3.55 3.52 -0.56 -5.00 118.95 117.01 2w3r s ARG 641 Ca -0.00 0.16 -0.29 0.00 -0.13 0.00 0.00 55.73 55.47 2w3r s ARG 641 Cb 0.01 0.09 0.02 0.00 -1.56 0.00 0.00 34.95 33.50 2w3r s ARG 641 CO -0.08 -0.02 1.16 0.42 -0.81 0.00 0.00 175.30 175.96 2w3r s ILE 642 N -0.01 4.33 -0.09 4.11 1.01 -1.26 -1.52 121.20 127.76 2w3r s ILE 642 Ca -0.01 1.49 -0.20 0.00 0.00 0.00 0.00 60.65 61.92 2w3r s ILE 642 Cb -0.01 -4.39 -0.28 0.00 0.01 0.00 0.00 42.46 37.79 2w3r s ILE 642 CO 0.00 -0.61 0.70 -0.07 0.00 0.00 0.00 174.94 174.96 2w3r h LEU 643 N 10.60 0.34 -7.35 2.97 3.38 -0.94 -3.24 115.31 121.08 2w3r h LEU 643 Ca -0.23 -0.89 -0.11 0.00 0.09 0.00 0.00 57.88 56.74 2w3r h LEU 643 Cb 1.07 -0.11 -0.22 0.00 0.09 0.00 0.00 40.66 41.49 2w3r h LEU 643 CO 1.06 1.43 -0.21 -0.60 0.09 0.00 0.00 178.44 180.21 2w3r s ARG 644 N -2.41 0.60 0.00 1.13 3.52 -1.13 -1.87 118.95 118.79 2w3r s ARG 644 Ca -0.18 0.30 0.02 0.00 -0.13 0.00 0.00 55.73 55.75 2w3r s ARG 644 Cb 0.02 0.28 -0.01 0.00 -1.56 0.00 0.00 34.95 33.68 2w3r s ARG 644 CO 0.77 -0.12 -0.08 0.99 -0.81 0.00 0.00 175.30 176.05 2w3r s THR 645 N -0.40 0.61 -0.09 4.11 2.01 0.09 0.02 115.64 121.99 2w3r s THR 645 Ca -0.05 -0.43 0.00 0.00 0.31 0.00 0.00 61.69 61.52 2w3r s THR 645 Cb -0.03 -0.53 0.02 0.00 0.01 0.00 0.00 72.50 71.97 2w3r s THR 645 CO 0.03 0.10 -0.08 -1.81 -0.69 0.00 0.00 174.62 172.16 2w3r s ASP 646 N -0.37 1.93 -0.07 3.53 1.01 -0.04 -1.12 116.67 121.54 2w3r s ASP 646 Ca 0.02 -0.28 0.04 0.00 0.71 0.00 0.00 52.55 53.03 2w3r s ASP 646 Cb -0.04 -0.79 0.00 0.00 1.01 0.00 0.00 42.92 43.11 2w3r s ASP 646 CO -0.00 -0.07 -0.18 -0.63 0.21 0.00 0.00 175.17 174.50 2w3r s ILE 647 N 1.34 1.53 -0.32 0.77 1.01 0.14 -0.76 121.20 124.91 2w3r s ILE 647 Ca -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.92 2w3r s ILE 647 Cb -0.14 -1.34 0.10 0.00 0.01 0.00 0.00 42.46 41.09 2w3r s ILE 647 CO -0.04 0.44 0.05 -0.22 0.00 0.00 0.00 174.94 175.17 2w3r s LEU 648 N 0.33 3.99 0.02 2.97 2.96 -0.72 0.13 118.68 128.35 2w3r s LEU 648 Ca -0.12 -1.94 0.04 0.00 -0.22 0.00 0.00 54.13 51.89 2w3r s LEU 648 Cb -0.15 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 2w3r s LEU 648 CO 0.05 -0.37 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.35 2w3r s HIS 649 N 1.10 2.86 -0.34 5.38 5.65 -0.75 -1.74 115.29 127.45 2w3r s HIS 649 Ca 0.09 -0.06 -0.17 0.00 0.25 0.00 0.00 55.06 55.16 2w3r s HIS 649 Cb -0.19 -1.58 -0.01 0.00 -1.18 0.00 0.00 32.58 29.62 2w3r s HIS 649 CO -0.12 0.37 0.48 0.34 -0.65 0.00 0.00 174.74 175.17 2w3r s ASP 650 N -1.50 6.29 -0.10 9.88 2.15 0.73 -0.13 116.67 133.99 2w3r s ASP 650 Ca 0.18 -0.04 0.13 0.00 0.43 0.00 0.00 52.55 53.25 2w3r s ASP 650 Cb -0.11 -2.25 0.35 0.00 -0.30 0.00 0.00 42.92 40.60 2w3r s ASP 650 CO 0.08 -0.44 1.26 0.00 -0.17 0.00 0.00 175.17 175.91 2w3r n ALA 651 N 5.66 2.50 -0.75 3.66 0.00 -1.25 -4.28 120.51 126.04 2w3r n ALA 651 Ca -0.06 -1.91 0.00 0.00 0.00 0.00 0.00 53.44 51.47 2w3r n ALA 651 Cb 0.49 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.47 2.42 3.44 0.00 0.00 -1.26 -1.03 105.19 108.29 2w3r n GLY 652 Ca 0.15 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.00 3.28 0.25 4.61 0.00 0.43 -2.97 121.76 125.36 2w3r s ALA 653 Ca 0.00 -2.28 -0.30 0.00 0.00 0.00 0.00 51.96 49.38 2w3r s ALA 653 Cb 0.00 -3.86 -0.14 0.00 0.00 0.00 0.00 23.12 19.12 2w3r s ALA 653 CO 0.00 -2.77 1.21 0.45 0.00 0.00 0.00 175.76 174.65 2w3r n SER 654 N 6.96 1.95 0.09 0.00 2.88 -1.24 -3.29 113.62 120.98 2w3r n SER 654 Ca 0.06 1.16 -0.07 0.00 -1.33 0.00 0.00 58.87 58.69 2w3r n SER 654 Cb 0.46 -1.34 0.02 0.00 -0.75 0.00 0.00 64.21 62.60 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 3.06 0.16 -6.01 2.46 3.38 -1.90 -3.36 115.31 113.10 2w3r h LEU 655 Ca -0.43 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.45 2w3r h LEU 655 Cb 1.31 -0.05 -0.21 0.00 0.09 0.00 0.00 40.66 41.80 2w3r h LEU 655 CO 0.68 0.91 -0.37 0.21 0.09 0.00 0.00 178.44 179.96 2w3r s ASN 656 N -6.87 -1.51 0.28 -0.43 3.84 -1.26 -0.17 114.94 108.81 2w3r s ASN 656 Ca -0.02 0.29 -0.03 0.00 0.21 0.00 0.00 52.86 53.31 2w3r s ASN 656 Cb 0.11 2.02 0.37 0.00 -0.55 0.00 0.00 41.25 43.20 2w3r s ASN 656 CO 0.81 -0.30 1.90 -0.65 -2.79 0.00 0.00 177.10 176.08 2w3r h PRO 657 N 8.01 1.07 0.32 0.43 0.11 -1.77 -2.56 132.00 137.61 2w3r h PRO 657 Ca -0.05 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 65.94 2w3r h PRO 657 Cb 1.18 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 2w3r h PRO 657 CO 0.17 0.78 -0.31 0.00 -0.21 0.00 0.00 178.00 178.43 2w3r h ALA 658 N 1.39 -0.67 -0.23 -0.75 0.00 -1.87 -1.99 119.26 