#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3r n VAL 3 N 0.00 0.62 0.00 2.46 0.31 -1.24 -2.74 118.33 117.73 2w3r n VAL 3 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2w3r n VAL 3 Cb 0.00 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.22 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 2.71 1.54 3.77 2.92 0.00 0.14 -5.02 105.19 111.25 2w3r n GLY 4 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.85 4.40 -1.11 1.61 1.02 -1.11 -4.50 119.74 119.21 2w3r s LYS 5 Ca 0.00 1.68 -0.08 0.00 0.02 0.00 0.00 55.97 57.59 2w3r s LYS 5 Cb 0.00 -2.88 -0.10 0.00 -0.52 0.00 0.00 37.83 34.33 2w3r s LYS 5 CO 0.00 0.03 3.04 -0.35 -0.92 0.00 0.00 175.35 177.16 2w3r n PRO 6 N 0.59 3.33 -2.71 -1.68 -0.04 -1.26 -4.34 135.00 128.88 2w3r n PRO 6 Ca 0.02 -2.08 -0.33 0.00 -0.04 0.00 0.00 63.50 61.07 2w3r n PRO 6 Cb 0.47 -2.54 -0.06 0.00 -0.04 0.00 0.00 33.50 31.33 2w3r n PRO 6 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2w3r s LEU 7 N -0.33 3.88 0.99 1.53 1.43 -1.26 -4.78 118.68 120.14 2w3r s LEU 7 Ca 0.66 1.71 -0.15 0.00 -1.03 0.00 0.00 54.13 55.33 2w3r s LEU 7 Cb 0.23 -4.54 0.19 0.00 0.03 0.00 0.00 46.19 42.09 2w3r s LEU 7 CO -0.06 -0.46 1.17 -2.16 0.23 0.00 0.00 176.35 175.06 2w3r s PRO 8 N -3.31 0.49 0.53 1.29 0.04 -1.26 -4.70 135.00 128.07 2w3r s PRO 8 Ca 0.62 0.08 -0.22 0.00 0.04 0.00 0.00 61.00 61.53 2w3r s PRO 8 Cb -0.10 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 2w3r s PRO 8 CO 0.17 -2.60 1.28 1.58 0.04 0.00 0.00 177.00 177.46 2w3r n HIS 9 N -4.00 2.02 0.08 0.56 -0.00 -1.26 -4.88 115.22 107.74 2w3r n HIS 9 Ca 0.10 0.45 0.13 0.00 -0.00 0.00 0.00 57.72 58.40 2w3r n HIS 9 Cb 0.59 -2.33 0.62 0.00 -0.00 0.00 0.00 29.99 28.88 2w3r n HIS 9 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 2w3r h ASP 10 N 1.39 0.09 -0.08 0.26 2.03 -1.93 -2.60 116.42 115.59 2w3r h ASP 10 Ca -0.50 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.80 2w3r h ASP 10 Cb 1.31 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.79 2w3r h ASP 10 CO 0.57 0.06 -0.04 -1.20 -1.03 0.00 0.00 179.24 177.60 2w3r n SER 11 N -4.46 2.69 0.27 4.15 7.64 -1.26 -4.79 113.62 117.86 2w3r n SER 11 Ca 0.05 -3.16 0.14 0.00 1.01 0.00 0.00 58.87 56.91 2w3r n SER 11 Cb 0.34 -0.47 0.84 0.00 -1.01 0.00 0.00 64.21 63.91 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 0.56 1.70 0.18 -0.43 0.00 -1.83 0.51 119.26 119.94 2w3r h ALA 12 Ca 0.01 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.63 2w3r h ALA 12 Cb 1.14 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.96 2w3r h ALA 12 CO 0.07 -0.07 -1.23 -0.09 0.00 0.00 0.00 179.25 177.93 2w3r h ARG 13 N 0.00 0.51 -0.64 0.00 2.43 -1.87 -2.73 114.38 112.08 2w3r h ARG 13 Ca 0.02 -0.79 -0.09 0.00 -0.81 0.00 0.00 59.98 58.31 2w3r h ARG 13 Cb 0.11 0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2w3r h ARG 13 CO -0.00 1.37 0.05 0.00 -1.51 0.00 0.00 179.97 179.88 2w3r h ALA 14 N 0.18 0.87 -0.03 2.80 0.00 -1.60 -0.45 119.26 121.04 2w3r h ALA 14 Ca -0.21 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.44 2w3r