115.15 2w3r h ALA 658 Ca 0.28 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2w3r h ALA 658 Cb 0.01 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 658 CO -0.05 -0.91 -0.05 -0.07 0.00 0.00 0.00 179.25 178.17 2w3r h LEU 659 N -0.66 0.32 -0.14 0.00 3.38 -1.80 -2.03 115.31 114.39 2w3r h LEU 659 Ca -0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2w3r h LEU 659 Cb 0.60 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2w3r h LEU 659 CO -0.06 0.42 0.01 0.44 0.09 0.00 0.00 178.44 179.34 2w3r h ASP 660 N 0.33 0.23 -0.97 -0.43 3.32 -1.24 -0.67 116.42 117.00 2w3r h ASP 660 Ca 0.07 -0.29 0.02 0.00 0.02 0.00 0.00 57.03 56.85 2w3r h ASP 660 Cb 0.31 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 2w3r h ASP 660 CO 0.01 0.47 0.64 0.40 -1.72 0.00 0.00 179.24 179.04 2w3r h ILE 661 N -0.01 1.21 -0.45 0.35 1.08 -1.19 -0.20 117.51 118.30 2w3r h ILE 661 Ca 0.04 -0.43 0.02 0.00 -0.39 0.00 0.00 64.86 64.10 2w3r h ILE 661 Cb 0.35 -0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 33.90 2w3r h ILE 661 CO 0.01 0.23 0.26 1.23 -0.69 0.00 0.00 178.15 179.19 2w3r h GLY 662 N 1.27 0.62 0.94 5.37 0.00 -1.07 0.22 103.07 110.41 2w3r h GLY 662 Ca 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2w3r h GLY 662 CO -0.10 0.17 0.16 1.46 0.00 0.00 0.00 176.54 178.22 2w3r h GLN 663 N 0.52 0.47 -0.56 4.80 1.08 -0.68 -0.38 115.11 120.37 2w3r h GLN 663 Ca 0.18 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2w3r h GLN 663 Cb 0.02 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2w3r h GLN 663 CO -0.09 0.44 0.26 0.82 -0.95 0.00 0.00 178.83 179.31 2w3r h ILE 664 N 0.39 1.21 0.73 2.54 2.04 -0.75 0.97 117.51 124.64 2w3r h ILE 664 Ca 0.11 -0.60 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2w3r h ILE 664 Cb 0.12 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2w3r h ILE 664 CO -0.01 0.24 -0.38 -0.33 0.00 0.00 0.00 178.15 177.66 2w3r h GLU 665 N 0.76 -0.98 -0.23 2.37 5.08 -0.48 -2.23 114.58 118.86 2w3r h GLU 665 Ca 0.19 0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.68 2w3r h GLU 665 Cb 0.13 0.22 -0.07 0.00 0.50 0.00 0.00 28.75 29.54 2w3r h GLU 665 CO -0.02 -0.66 -0.31 0.78 -1.00 0.00 0.00 179.01 177.80 2w3r h GLY 666 N -1.02 -0.33 0.79 -3.84 0.00 -0.99 -2.23 103.07 95.46 2w3r h GLY 666 Ca -0.10 0.38 0.05 0.00 0.00 0.00 0.00 47.33 47.67 2w3r h GLY 666 CO 0.15 -0.21 0.66 0.00 0.00 0.00 0.00 176.54 177.13 2w3r h ALA 667 N 0.59 1.38 -0.01 3.60 0.00 -0.87 -1.40 119.26 122.55 2w3r h ALA 667 Ca 0.13 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2w3r h ALA 667 Cb 0.53 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2w3r h ALA 667 CO -0.41 0.49 -0.08 -0.92 0.00 0.00 0.00 179.25 178.33 2w3r h TYR 668 N 1.22 -0.20 -0.84 0.00 3.20 -0.82 0.35 116.97 119.87 2w3r h TYR 668 Ca 0.42 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.38 2w3r h TYR 668 Cb 0.10 0.09 -0.07 0.00 1.54 0.00 0.00 36.73 38.40 2w3r h TYR 668 CO -0.00 -0.13 0.50 0.28 -1.64 0.00 0.00 178.16 177.18 2w3r h VAL 669 N -0.14 0.98 -0.19 1.81 2.07 -0.88 0.26 116.25 120.16 2w3r h VAL 669 Ca 0.04 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.10 2w3r h VAL 669 Cb 0.18 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2w3r h VAL 669 CO -0.09 0.16 -0.52 -0.61 0.02 0.00 0.00 177.57 176.53 2w3r h GLN 670 N 0.88 0.54 -0.23 1.57 4.15 -0.96 -0.13 115.11 120.94 2w3r h GLN 670 Ca 0.39 -0.33 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 2w3r h GLN 670 Cb 0.27 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 2w3r h GLN 670 CO -0.21 0.93 -0.14 0.78 -1.93 0.00 0.00 178.83 178.27 2w3r h GLY 671 N 1.08 0.54 0.99 2.39 0.00 0.77 -2.01 103.07 106.83 2w3r h GLY 671 Ca 0.01 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2w3r h GLY 671 CO 0.10 0.45 -0.01 0.00 0.00 0.00 0.00 176.54 177.08 2w3r h ALA 672 N 0.70 0.62 -0.65 3.60 0.00 -0.56 -2.99 119.26 119.99 2w3r h ALA 672 Ca 0.05 -0.28 0.07 0.00 0.00 0.00 0.00 54.91 54.75 2w3r h ALA 672 Cb 0.65 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2w3r h ALA 672 CO 0.04 0.43 0.43 0.78 0.00 0.00 0.00 179.25 180.93 2w3r h GLY 673 N 0.67 0.79 1.82 0.00 0.00 -0.97 -1.44 103.07 103.94 2w3r h GLY 673 Ca 0.13 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 2w3r h GLY 673 CO 0.03 0.17 -0.15 -0.25 0.00 0.00 0.00 176.54 176.34 2w3r h TRP 674 N 0.60 0.23 -0.42 5.60 7.01 -1.21 -2.48 115.95 125.28 2w3r h TRP 674 Ca 0.29 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.26 2w3r h TRP 674 Cb 0.35 -0.06 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 2w3r h TRP 674 CO -0.00 0.36 0.00 1.28 -2.79 0.00 0.00 178.44 177.29 2w3r n LEU 675 N -4.27 3.43 0.00 0.65 4.77 -0.63 -4.60 117.00 116.36 2w3r n LEU 675 Ca -0.01 -2.21 0.00 0.00 -0.03 0.00 0.00 56.01 53.76 2w3r n LEU 675 Cb 0.27 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2w3r n LEU 675 CO 0.38 0.77 0.00 0.35 -1.33 0.00 0.00 177.39 177.56 2w3r n THR 676 N 0.57 0.00 0.25 -5.08 -2.24 -0.70 -0.99 114.28 106.09 2w3r n THR 676 Ca 0.16 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.05 2w3r n THR 676 Cb 0.58 -0.29 -0.11 0.00 -2.10 0.00 0.00 70.33 68.41 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 -0.63 0.11 -2.70 4.28 -2.24 -1.16 -1.80 114.28 110.14 2w3r n THR 677 Ca 0.00 -0.39 -0.43 0.00 -2.27 0.00 0.00 64.05 60.96 2w3r n THR 677 Cb 0.00 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 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 -3.37 4.05 -0.04 -0.78 2.02 -0.94 -4.32 118.70 115.32 2w3r s GLU 678 Ca -0.03 0.99 -0.01 0.00 0.02 0.00 0.00 54.97 55.94 2w3r s GLU 678 Cb 0.14 -3.73 0.03 0.00 0.10 0.00 0.00 34.13 30.67 2w3r s GLU 678 CO 0.87 -0.84 0.07 -2.00 0.02 0.00 0.00 175.26 173.38 2w3r s GLU 679 N 3.48 -0.01 -0.23 1.61 2.12 -1.26 -4.71 118.70 119.70 2w3r s GLU 679 Ca 0.43 0.28 -0.11 0.00 0.36 0.00 0.00 54.97 55.93 2w3r s GLU 679 Cb -0.13 -0.27 -0.05 0.00 0.26 0.00 0.00 34.13 33.94 2w3r s GLU 679 CO 0.14 -0.20 0.19 -0.51 -0.54 0.00 0.00 175.26 174.34 2w3r s LEU 680 N 1.34 4.13 -0.14 2.70 1.43 -1.26 -4.85 118.68 122.03 2w3r s LEU 680 Ca -0.06 0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2w3r s LEU 680 Cb -0.12 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 43.95 2w3r s LEU 680 CO -0.04 0.05 -0.16 -0.69 0.23 0.00 0.00 176.35 175.75 2w3r s VAL 681 N 1.04 1.65 -0.02 -1.59 1.01 -1.26 -4.99 120.40 116.24 2w3r s VAL 681 Ca 0.09 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 2w3r s VAL 681 Cb -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2w3r s VAL 681 CO 0.04 0.47 0.05 0.26 0.00 0.00 0.00 175.10 175.92 2w3r s TRP 682 N 1.28 3.21 0.00 5.22 0.51 -1.26 0.35 118.94 128.25 2w3r s TRP 682 Ca 0.01 0.18 0.00 0.00 -2.12 0.00 0.00 56.10 54.17 2w3r s TRP 682 Cb -0.14 -1.73 0.00 0.00 -0.81 0.00 0.00 33.47 30.79 2w3r s TRP 682 CO -0.08 0.52 0.00 -0.40 -0.51 0.00 0.00 176.95 176.48 2w3r n ASP 683 N 1.44 0.00 0.26 2.95 5.75 -0.31 -4.90 116.55 121.74 2w3r n ASP 683 Ca -0.15 -0.79 0.12 0.00 -0.01 0.00 0.00 54.79 53.96 2w3r n ASP 683 Cb 0.53 0.00 0.68 0.00 -1.03 0.00 0.00 41.12 41.30 2w3r n ASP 683 CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 2w3r h HIS 684 N -0.68 0.00 -0.00 2.11 2.07 -2.01 -2.54 115.15 114.10 2w3r h HIS 684 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2w3r h HIS 684 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2w3r h HIS 684 CO 0.00 0.14 -0.17 0.00 -3.07 0.00 0.00 177.93 174.82 2w3r n GLY 686 N 1.49 0.34 3.76 0.00 0.00 -0.96 -4.39 105.19 105.44 2w3r n GLY 686 Ca 0.07 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.67 4.15 -0.12 1.61 0.52 -1.26 -4.30 118.95 115.88 2w3r s ARG 687 Ca 0.00 0.24 -0.29 0.00 -0.52 0.00 0.00 55.73 55.16 2w3r s ARG 687 Cb 0.00 -3.37 -0.03 0.00 0.52 0.00 0.00 34.95 32.07 2w3r s ARG 687 CO 0.00 0.36 1.45 -1.17 0.02 0.00 0.00 175.30 175.96 2w3r s LEU 688 N 0.06 4.23 0.04 2.53 2.96 -1.26 -1.16 118.68 126.08 2w3r s LEU 688 Ca 0.20 1.93 -0.02 0.00 -0.22 0.00 0.00 54.13 56.02 2w3r s LEU 688 Cb -0.14 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 42.74 2w3r s LEU 688 CO 0.08 -0.85 0.99 0.24 -1.32 0.00 0.00 176.35 175.49 2w3r h MET 689 N 8.89 0.23 -4.26 1.98 2.86 -0.46 -3.40 114.93 120.78 2w3r h MET 689 Ca -0.32 -0.39 -0.76 0.00 -2.06 0.00 0.00 59.70 56.16 2w3r h MET 689 Cb 1.14 0.15 -0.22 0.00 0.06 0.00 0.00 31.60 32.72 2w3r h MET 689 CO 0.96 1.12 0.88 0.95 1.06 0.00 0.00 176.91 181.89 2w3r s THR 690 N -2.64 5.43 -0.10 2.22 -4.23 -1.21 -4.75 115.64 110.35 2w3r s THR 690 Ca -0.06 -2.85 0.14 0.00 -1.18 0.00 0.00 61.69 57.74 2w3r s THR 690 Cb 0.07 -4.75 0.23 0.00 1.34 0.00 0.00 72.50 69.39 2w3r s THR 690 CO 0.86 -1.41 1.12 0.00 -0.54 0.00 0.00 174.62 174.65 2w3r n HIS 691 N 4.47 0.00 -3.79 3.99 1.44 -1.26 -4.78 115.22 115.29 2w3r n HIS 691 Ca 0.29 -0.78 -0.10 0.00 -2.01 0.00 0.00 57.72 55.13 2w3r n HIS 691 Cb 0.42 -0.13 -0.06 0.00 0.12 0.00 0.00 29.99 30.34 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 -2.18 -0.48 0.49 1.59 0.00 -1.26 -3.99 121.76 115.94 2w3r s ALA 692 Ca 0.25 -0.44 0.31 0.00 0.00 0.00 0.00 51.96 52.07 2w3r s ALA 692 Cb 0.22 0.66 1.70 0.00 0.00 0.00 0.00 23.12 25.69 2w3r s ALA 692 CO 0.02 -0.61 2.17 -1.35 0.00 0.00 0.00 175.76 175.99 2w3r h PRO 693 N 2.53 0.00 0.00 0.00 0.11 -1.97 0.15 132.00 132.82 2w3r h PRO 693 Ca -0.33 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 2w3r h PRO 693 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2w3r h PRO 693 CO 0.50 0.06 -0.10 0.66 -0.21 0.00 0.00 178.00 178.91 2w3r h SER 694 N 0.00 0.00 0.00 -2.05 4.64 -2.02 -3.31 113.55 110.81 2w3r h SER 694 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2w3r h SER 694 Cb 0.