h ALA 14 Cb 1.95 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.46 2w3r h ALA 14 CO 0.23 0.67 -0.22 0.45 0.00 0.00 0.00 179.25 180.39 2w3r h HIS 15 N 1.01 -0.58 -0.32 0.00 3.86 -1.05 0.37 115.15 118.44 2w3r h HIS 15 Ca 0.19 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 2w3r h HIS 15 Cb 0.51 0.26 -0.02 0.00 1.06 0.00 0.00 27.41 29.22 2w3r h HIS 15 CO 0.04 -0.30 0.05 0.28 0.86 0.00 0.00 177.93 178.85 2w3r h VAL 16 N -0.33 1.17 0.00 2.45 2.07 -1.14 -2.42 116.25 118.05 2w3r h VAL 16 Ca 0.07 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2w3r h VAL 16 Cb 0.43 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2w3r h VAL 16 CO -0.22 0.22 -0.57 0.35 0.02 0.00 0.00 177.57 177.37 2w3r n THR 17 N -4.33 0.06 -2.38 2.57 -2.24 -0.21 -4.94 114.28 102.81 2w3r n THR 17 Ca 0.01 -0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.65 2w3r n THR 17 Cb 0.20 0.22 0.01 0.00 -2.10 0.00 0.00 70.33 68.65 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 1.47 0.07 0.00 3.38 0.00 -0.23 -4.94 105.19 104.94 2w3r n GLY 18 Ca 0.05 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.03 0.95 -2.07 1.61 6.02 0.11 -4.96 117.38 117.02 2w3r n GLN 19 Ca -0.08 -0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.47 2w3r n GLN 19 Cb 0.57 -1.37 -0.02 0.00 1.02 0.00 0.00 30.24 30.44 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 -2.81 3.56 -0.23 -1.58 0.00 -0.96 -4.99 121.76 114.76 2w3r s ALA 20 Ca 0.04 1.28 -0.09 0.00 0.00 0.00 0.00 51.96 53.20 2w3r s ALA 20 Cb 0.13 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2w3r s ALA 20 CO 0.75 -0.69 0.10 1.03 0.00 0.00 0.00 175.76 176.95 2w3r s ARG 21 N -0.96 3.91 0.26 0.00 0.52 -1.26 -4.98 118.95 116.44 2w3r s ARG 21 Ca 0.55 -0.36 0.08 0.00 -0.52 0.00 0.00 55.73 55.47 2w3r s ARG 21 Cb -0.40 -3.37 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 2w3r s ARG 21 CO 0.47 0.04 0.14 0.71 0.02 0.00 0.00 175.30 176.68 2w3r s TYR 22 N 1.04 2.96 0.25 -0.53 1.51 -1.26 -4.71 117.35 116.61 2w3r s TYR 22 Ca 0.05 -0.16 -0.04 0.00 -1.01 0.00 0.00 57.07 55.91 2w3r s TYR 22 Cb -0.14 -1.36 0.50 0.00 -0.11 0.00 0.00 41.96 40.84 2w3r s TYR 22 CO 0.04 0.53 1.34 -0.11 -1.11 0.00 0.00 175.55 176.24 2w3r n LEU 23 N -1.10 -0.23 0.27 -1.29 7.94 -1.26 0.12 117.00 121.45 2w3r n LEU 23 Ca -0.07 1.47 0.17 0.00 -1.11 0.00 0.00 56.01 56.47 2w3r n LEU 23 Cb 0.58 -0.48 0.64 0.00 0.53 0.00 0.00 43.42 44.69 2w3r n LEU 23 CO 0.42 -1.44 0.97 -0.78 -1.11 0.00 0.00 177.39 175.45 2w3r h ASP 24 N 0.00 0.00 0.45 1.96 -0.00 -1.96 -2.95 116.42 113.91 2w3r h ASP 24 Ca 0.45 0.00 -0.16 0.00 -0.00 0.00 0.00 57.03 57.32 2w3r h ASP 24 Cb 0.80 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.12 2w3r h ASP 24 CO -0.86 0.01 -0.71 0.44 -0.00 0.00 0.00 179.24 178.13 2w3r h ASP 25 N 0.00 0.26 -2.85 2.28 3.32 0.54 -3.47 116.42 116.51 2w3r h ASP 25 Ca -0.00 -0.17 -0.59 0.00 0.02 0.00 0.00 57.03 56.29 2w3r h ASP 25 Cb 0.56 -0.08 0.12 0.00 0.22 0.00 0.00 39.33 40.16 2w3r h ASP 25 CO 0.00 0.88 0.13 0.18 -1.72 0.00 0.00 179.24 178.72 2w3r n LEU 26 N -3.79 2.23 -4.78 1.55 4.77 -1.12 -4.96 117.00 110.90 2w3r n LEU 26 Ca -0.03 1.08 -0.36 0.00 -0.03 0.00 0.00 56.01 56.67 2w3r n LEU 26 Cb 0.69 -1.32 -0.04 0.00 -2.33 0.00 0.00 43.42 40.42 2w3r n LEU 26 CO 0.46 -1.50 0.74 -2.16 -1.33 0.00 0.00 177.39 173.60 2w3r s PRO 27 N -1.84 4.06 0.06 3.23 0.04 -1.26 -5.07 135.00 134.23 2w3r s PRO 27 Ca 0.61 1.52 -0.24 0.00 0.04 0.00 0.00 61.00 62.93 2w3r s PRO 27 Cb -0.60 -2.46 0.06 0.00 0.04 0.00 0.00 34.50 31.53 2w3r s PRO 27 CO 0.58 -0.23 0.58 0.00 0.04 0.00 0.00 177.00 177.97 2w3r n PRO 29 N 0.25 -0.25 -0.35 0.00 -0.02 -1.26 -4.84 135.00 128.53 2w3r n PRO 29 Ca -0.18 -0.03 0.08 0.00 -2.02 0.00 0.00 63.50 61.35 2w3r n PRO 29 Cb 0.61 -1.81 0.25 0.00 -0.02 0.00 0.00 33.50 32.53 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 -1.48 1.51 0.00 3.55 0.00 -2.02 -2.26 119.26 118.56 2w3r h ALA 30 Ca -0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2w3r h ALA 30 Cb 1.29 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2w3r h ALA 30 CO 0.34 0.14 0.00 0.27 0.00 0.00 0.00 179.25 180.00 2w3r n ASN 31 N -4.68 0.00 -4.70 0.00 0.23 -1.26 -4.88 115.26 99.97 2w3r n ASN 31 Ca 0.19 0.27 -0.56 0.00 -0.53 0.00 0.00 54.58 53.96 2w3r n ASN 31 Cb 0.40 -0.42 -0.07 0.00 -2.08 0.00 0.00 39.78 37.62 2w3r n ASN 31 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 2w3r n THR 32 N -1.42 0.32 -2.22 5.53 -1.04 -0.85 -4.67 114.28 109.92 2w3r n THR 32 Ca 0.08 -0.06 -0.26 0.00 -2.04 0.00 0.00 64.05 61.78 2w3r n THR 32 Cb 0.25 -1.28 0.09 0.00 -1.82 0.00 0.00 70.33 67.58 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 3.37 2.83 -0.03 -4.42 1.43 0.76 -4.91 118.68 117.71 2w3r s LEU 33 Ca 0.97 0.28 0.01 0.00 -1.03 0.00 0.00 54.13 54.36 2w3r s LEU 33 Cb -1.01 -2.78 0.02 0.00 0.03 0.00 0.00 46.19 42.45 2w3r s LEU 33 CO 0.62 -1.83 -0.04 -1.00 0.23 0.00 0.00 176.35 174.33 2w3r s HIS 34 N -3.33 0.66 0.27 0.29 3.76 0.14 -1.41 115.29 115.66 2w3r s HIS 34 Ca 0.63 -0.16 0.08 0.00 -0.15 0.00 0.00 55.06 55.46 2w3r s HIS 34 Cb -0.09 -0.58 -0.04 0.00 1.11 0.00 0.00 32.58 32.99 2w3r s HIS 34 CO 0.46 -0.15 0.14 -0.51 -0.85 0.00 0.00 174.74 173.83 2w3r s LEU 35 N 0.72 3.58 -0.09 0.89 1.43 -0.41 -1.24 118.68 123.56 2w3r s LEU 35 Ca -0.09 -0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 52.43 2w3r s LEU 35 Cb -0.12 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 44.02 2w3r s LEU 35 CO 0.00 -0.06 0.41 0.00 0.23 0.00 0.00 176.35 176.93 2w3r s ALA 36 N -2.22 -1.02 0.30 4.21 0.00 -0.79 -4.63 121.76 117.61 2w3r s ALA 36 Ca 0.33 0.86 -0.16 0.00 0.00 0.00 0.00 51.96 52.99 2w3r s ALA 36 Cb -0.07 -0.31 -0.09 0.00 0.00 0.00 0.00 23.12 22.65 2w3r s ALA 36 CO 0.23 -0.24 0.74 -0.06 0.00 0.00 0.00 175.76 176.43 2w3r s PHE 37 N -0.56 3.44 -0.21 0.00 2.99 -1.26 -0.73 117.98 121.65 2w3r s PHE 37 Ca -0.07 1.27 -0.15 0.00 0.00 0.00 0.00 56.93 57.99 2w3r s PHE 37 Cb -0.04 -2.57 -0.04 0.00 0.00 0.00 0.00 43.02 40.38 2w3r s PHE 37 CO 0.03 0.15 0.34 0.20 -0.00 0.00 0.00 175.22 175.94 2w3r s GLY 38 N -2.11 2.07 0.13 4.36 0.00 -0.04 -4.86 107.32 106.88 2w3r s GLY 38 