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2w3r h SER 694 CO 0.01 0.10 -1.25 0.35 -0.87 0.00 0.00 176.83 175.17 2w3r n THR 695 N -3.23 0.03 -4.00 2.95 -2.24 -0.79 -4.95 114.28 102.05 2w3r n THR 695 Ca 0.00 -0.13 -0.35 0.00 -2.27 0.00 0.00 64.05 61.31 2w3r n THR 695 Cb 0.37 0.28 -0.13 0.00 -2.10 0.00 0.00 70.33 68.75 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 -2.35 3.01 -0.79 4.78 5.04 0.44 -4.82 117.35 122.67 2w3r s TYR 696 Ca -0.02 -0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 53.98 2w3r s TYR 696 Cb 0.03 -2.11 0.20 0.00 0.35 0.00 0.00 41.96 40.43 2w3r s TYR 696 CO 0.22 -0.35 0.66 0.15 -1.34 0.00 0.00 175.55 174.89 2w3r s LYS 697 N 1.22 3.06 0.74 4.97 3.01 -1.26 -4.52 119.74 126.96 2w3r s LYS 697 Ca 0.03 -2.93 -0.11 0.00 -1.01 0.00 0.00 55.97 51.95 2w3r s LYS 697 Cb -0.15 -3.92 0.04 0.00 -1.01 0.00 0.00 37.83 32.79 2w3r s LYS 697 CO 0.01 -1.23 1.08 0.96 0.51 0.00 0.00 175.35 176.67 2w3r s ILE 698 N -0.74 3.59 0.12 2.17 -4.36 -1.26 -3.37 121.20 117.34 2w3r s ILE 698 Ca 0.23 0.52 -0.31 0.00 -0.26 0.00 0.00 60.65 60.82 2w3r s ILE 698 Cb -0.13 -3.23 -0.10 0.00 1.25 0.00 0.00 42.46 40.25 2w3r s ILE 698 CO -0.09 -0.68 1.81 -2.84 0.24 0.00 0.00 174.94 173.39 2w3r s PRO 699 N -5.07 4.14 0.47 0.37 0.02 -1.26 -5.00 135.00 128.68 2w3r s PRO 699 Ca 0.59 2.56 -0.02 0.00 0.02 0.00 0.00 61.00 64.16 2w3r s PRO 699 Cb -0.15 -3.59 -0.01 0.00 0.02 0.00 0.00 34.50 30.78 2w3r s PRO 699 CO 0.55 -0.83 0.72 0.00 -0.33 0.00 0.00 177.00 177.11 2w3r s ALA 700 N 2.71 3.60 0.11 -1.55 0.00 -1.26 -4.96 121.76 120.41 2w3r s ALA 700 Ca 0.80 -0.88 -0.22 0.00 0.00 0.00 0.00 51.96 51.66 2w3r s ALA 700 Cb -0.45 -2.30 -0.05 0.00 0.00 0.00 0.00 23.12 20.32 2w3r s ALA 700 CO 0.36 -0.40 1.22 0.34 0.00 0.00 0.00 175.76 177.27 2w3r n PHE 701 N -2.16 -0.31 0.52 0.00 7.35 -1.26 -0.31 117.46 121.28 2w3r n PHE 701 Ca 0.01 0.89 0.07 0.00 -0.76 0.00 0.00 57.45 57.66 2w3r n PHE 701 Cb 0.57 -0.55 0.31 0.00 0.35 0.00 0.00 39.48 40.16 2w3r n PHE 701 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2w3r n SER 702 N -4.73 0.00 0.05 -2.13 3.41 -1.26 -2.34 113.62 106.61 2w3r n SER 702 Ca 0.01 0.41 0.10 0.00 -0.26 0.00 0.00 58.87 59.14 2w3r n SER 702 Cb 0.19 -0.45 0.42 0.00 -0.26 0.00 0.00 64.21 64.10 2w3r n SER 702 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2w3r n ASP 703 N -1.45 0.29 -4.76 4.04 8.00 0.58 -4.84 116.55 118.41 2w3r n ASP 703 Ca 0.04 0.56 -0.39 0.00 0.71 0.00 0.00 54.79 55.71 2w3r n ASP 703 Cb 0.15 -0.62 0.03 0.00 -0.02 0.00 0.00 41.12 40.66 2w3r n ASP 703 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w3r s ARG 704 N -3.11 3.36 0.13 -1.24 1.70 -0.99 -4.71 118.95 114.09 2w3r s ARG 704 Ca 0.07 2.30 -0.35 0.00 -0.47 0.00 0.00 55.73 57.28 2w3r s ARG 704 Cb 0.11 -2.41 -0.15 0.00 -0.57 0.00 0.00 34.95 31.92 2w3r s ARG 704 CO 0.37 -1.04 1.45 -2.30 -1.08 0.00 0.00 175.30 172.71 2w3r n PRO 705 N -0.70 1.65 -0.11 3.89 -0.02 -1.26 -4.86 135.00 133.59 2w3r n PRO 705 Ca 0.08 0.60 -0.08 0.00 -2.02 0.00 0.00 63.50 62.08 2w3r n PRO 705 Cb 0.44 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.62 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 5.15 0.48 -4.69 -0.52 2.47 -1.42 -3.33 114.38 112.52 2w3r h ARG 706 Ca -0.46 -0.03 -0.69 0.00 -1.26 0.00 0.00 59.98 57.54 2w3r h ARG 706 Cb 1.29 -0.11 -0.27 0.00 -1.65 0.00 0.00 29.97 29.24 2w3r h ARG 706 CO 0.83 0.32 -0.59 0.42 0.56 0.00 0.00 179.97 181.50 2w3r s ILE 707 N -6.16 4.02 -0.36 2.04 1.01 -0.78 -5.02 121.20 115.95 2w3r s ILE 707 Ca -0.13 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.56 2w3r s ILE 707 Cb 0.10 -3.21 0.09 0.00 0.01 0.00 0.00 42.46 39.45 2w3r s ILE 707 CO 0.72 -0.12 0.11 0.12 0.00 0.00 0.00 174.94 175.77 2w3r s PHE 708 N 1.46 3.51 -0.27 3.97 5.99 -1.25 -0.73 117.98 130.66 2w3r s PHE 708 Ca 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 56.93 54.55 2w3r s PHE 708 Cb -0.19 -2.79 0.02 0.00 0.00 0.00 0.00 43.02 40.06 2w3r s PHE 708 CO 0.04 -0.91 0.01 -0.80 -0.00 0.00 0.00 175.22 173.56 2w3r s ASN 709 N 1.47 4.76 -0.14 6.13 0.01 -0.27 -5.02 114.94 121.88 2w3r s ASN 709 Ca 0.04 -0.81 0.02 0.00 -0.71 0.00 0.00 52.86 51.40 2w3r s ASN 709 Cb -0.21 -1.78 0.01 0.00 0.41 0.00 0.00 41.25 39.69 2w3r s ASN 709 CO -0.04 -0.17 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.49 2w3r s VAL 710 N 1.41 1.96 0.00 1.60 1.01 -1.26 0.27 120.40 125.38 2w3r s VAL 710 Ca 0.01 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.11 2w3r s VAL 710 Cb -0.17 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 2w3r s VAL 710 CO -0.01 0.53 -0.11 0.00 0.00 0.00 0.00 175.10 175.52 2w3r s ALA 711 N 0.94 0.88 -0.06 5.51 0.00 0.12 -4.96 121.76 124.18 2w3r s ALA 711 Ca -0.05 -0.50 -0.20 0.00 0.00 0.00 0.00 51.96 51.21 2w3r s ALA 711 Cb -0.15 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 2w3r s ALA 711 CO -0.04 0.20 0.56 -0.51 0.00 0.00 0.00 175.76 175.97 2w3r s LEU 712 N -0.42 4.35 -0.60 0.00 1.43 -1.26 -1.82 118.68 120.35 2w3r s LEU 712 Ca 0.03 1.03 -0.27 0.00 -1.03 0.00 0.00 54.13 53.89 2w3r s LEU 712 Cb -0.05 -2.85 0.03 0.00 0.03 0.00 0.00 46.19 43.35 2w3r s LEU 712 CO -0.00 0.03 1.14 0.86 0.23 0.00 0.00 176.35 178.61 2w3r s TRP 713 N 0.28 2.59 -0.80 0.29 -0.11 0.81 -4.89 118.94 117.12 2w3r s TRP 713 Ca 0.30 0.20 -0.15 0.00 1.22 0.00 0.00 56.10 57.67 2w3r s TRP 713 Cb -0.17 -4.43 0.20 0.00 -1.50 0.00 0.00 33.47 27.57 2w3r s TRP 713 CO 0.15 -1.62 0.77 0.34 -4.62 0.00 0.00 176.95 171.96 2w3r s ASP 714 N 3.10 6.67 -0.19 5.86 2.15 -1.26 -3.75 116.67 129.24 2w3r s ASP 714 Ca 0.38 -2.48 -0.06 0.00 0.43 0.00 0.00 52.55 50.82 2w3r s ASP 714 Cb -0.09 -2.23 0.09 0.00 -0.30 0.00 0.00 42.92 40.39 2w3r s ASP 714 CO 0.22 -0.67 0.37 -1.58 -0.17 0.00 0.00 175.17 173.34 2w3r s GLN 715 N 0.65 0.28 0.50 4.34 0.74 -1.16 -5.00 119.66 120.01 2w3r s GLN 715 Ca 0.17 0.88 -0.21 0.00 0.05 0.00 0.00 55.36 56.26 2w3r s GLN 715 Cb -0.12 0.10 -0.09 0.00 1.10 0.00 0.00 33.01 34.00 2w3r s GLN 715 CO -0.07 -0.32 0.73 -2.30 -0.55 0.00 0.00 175.29 172.78 2w3r n PRO 716 N 5.38 0.80 -2.46 1.67 -0.02 -1.26 -3.65 135.00 135.46 2w3r n PRO 716 Ca -0.07 0.30 -0.41 0.00 -2.02 0.00 0.00 63.50 61.30 2w3r n PRO 716 Cb 0.50 -1.82 -0.04 0.00 -0.02 0.00 0.00 33.50 32.12 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 -1.02 7.23 0.30 2.55 2.47 -0.36 -4.78 114.94 121.34 2w3r s ASN 717 Ca 0.67 2.24 0.01 0.00 0.42 0.00 0.00 52.86 56.20 2w3r s ASN 717 Cb -0.51 -2.62 0.49 0.00 -1.45 0.00 0.00 41.25 37.16 2w3r s ASN 717 CO 0.55 -0.20 1.86 0.03 -3.72 0.00 0.00 177.10 175.62 2w3r h ARG 718 N 4.26 0.72 -7.07 0.43 3.08 -1.91 -3.44 114.38 110.46 2w3r h ARG 718 Ca -0.46 -0.14 -0.45 0.00 0.07 0.00 0.00 59.98 59.00 2w3r h ARG 718 Cb 1.21 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 2w3r h ARG 718 CO 0.69 0.66 0.35 -1.21 -1.07 0.00 0.00 179.97 179.39 2w3r s GLU 719 N -5.16 4.13 -1.39 0.04 0.41 -1.26 -4.95 118.70 110.52 2w3r s GLU 719 Ca -0.09 1.15 -0.15 0.00 -0.41 0.00 0.00 54.97 55.48 2w3r s GLU 719 Cb 0.16 -2.16 0.07 0.00 -1.78 0.00 0.00 34.13 30.41 2w3r s GLU 719 CO 0.79 -0.12 2.03 0.39 -0.49 0.00 0.00 175.26 177.86 2w3r n GLU 720 N -0.75 3.04 -3.46 1.61 1.02 -1.26 -4.76 120.64 116.07 2w3r n GLU 720 Ca 0.07 -2.92 -0.26 0.00 -0.02 0.00 0.00 57.16 54.03 2w3r n GLU 720 Cb 0.54 -3.30 -0.02 0.00 -0.02 0.00 0.00 31.44 28.64 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 3.10 5.11 -0.49 2.62 -4.23 -1.26 -4.97 115.64 115.53 2w3r s THR 721 Ca 0.48 -0.33 -0.43 0.00 -1.18 0.00 0.00 61.69 60.22 2w3r s THR 721 Cb 0.10 -3.80 -0.18 0.00 1.34 0.00 0.00 72.50 69.96 2w3r s THR 721 CO -0.03 -0.41 2.13 0.00 -0.54 0.00 0.00 174.62 175.77 2w3r n ILE 722 N -1.31 0.02 -4.10 2.99 0.13 -1.26 0.07 119.36 115.90 2w3r n ILE 722 Ca -0.04 -0.02 -0.32 0.00 -1.10 0.00 0.00 62.75 61.27 2w3r n ILE 722 Cb 0.55 -0.60 -0.02 0.00 -0.84 0.00 0.00 39.64 38.73 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 7.59 -1.78 -2.60 9.51 3.01 -1.26 -2.22 117.46 129.71 2w3r n PHE 723 Ca 0.53 0.80 -0.14 0.00 1.01 0.00 0.00 57.45 59.65 2w3r n PHE 723 Cb -0.02 -3.33 -0.00 0.00 -0.01 0.00 0.00 39.48 36.12 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 -4.43 -2.51 -2.13 -1.08 5.12 0.11 -4.58 116.66 107.16 2w3r n ARG 724 Ca -0.05 0.56 -0.27 0.00 -1.93 0.00 0.00 57.85 56.16 2w3r n ARG 724 Cb 0.56 -5.18 0.08 0.00 -1.16 0.00 0.00 32.46 26.76 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 -2.15 4.65 0.19 0.55 1.04 -0.94 -0.43 113.70 116.61 2w3r s SER 725 Ca 0.07 0.50 0.10 0.00 0.48 0.00 0.00 55.95 57.10 2w3r s SER 725 Cb -0.04 -1.08 -0.04 0.00 0.10 0.00 0.00 66.02 64.96 2w3r s SER 725 CO 0.08 -1.73 -0.20 -0.54 