Ca 0.52 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.66 2w3r s GLY 38 CO 0.18 0.69 0.25 1.08 0.00 0.00 0.00 173.10 175.31 2w3r s LEU 39 N 1.19 4.27 0.18 0.66 1.43 -1.26 0.23 118.68 125.39 2w3r s LEU 39 Ca 0.16 0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 53.11 2w3r s LEU 39 Cb -0.14 -2.85 -0.08 0.00 0.03 0.00 0.00 46.19 43.14 2w3r s LEU 39 CO 0.07 0.08 1.24 -0.55 0.23 0.00 0.00 176.35 177.41 2w3r s SER 40 N -3.07 7.02 0.00 2.29 0.15 0.73 -4.86 113.70 115.96 2w3r s SER 40 Ca 0.34 2.28 0.24 0.00 0.70 0.00 0.00 55.95 59.51 2w3r s SER 40 Cb -0.11 -2.61 0.34 0.00 -1.71 0.00 0.00 66.02 61.93 2w3r s SER 40 CO 0.28 -0.43 1.30 0.35 1.20 0.00 0.00 173.24 175.93 2w3r n THR 41 N 2.63 0.00 -4.34 6.45 -2.24 -1.26 -0.57 114.28 114.95 2w3r n THR 41 Ca 0.05 -0.11 -0.34 0.00 -2.27 0.00 0.00 64.05 61.38 2w3r n THR 41 Cb 0.44 0.68 -0.12 0.00 -2.10 0.00 0.00 70.33 69.24 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 -2.70 3.67 0.41 -0.78 0.41 -1.26 -4.83 118.70 113.63 2w3r s GLU 42 Ca 0.17 -0.48 0.19 0.00 -0.41 0.00 0.00 54.97 54.44 2w3r s GLU 42 Cb 0.18 -2.95 0.89 0.00 -1.78 0.00 0.00 34.13 30.47 2w3r s GLU 42 CO 0.63 0.28 1.85 0.00 -0.49 0.00 0.00 175.26 177.54 2w3r h ALA 43 N 6.58 1.20 -0.72 5.21 0.00 -1.81 -3.30 119.26 126.42 2w3r h ALA 43 Ca -0.33 -0.28 0.17 0.00 0.00 0.00 0.00 54.91 54.47 2w3r h ALA 43 Cb 1.19 -0.05 -0.21 0.00 0.00 0.00 0.00 17.79 18.71 2w3r h ALA 43 CO 0.64 0.38 -0.01 0.45 0.00 0.00 0.00 179.25 180.71 2w3r s SER 44 N -6.53 -0.83 0.07 0.00 0.15 -1.26 -2.35 113.70 102.95 2w3r s SER 44 Ca -0.02 0.61 -0.26 0.00 0.70 0.00 0.00 55.95 56.98 2w3r s SER 44 Cb 0.13 1.73 0.09 0.00 -1.71 0.00 0.00 66.02 66.26 2w3r s SER 44 CO 0.67 -0.16 0.79 0.00 1.20 0.00 0.00 173.24 175.75 2w3r s ALA 45 N 2.85 -1.72 0.28 5.45 0.00 -1.14 -0.27 121.76 127.21 2w3r s ALA 45 Ca 0.06 0.76 -0.06 0.00 0.00 0.00 0.00 51.96 52.72 2w3r s ALA 45 Cb -0.11 0.60 -0.06 0.00 0.00 0.00 0.00 23.12 23.55 2w3r s ALA 45 CO -0.16 -0.74 0.56 0.00 0.00 0.00 0.00 175.76 175.42 2w3r s ALA 46 N -3.36 3.60 -0.39 0.00 0.00 -0.92 -0.91 121.76 119.78 2w3r s ALA 46 Ca 0.04 -0.48 -0.14 0.00 0.00 0.00 0.00 51.96 51.37 2w3r s ALA 46 Cb -0.01 -2.34 0.01 0.00 0.00 0.00 0.00 23.12 20.77 2w3r s ALA 46 CO -0.09 0.29 0.28 0.42 0.00 0.00 0.00 175.76 176.66 2w3r s ILE 47 N -2.04 5.26 -0.01 0.00 1.01 0.22 0.91 121.20 126.55 2w3r s ILE 47 Ca 0.45 -0.54 -0.17 0.00 0.00 0.00 0.00 60.65 60.39 2w3r s ILE 47 Cb -0.11 -3.87 -0.33 0.00 0.01 0.00 0.00 42.46 38.16 2w3r s ILE 47 CO 0.28 -0.23 0.89 0.74 0.00 0.00 0.00 174.94 176.63 2w3r h THR 48 N 5.59 1.28 -3.58 2.92 2.02 -0.32 -3.47 112.91 117.35 2w3r h THR 48 Ca -0.28 -2.61 -0.09 0.00 0.77 0.00 0.00 66.41 64.20 2w3r h THR 48 Cb 1.13 3.03 -0.16 0.00 -1.74 0.00 0.00 68.15 70.41 2w3r h THR 48 CO 0.70 0.78 -0.34 -0.83 0.37 0.00 0.00 175.52 176.21 2w3r s GLY 49 N -4.65 0.00 -0.45 2.16 0.00 -1.07 -4.96 107.32 98.35 2w3r s GLY 49 Ca -0.12 -0.32 0.05 0.00 0.00 0.00 0.00 44.72 44.33 2w3r s GLY 49 CO 0.89 -0.52 0.51 -0.10 0.00 0.00 0.00 173.10 173.88 2w3r n LEU 