0.98 0.00 0.00 173.24 171.84 2w3r s LYS 726 N -5.35 1.39 0.43 4.02 1.02 -0.20 -4.69 119.74 116.35 2w3r s LYS 726 Ca 0.61 -1.49 -0.24 0.00 0.02 0.00 0.00 55.97 54.87 2w3r s LYS 726 Cb -0.10 -1.51 -0.08 0.00 -0.52 0.00 0.00 37.83 35.62 2w3r s LYS 726 CO 0.46 0.31 1.21 0.00 -0.92 0.00 0.00 175.35 176.40 2w3r s ALA 727 N -2.05 3.09 0.00 5.17 0.00 -1.26 -4.76 121.76 121.95 2w3r s ALA 727 Ca 0.19 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.19 2w3r s ALA 727 Cb -0.06 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2w3r s ALA 727 CO 0.08 -0.69 0.49 1.55 0.00 0.00 0.00 175.76 177.20 2w3r n VAL 728 N -0.17 0.21 -0.05 0.00 3.14 -1.26 -4.82 118.33 115.37 2w3r n VAL 728 Ca 0.06 -0.26 -0.12 0.00 -2.96 0.00 0.00 64.34 61.06 2w3r n VAL 728 Cb 0.46 1.12 -0.07 0.00 -1.06 0.00 0.00 33.84 34.29 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 0.00 0.34 0.00 7.55 0.00 -1.92 -3.41 103.07 105.63 2w3r h GLY 729 Ca 0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 2w3r h GLY 729 CO 0.00 0.27 -1.45 1.18 0.00 0.00 0.00 176.54 176.55 2w3r n GLU 730 N -4.65 2.30 -0.28 4.80 1.02 -1.26 -4.75 120.64 117.81 2w3r n GLU 730 Ca -0.06 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.22 2w3r n GLU 730 Cb 0.29 -1.16 0.38 0.00 -0.02 0.00 0.00 31.44 30.92 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 0.00 0.67 0.00 3.49 0.11 -1.88 -1.78 132.00 132.60 2w3r h PRO 731 Ca -0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2w3r h PRO 731 Cb 1.37 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2w3r h PRO 731 CO 0.00 0.44 0.00 -1.35 -0.21 0.00 0.00 178.00 176.88 2w3r h PRO 732 N 0.69 0.00 -0.57 1.05 0.11 -1.85 -2.86 132.00 128.56 2w3r h PRO 732 Ca 0.47 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.67 2w3r h PRO 732 Cb 0.78 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 2w3r h PRO 732 CO -0.23 0.00 0.38 0.35 -0.21 0.00 0.00 178.00 178.29 2w3r h PHE 733 N 0.00 0.42 0.00 0.65 3.57 -1.51 -0.97 116.94 119.10 2w3r h PHE 733 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2w3r h PHE 733 Cb 0.56 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.16 2w3r h PHE 733 CO 0.00 0.21 0.00 1.28 -2.23 0.00 0.00 178.31 177.57 2w3r n LEU 734 N -4.47 0.00 0.23 0.59 4.32 -1.08 -2.59 117.00 114.00 2w3r n LEU 734 Ca 0.09 0.42 0.11 0.00 -0.02 0.00 0.00 56.01 56.60 2w3r n LEU 734 Cb 0.34 -0.42 0.51 0.00 -1.62 0.00 0.00 43.42 42.23 2w3r n LEU 734 CO 0.34 -0.11 0.83 -0.07 -1.22 0.00 0.00 177.39 177.16 2w3r h LEU 735 N 0.00 0.00 -0.96 2.23 3.38 -1.33 -2.95 115.31 115.67 2w3r h LEU 735 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2w3r h LEU 735 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2w3r h LEU 735 CO 0.00 0.21 0.00 0.61 0.09 0.00 0.00 178.44 179.35 2w3r n GLY 736 N 0.00 -0.93 0.24 0.83 0.00 -1.07 -2.59 105.19 101.68 2w3r n GLY 736 Ca -0.00 0.13 0.03 0.00 0.00 0.00 0.00 46.02 46.18 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 1.16 0.00 -0.61 2.04 -1.75 -2.09 117.51 116.26 2w3r h ILE 737 Ca 0.00 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2w3r h ILE 737 Cb 0.11 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2w3r h ILE 737 CO 0.00 0.22 -0.05 0.77 0.00 0.00 0.00 178.15 179.09 2w3r h SER 738 N 0.19 0.00 -0.08 1.72 4.64 -1.75 -1.64 113.55 116.64 2w3r h SER 738 Ca 0.04 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.20 2w3r h SER 738 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 2w3r h SER 738 CO 0.02 0.05 -0.51 0.00 -0.87 0.00 0.00 176.83 175.52 2w3r h ALA 739 N 1.95 0.67 -0.06 5.18 0.00 -1.59 -0.77 119.26 124.64 2w3r h ALA 739 Ca -0.00 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 2w3r h ALA 739 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w3r h ALA 739 CO 0.01 0.68 -0.71 0.35 0.00 0.00 0.00 179.25 179.57 2w3r h PHE 740 N 0.51 0.40 0.00 0.00 3.57 -1.43 -2.13 116.94 117.85 2w3r h PHE 740 Ca 0.02 -0.18 -0.15 0.00 3.53 0.00 0.00 57.97 61.19 2w3r h PHE 740 Cb 1.07 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.72 2w3r h PHE 740 CO 0.05 0.91 -0.71 -0.07 -2.23 0.00 0.00 178.31 176.26 2w3r h LEU 741 N 0.20 0.00 -0.12 0.59 4.07 -1.24 -1.10 115.31 117.71 2w3r h LEU 741 Ca -0.02 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.79 2w3r h LEU 741 Cb 1.28 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.02 2w3r h LEU 741 CO 0.12 0.71 -0.48 0.00 -1.08 0.00 0.00 178.44 177.71 2w3r h ALA 742 N 1.29 0.22 -0.88 1.53 0.00 -1.14 -1.64 119.26 118.64 2w3r h ALA 742 Ca -0.01 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.46 2w3r h