50 N 0.35 -1.59 -4.58 0.66 7.94 -1.26 -2.00 117.00 116.53 2w3r n LEU 50 Ca -0.17 -3.84 -0.43 0.00 -1.11 0.00 0.00 56.01 50.46 2w3r n LEU 50 Cb 0.60 0.64 -0.03 0.00 0.53 0.00 0.00 43.42 45.17 2w3r n LEU 50 CO 0.22 1.90 0.98 -0.62 -1.11 0.00 0.00 177.39 178.76 2w3r s ASP 51 N 0.22 6.52 -0.24 1.96 2.15 0.78 -4.87 116.67 123.19 2w3r s ASP 51 Ca 0.32 0.20 0.14 0.00 0.43 0.00 0.00 52.55 53.64 2w3r s ASP 51 Cb 0.04 -2.52 0.68 0.00 -0.30 0.00 0.00 42.92 40.81 2w3r s ASP 51 CO -0.14 -1.30 1.62 0.18 -0.17 0.00 0.00 175.17 175.35 2w3r n LEU 52 N 7.92 5.01 -0.01 -1.34 4.77 -1.26 -0.99 117.00 131.10 2w3r n LEU 52 Ca 0.09 -3.08 -0.15 0.00 -0.03 0.00 0.00 56.01 52.83 2w3r n LEU 52 Cb 0.49 -0.64 -0.04 0.00 -2.33 0.00 0.00 43.42 40.89 2w3r n LEU 52 CO 0.70 0.72 0.30 -0.08 -1.33 0.00 0.00 177.39 177.70 2w3r h GLU 53 N 2.69 0.71 0.00 3.23 4.57 -1.91 -2.13 114.58 121.74 2w3r h GLU 53 Ca 0.07 -0.57 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2w3r h GLU 53 Cb 1.84 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 30.54 2w3r h GLU 53 CO 0.44 1.18 0.00 -2.30 -1.18 0.00 0.00 179.01 177.15 2w3r n PRO 54 N -3.92 0.20 -0.08 0.92 -0.02 -1.26 -2.16 135.00 128.68 2w3r n PRO 54 Ca -0.06 0.07 -0.14 0.00 -2.02 0.00 0.00 63.50 61.34 2w3r n PRO 54 Cb 0.73 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.60 2w3r n PRO 54 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2w3r h VAL 55 N 0.00 1.33 -0.28 -1.45 2.07 -1.70 -3.17 116.25 113.05 2w3r h VAL 55 Ca 0.00 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.39 2w3r h VAL 55 Cb 0.31 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 2w3r h VAL 55 CO 0.00 0.45 0.18 0.03 0.02 0.00 0.00 177.57 178.25 2w3r h ARG 56 N -1.00 0.37 0.00 1.57 3.08 -1.35 -2.08 114.38 114.98 2w3r h ARG 56 Ca -0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2w3r h ARG 56 Cb 0.97 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.94 2w3r h ARG 56 CO -0.06 0.26 -0.16 0.39 -1.07 0.00 0.00 179.97 179.33 2w3r n GLU 57 N -4.48 0.19 -2.08 0.04 1.02 -0.92 -4.78 120.64 109.64 2w3r n GLU 57 Ca 0.01 0.13 -0.40 0.00 -0.02 0.00 0.00 57.16 56.88 2w3r n GLU 57 Cb 0.08 -1.70 -0.01 0.00 -0.02 0.00 0.00 31.44 29.79 2w3r n GLU 57 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2w3r s SER 58 N -4.04 6.42 0.14 1.62 0.15 -0.78 -4.92 113.70 112.28 2w3r s SER 58 Ca 0.11 2.65 -0.35 0.00 0.70 0.00 0.00 55.95 59.06 2w3r s SER 58 Cb 0.14 -2.64 -0.16 0.00 -1.71 0.00 0.00 66.02 61.66 2w3r s SER 58 CO 0.61 -0.77 1.35 -2.65 1.20 0.00 0.00 173.24 172.98 2w3r n PRO 59 N 0.27 1.43 0.00 5.44 -0.02 -1.26 -2.84 135.00 138.02 2w3r n PRO 59 Ca 0.03 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2w3r n PRO 59 Cb 0.43 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 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 2.54 3.21 3.75 -1.23 0.00 -1.26 -4.83 105.19 107.37 2w3r n GLY 60 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.18 2.63 -0.13 1.61 1.01 -1.13 -2.02 120.40 120.19 2w3r s VAL 61 Ca 0.00 0.56 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 