ALA 742 Cb 1.36 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2w3r h ALA 742 CO 0.09 0.38 0.56 -0.07 0.00 0.00 0.00 179.25 180.22 2w3r h LEU 743 N 0.14 0.91 -0.43 0.00 4.07 -1.31 -0.12 115.31 118.57 2w3r h LEU 743 Ca -0.03 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.89 2w3r h LEU 743 Cb 1.11 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.64 2w3r h LEU 743 CO 0.10 0.61 0.10 -0.74 -1.08 0.00 0.00 178.44 177.43 2w3r h HIS 744 N 1.06 0.73 -0.56 1.13 -0.00 -1.19 -2.99 115.15 113.33 2w3r h HIS 744 Ca 0.37 -0.09 -0.03 0.00 -0.00 0.00 0.00 60.37 60.62 2w3r h HIS 744 Cb 0.08 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.26 2w3r h HIS 744 CO -0.02 0.68 0.22 0.22 -0.00 0.00 0.00 177.93 179.03 2w3r h ASP 745 N 0.57 0.74 -0.91 3.26 3.58 -0.87 -2.08 116.42 120.71 2w3r h ASP 745 Ca 0.14 -0.09 0.06 0.00 0.42 0.00 0.00 57.03 57.56 2w3r h ASP 745 Cb 0.32 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 41.12 2w3r h ASP 745 CO 0.00 0.67 0.59 0.00 -2.88 0.00 0.00 179.24 177.62 2w3r h ALA 746 N 1.44 1.50 -0.13 -0.78 0.00 -0.89 -1.87 119.26 118.53 2w3r h ALA 746 Ca 0.19 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2w3r h ALA 746 Cb 0.16 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2w3r h ALA 746 CO -0.02 0.37 -0.59 0.00 0.00 0.00 0.00 179.25 179.01 2w3r n ALA 748 N -2.50 1.26 1.13 0.00 0.00 -0.71 -1.37 120.51 118.30 2w3r n ALA 748 Ca -0.03 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.51 2w3r n ALA 748 Cb 0.62 -1.08 0.19 0.00 0.00 0.00 0.00 19.45 19.17 2w3r n ALA 748 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n ALA 749 N -1.48 3.27 -0.06 0.00 0.00 -1.13 -4.29 120.51 116.82 2w3r n ALA 749 Ca 0.01 -0.54 -0.02 0.00 0.00 0.00 0.00 53.44 52.90 2w3r n ALA 749 Cb 0.06 -0.95 -0.16 0.00 0.00 0.00 0.00 19.45 18.40 2w3r n ALA 749 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r s GLY 751 N -5.09 -0.24 0.49 0.00 0.00 -1.25 -4.55 107.32 96.67 2w3r s GLY 751 Ca -0.09 -0.01 0.29 0.00 0.00 0.00 0.00 44.72 44.91 2w3r s GLY 751 CO 0.86 -0.00 1.82 -0.56 0.00 0.00 0.00 173.10 175.22 2w3r h PRO 752 N 2.00 0.00 -7.18 2.90 0.13 -1.86 -3.45 132.00 124.53 2w3r h PRO 752 Ca -0.23 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.43 2w3r h PRO 752 Cb 1.26 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.41 2w3r h PRO 752 CO 0.27 0.00 0.37 -1.01 -0.23 0.00 0.00 178.00 177.40 2w3r s HIS 753 N -3.46 3.38 -0.01 1.56 3.76 -1.10 -5.00 115.29 114.42 2w3r s HIS 753 Ca 0.04 1.48 -0.30 0.00 -0.15 0.00 0.00 55.06 56.13 2w3r s HIS 753 Cb 0.07 -2.83 -0.06 0.00 1.11 0.00 0.00 32.58 30.87 2w3r s HIS 753 CO 0.59 -0.45 1.62 -0.46 -0.85 0.00 0.00 174.74 175.19 2w3r s TRP 754 N -2.57 2.23 0.24 1.40 -0.11 -1.26 -4.32 118.94 114.55 2w3r s TRP 754 Ca 0.60 0.31 0.04 0.00 1.22 0.00 0.00 56.10 58.27 2w3r s TRP 754 Cb -0.11 -3.90 0.27 0.00 -1.50 0.00 0.00 33.47 28.24 2w3r s TRP 754 CO 0.31 -3.67 1.58 -1.35 -4.62 0.00 0.00 176.95 169.20 2w3r h PRO 755 N 8.93 0.30 -6.07 5.86 0.11 -1.88 -3.38 132.00 135.87 2w3r h PRO 755 Ca -0.40 -0.18 -0.40 0.00 0.11 0.00 0.00 66.00 65.13 2w3r h PRO 755 Cb 1.19 0.02 0.11 0.00 0.11 0.00 0.00 31.00 32.42 2w3r h PRO 755 CO 0.94 0.77 -0.92 -3.47 -0.21 0.00 0.00 178.00 175.11 2w3r n ASP 756 N -3.92 -5.39 -4.72 -2.05 -0.08 -1.26 -4.46 116.55 94.67 2w3r n ASP 756 Ca -0.02 -0.95 -0.42 0.00 -1.51 0.00 0.00 54.79 51.89 2w3r n ASP 756 Cb 0.58 -3.77 -0.03 0.00 2.34 0.00 0.00 41.12 40.24 2w3r n ASP 756 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2w3r s LEU 757 N -6.27 4.39 0.40 -2.67 2.96 -1.26 -4.84 118.68 111.40 2w3r s LEU 757 Ca 0.45 2.09 0.02 0.00 -0.22 0.00 0.00 54.13 56.47 2w3r s LEU 757 Cb -0.14 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.96 2w3r s LEU 757 CO 0.84 -0.45 0.60 -1.10 -1.32 0.00 0.00 176.35 174.91 2w3r s GLN 758 N 0.75 3.11 -0.08 1.98 -1.52 -1.26 -4.95 119.66 117.69 2w3r s GLN 758 Ca 0.58 -0.65 -0.00 0.00 -1.95 0.00 0.00 55.36 53.34 2w3r s GLN 758 Cb -0.31 -2.65 -0.03 0.00 -0.22 0.00 0.00 33.01 29.80 2w3r s GLN 758 CO 0.31 -0.13 -0.05 0.00 -0.25 0.00 0.00 175.29 175.17 2w3r s ALA 759 N -2.41 3.05 0.44 6.09 0.00 -0.59 -3.07 121.76 125.27 2w3r s ALA 759 Ca 0.47 -0.86 -0.22 0.00 0.00 0.00 0.00 51.96 51.34 2w3r s ALA 759 Cb -0.10 -1.31 -0.09 0.00 0.00 0.00 0.00 23.12 21.62 2w3r s ALA 759 CO 0.35 0.54 1.05 -1.25 0.00 0.00 0.00 175.76 176.45 2w3r s PRO 760 N -0.72 3.97 -1.51 0.00 0.04 -1.26 -2.87 135.00 132.65 2w3r s PRO 760 Ca 0.11 1.44 -0.11 0.00 0.04 0.00 0.00 61.00 62.48 2w3r s PRO 760 Cb -0.11 -2.31 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 