2w3r s VAL 61 Cb 0.00 -3.36 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2w3r s VAL 61 CO 0.00 0.10 -0.13 -0.38 0.00 0.00 0.00 175.10 174.69 2w3r n ILE 62 N 1.80 0.75 -3.85 2.22 2.08 0.25 -4.95 119.36 117.67 2w3r n ILE 62 Ca 0.05 -0.26 -0.11 0.00 0.56 0.00 0.00 62.75 62.99 2w3r n ILE 62 Cb 0.41 -1.18 -0.09 0.00 -0.75 0.00 0.00 39.64 38.03 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 -2.26 -0.36 -0.05 -1.39 0.00 -1.06 -5.02 121.76 111.63 2w3r s ALA 63 Ca -0.18 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.54 2w3r s ALA 63 Cb 0.05 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.45 2w3r s ALA 63 CO 0.28 -0.34 -0.06 0.08 0.00 0.00 0.00 175.76 175.73 2w3r s VAL 64 N -2.39 0.63 -0.03 0.00 1.01 -1.26 -0.61 120.40 117.75 2w3r s VAL 64 Ca -0.06 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.81 2w3r s VAL 64 Cb -0.02 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 2w3r s VAL 64 CO -0.03 0.24 -0.23 -0.36 0.00 0.00 0.00 175.10 174.72 2w3r s PHE 65 N 0.86 2.43 0.28 5.22 0.40 0.19 -4.93 117.98 122.43 2w3r s PHE 65 Ca -0.12 -0.37 0.09 0.00 -0.60 0.00 0.00 56.93 55.93 2w3r s PHE 65 Cb -0.15 -1.53 -0.06 0.00 0.51 0.00 0.00 43.02 41.79 2w3r s PHE 65 CO 0.01 0.01 -0.11 0.99 0.70 0.00 0.00 175.22 176.82 2w3r s THR 66 N -0.63 2.01 0.57 0.64 2.01 -1.26 -0.43 115.64 118.54 2w3r s THR 66 Ca 0.10 -2.23 0.29 0.00 0.31 0.00 0.00 61.69 60.16 2w3r s THR 66 Cb -0.10 -2.40 0.40 0.00 0.01 0.00 0.00 72.50 70.41 2w3r s THR 66 CO -0.01 -0.35 1.93 0.00 -0.69 0.00 0.00 174.62 175.51 2w3r h ALA 67 N 2.25 2.35 -0.17 7.40 0.00 -1.80 0.25 119.26 129.55 2w3r h ALA 67 Ca -0.40 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 2w3r h ALA 67 Cb 1.24 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2w3r h ALA 67 CO 0.66 -0.76 -0.25 0.00 0.00 0.00 0.00 179.25 178.90 2w3r h ALA 68 N 1.55 1.26 0.00 0.00 0.00 -1.95 -3.02 119.26 117.10 2w3r h ALA 68 Ca 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 68 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2w3r h ALA 68 CO -0.00 0.49 -0.01 -0.44 0.00 0.00 0.00 179.25 179.29 2w3r h ASP 69 N 0.29 0.00 -2.71 0.00 3.32 -0.88 -3.45 116.42 112.98 2w3r h ASP 69 Ca 0.05 -0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.53 2w3r h ASP 69 Cb 0.60 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2w3r h ASP 69 CO 0.04 0.00 1.12 -0.76 -1.72 0.00 0.00 179.24 177.92 2w3r s LEU 70 N -4.66 4.01 0.29 1.55 1.43 -1.12 -4.92 118.68 115.27 2w3r s LEU 70 Ca 0.10 1.79 -0.00 0.00 -1.03 0.00 0.00 54.13 54.99 2w3r s LEU 70 Cb 0.12 -3.53 0.50 0.00 0.03 0.00 0.00 46.19 43.30 2w3r s LEU 70 CO 0.61 -1.17 1.91 1.55 0.23 0.00 0.00 176.35 179.47 2w3r h PRO 71 N 10.42 1.04 0.00 1.29 0.13 -1.88 -3.46 132.00 139.53 2w3r h PRO 71 Ca -0.35 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2w3r h PRO 71 Cb 1.16 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2w3r h PRO 71 CO 0.99 0.69 0.00 0.72 -0.23 0.00 0.00 178.00 180.16 2w3r n HIS 72 N -4.49 0.00 -2.01 1.56 8.25 -1.26 -5.01 115.22 112.26 2w3r n HIS 72 Ca 