2w3r s PRO 760 CO 0.02 -0.30 2.59 0.00 0.04 0.00 0.00 177.00 179.35 2w3r n ALA 761 N -0.54 6.71 -1.26 8.56 0.00 -0.16 -4.80 120.51 129.02 2w3r n ALA 761 Ca 0.07 -3.77 -0.34 0.00 0.00 0.00 0.00 53.44 49.41 2w3r n ALA 761 Cb 0.51 -3.32 0.11 0.00 0.00 0.00 0.00 19.45 16.75 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 1.91 2.25 0.32 0.00 -4.23 -0.74 -4.55 115.64 110.59 2w3r s THR 762 Ca 0.59 0.12 0.08 0.00 -1.18 0.00 0.00 61.69 61.29 2w3r s THR 762 Cb 0.16 -2.61 0.36 0.00 1.34 0.00 0.00 72.50 71.75 2w3r s THR 762 CO -0.07 -0.07 1.60 -0.65 -0.54 0.00 0.00 174.62 174.89 2w3r h PRO 763 N -0.57 0.09 -0.23 3.99 0.11 -1.84 0.44 132.00 133.99 2w3r h PRO 763 Ca -0.47 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.67 2w3r h PRO 763 Cb 1.29 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 2w3r h PRO 763 CO 0.48 0.06 0.05 1.49 -0.21 0.00 0.00 178.00 179.87 2w3r h GLU 764 N 0.09 0.13 -0.48 1.05 4.81 -1.84 -0.74 114.58 117.61 2w3r h GLU 764 Ca 0.66 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.86 2w3r h GLU 764 Cb 1.50 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.83 2w3r h GLU 764 CO -0.78 0.09 0.19 0.00 -0.73 0.00 0.00 179.01 177.78 2w3r h ALA 765 N 1.17 1.43 -0.25 2.92 0.00 -0.53 0.54 119.26 124.53 2w3r h ALA 765 Ca 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 765 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2w3r h ALA 765 CO -0.14 0.44 0.02 0.28 0.00 0.00 0.00 179.25 179.85 2w3r h VAL 766 N 0.68 1.24 -0.88 0.00 2.07 -0.70 -2.01 116.25 116.67 2w3r h VAL 766 Ca 0.17 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 2w3r h VAL 766 Cb 0.15 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 2w3r h VAL 766 CO -0.02 0.26 0.48 0.25 0.02 0.00 0.00 177.57 178.57 2w3r h LEU 767 N 0.22 1.10 -0.95 2.57 5.85 -0.73 -0.89 115.31 122.48 2w3r h LEU 767 Ca 0.07 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.74 2w3r h LEU 767 Cb 0.37 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 2w3r h LEU 767 CO 0.01 0.88 0.61 0.00 -0.34 0.00 0.00 178.44 179.60 2w3r h ALA 768 N 1.30 1.27 -0.10 1.25 0.00 -0.75 -1.71 119.26 120.51 2w3r h ALA 768 Ca 0.31 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 2w3r h ALA 768 Cb 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2w3r h ALA 768 CO -0.05 0.46 -0.39 0.00 0.00 0.00 0.00 179.25 179.27 2w3r h ALA 769 N 1.40 0.18 -0.50 0.00 0.00 -0.95 -2.94 119.26 116.46 2w3r h ALA 769 Ca 0.39 -0.46 0.10 0.00 0.00 0.00 0.00 54.91 54.93 2w3r h ALA 769 Cb 0.05 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.73 2w3r h ALA 769 CO -0.14 0.28 -0.15 0.28 0.00 0.00 0.00 179.25 179.53 2w3r h VAL 770 N 0.01 0.46 -0.68 0.00 2.07 -0.96 -0.82 116.25 116.33 2w3r h VAL 770 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2w3r h VAL 770 Cb 1.03 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 2w3r h VAL 770 CO 0.08 0.00 0.33 0.03 0.02 0.00 0.00 177.57 178.04 2w3r h ARG 771 N -0.03 0.96 -0.14 1.57 3.08 -1.35 0.86 114.38 119.34 2w3r h ARG 771 Ca 0.24 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 2w3r h ARG 771 Cb 0.39 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 2w3r h ARG 771 CO -0.53 0.74 0.06 0.00 -1.07 0.00 0.00 179.97 179.17 2w3r h ARG 772 N 0.96 0.21 -0.86 0.04 3.08 -1.15 0.37 114.38 117.03 2w3r h ARG 772 Ca 0.24 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.26 2w3r h ARG 772 Cb 0.09 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 2w3r h ARG 772 CO -0.03 0.30 0.57 0.00 -1.07 0.00 0.00 179.97 179.74 2w3r h ALA 773 N 0.90 1.09 0.00 0.04 0.00 -0.72 -2.05 119.26 118.53 2w3r h ALA 773 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2w3r h ALA 773 Cb 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2w3r h ALA 773 CO -0.00 0.49 0.00 0.93 0.00 0.00 0.00 179.25 180.67 2w3r h GLU 774 N 1.16 0.00 0.00 0.00 5.08 -0.66 -2.91 114.58 117.26 2w3r h GLU 774 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2w3r h GLU 774 Cb -0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2w3r h GLU 774 CO -0.07 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.35 2w3r n GLY 775 N 0.54 0.55 3.52 -3.84 0.00 0.37 -4.96 105.19 101.37 2w3r n GLY 775 Ca 0.03 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.34 3.37 0.00 1.61 0.52 0.10 -5.00 118.95 118.22 2w3r s ARG 776 Ca 0.00 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 54.71 2w3r s ARG 776 Cb 0.00 -3.88 0.00 0.00 0.52 0.00 0.00 34.95 31.59 2w3r s ARG 776 CO 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 175.30 174.61