0.14 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.18 2w3r n HIS 72 Cb 0.19 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 2w3r n HIS 72 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2w3r s ASP 73 N 1.00 6.67 -0.95 0.41 1.01 -1.03 -4.95 116.67 118.83 2w3r s ASP 73 Ca 0.00 2.51 -0.01 0.00 0.71 0.00 0.00 52.55 55.75 2w3r s ASP 73 Cb 0.00 -2.59 0.29 0.00 1.01 0.00 0.00 42.92 41.63 2w3r s ASP 73 CO 0.00 -0.78 1.22 -3.20 0.21 0.00 0.00 175.17 172.63 2w3r n ASN 74 N 4.14 5.52 -3.62 0.27 5.15 -1.26 -4.49 115.26 120.98 2w3r n ASN 74 Ca 0.13 -3.40 -0.10 0.00 -0.60 0.00 0.00 54.58 50.62 2w3r n ASN 74 Cb 0.40 -1.09 -0.10 0.00 -0.53 0.00 0.00 39.78 38.46 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 -1.80 -0.05 0.00 1.20 2.15 -1.26 -3.91 116.67 113.00 2w3r s ASP 75 Ca 0.33 0.80 0.00 0.00 0.43 0.00 0.00 52.55 54.12 2w3r s ASP 75 Cb 0.07 1.18 0.00 0.00 -0.30 0.00 0.00 42.92 43.87 2w3r s ASP 75 CO 0.05 -0.24 0.71 0.00 -0.17 0.00 0.00 175.17 175.52 2w3r n ALA 76 N 5.38 2.26 -1.87 3.66 0.00 0.61 -4.88 120.51 125.67 2w3r n ALA 76 Ca -0.07 -0.71 -0.40 0.00 0.00 0.00 0.00 53.44 52.25 2w3r n ALA 76 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.42 7.40 0.49 0.00 0.15 -1.25 -4.82 113.70 115.24 2w3r s SER 77 Ca 0.00 2.09 0.30 0.00 0.70 0.00 0.00 55.95 59.05 2w3r s SER 77 Cb 0.00 -2.61 1.11 0.00 -1.71 0.00 0.00 66.02 62.81 2w3r s SER 77 CO 0.00 -0.07 1.88 1.55 1.20 0.00 0.00 173.24 177.80 2w3r h PRO 78 N 4.37 0.00 -6.92 5.44 0.13 -1.91 -3.45 132.00 129.66 2w3r h PRO 78 Ca -0.45 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.18 2w3r h PRO 78 Cb 1.21 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.37 2w3r h PRO 78 CO 0.69 0.00 0.11 0.00 -0.23 0.00 0.00 178.00 178.57 2w3r s ALA 79 N -3.53 3.39 0.28 -0.56 0.00 -1.24 -5.01 121.76 115.10 2w3r s ALA 79 Ca 0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 51.96 51.50 2w3r s ALA 79 Cb 0.08 -2.61 0.37 0.00 0.00 0.00 0.00 23.12 20.96 2w3r s ALA 79 CO 0.56 -0.30 1.95 -1.35 0.00 0.00 0.00 175.76 176.62 2w3r h PRO 80 N 0.39 1.19 -6.88 0.00 0.11 -1.92 -3.43 132.00 121.46 2w3r h PRO 80 Ca -0.47 -0.07 -0.51 0.00 0.11 0.00 0.00 66.00 65.06 2w3r h PRO 80 Cb 1.20 -0.27 0.04 0.00 0.11 0.00 0.00 31.00 32.08 2w3r h PRO 80 CO 0.62 0.79 0.51 -1.54 -0.21 0.00 0.00 178.00 178.17 2w3r s SER 81 N -6.22 6.89 0.50 -2.05 1.04 -1.26 -4.99 113.70 107.61 2w3r s SER 81 Ca -0.12 2.37 -0.20 0.00 0.48 0.00 0.00 55.95 58.47 2w3r s SER 81 Cb 0.18 -2.62 -0.08 0.00 0.10 0.00 0.00 66.02 63.60 2w3r s SER 81 CO 0.80 -0.42 1.07 -2.84 0.98 0.00 0.00 173.24 172.83 2w3r s PRO 82 N -1.86 3.69 -0.18 4.02 0.02 -1.26 -4.78 135.00 134.65 2w3r s PRO 82 Ca 0.50 1.45 -0.03 0.00 0.02 0.00 0.00 61.00 62.94 2w3r s PRO 82 Cb -0.33 -2.10 0.06 0.00 0.02 0.00 0.00 34.50 32.15 2w3r s PRO 82 CO 0.42 -0.54 0.04 -2.00 -0.33 0.00 0.00 177.00 174.59 2w3r s GLU 83 N -3.20 0.57 0.35 5.54 2.12 -1.26 -4.94 118.70 117.88 2w3r s GLU 83 Ca 0.68 -0.33 -0.28 0.00 0.36 0.00 0.00 54.97 55.40 2w3r s GLU 83 Cb -0.19 -1.98 -0.10 0.00 0.26 0.00 0.00 34.13 32.12 2w3r s GLU 83 CO 0.23 -0.62 1.32 -1.25 -0.54 0.00 0.00 175.26 174.40 2w3r s PRO 84 N 1.90 4.26 0.05 4.30 0.04 -1.25 -0.28 135.00 144.01 2w3r s PRO 84 Ca -0.00 2.23 -0.17 0.00 0.04 0.00 0.00 61.00 63.09 2w3r s PRO 84 Cb -0.17 -2.99 -0.18 0.00 0.04 0.00 0.00 34.50 31.20 2w3r s PRO 84 CO -0.08 -0.28 1.24 0.28 0.04 0.00 0.00 177.00 178.20 2w3r h VAL 85 N 2.90 1.36 -3.76 -0.36 2.07 -1.90 -3.44 116.25 113.11 2w3r h VAL 85 Ca -0.49 -1.84 -0.68 0.00 0.82 0.00 0.00 66.70 64.50 2w3r h VAL 85 Cb 1.23 2.18 -0.31 0.00 -1.52 0.00 0.00 31.29 32.87 2w3r h VAL 85 CO 0.65 0.56 -0.86 -0.76 0.02 0.00 0.00 177.57 177.17 2w3r s LEU 86 N -8.57 2.21 0.21 2.57 1.43 -1.26 -4.67 118.68 110.60 2w3r s LEU 86 Ca -0.12 -0.48 -0.32 0.00 -1.03 0.00 0.00 54.13 52.18 2w3r s LEU 86 Cb 0.06 -1.43 -0.14 0.00 0.03 0.00 0.00 46.19 44.71 2w3r s LEU 86 CO 0.83 0.22 1.37 0.00 0.23 0.00 0.00 176.35 179.01 2w3r n ALA 87 N 3.11 0.68 -3.59 4.21 0.00 -0.49 -4.67 120.51 119.77 2w3r n ALA 87 Ca -0.18 0.43 -0.39 0.00 0.00 0.00 0.00 53.44 53.30 2w3r n ALA 87 Cb 0.52 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.69 2w3r n ALA 87 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3r s THR 88 N 0.02 4.47 0.00 0.00 -4.23 -1.26 -4.53 115.64 110.11 2w3r s THR 88 Ca 0.71 -3.29 0.00 0.00 -1.18 0.00 0.00 61.69 57.93 2w3r s THR 88 Cb -0.70 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 69.33 2w3r s THR 88 CO 0.49 -1.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 2w3r n GLY 89 N 3.03 2.74 3.28 3.99 0.00 -1.26 -4.91 105.19 112.05 2w3r n GLY 89 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 1.07 0.14 1.61 -1.05 -1.26 0.69 118.70 119.90 2w3r s GLU 90 Ca 0.00 -1.23 0.08 0.00 -0.15 0.00 0.00 54.97 53.67 2w3r s GLU 90 Cb 0.00 0.34 -0.04 0.00 -0.44 0.00 0.00 34.13 33.99 2w3r s GLU 90 CO 0.00 -0.37 -0.19 0.14 0.95 0.00 0.00 175.26 175.79 2w3r s VAL 91 N -3.98 1.75 0.00 1.83 -7.23 -0.08 -4.79 120.40 107.89 2w3r s VAL 91 Ca 0.18 -1.74 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2w3r s VAL 91 Cb 0.05 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.28 2w3r s VAL 91 CO -0.00 -0.21 0.32 1.41 -0.31 0.00 0.00 175.10 176.31 2w3r n HIS 92 N 0.65 0.00 -3.56 2.82 -0.00 -1.26 -2.90 115.22 110.97 2w3r n HIS 92 Ca -0.16 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.50 2w3r n HIS 92 Cb 0.55 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.52 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 -0.22 -0.23 -0.52 4.41 -0.12 -0.99 -4.21 117.98 116.09 2w3r s PHE 93 Ca 0.00 0.16 -0.28 0.00 -0.05 0.00 0.00 56.93 56.76 2w3r s PHE 93 Cb 0.00 0.52 0.01 0.00 -0.63 0.00 0.00 43.02 42.92 2w3r s PHE 93 CO 0.00 -0.35 1.48 0.08 -0.05 0.00 0.00 175.22 176.37 2w3r s VAL 94 N -2.65 3.75 0.00 -2.49 1.01 -1.24 -2.41 120.40 116.37 2w3r s VAL 94 Ca 0.07 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2w3r s VAL 94 Cb -0.01 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.07 2w3r s VAL 94 CO -0.06 -1.03 0.00 0.61 0.00 0.00 0.00 175.10 174.62 2w3r n GLY 95 N 5.28 0.51 3.68 4.51 0.00 0.27 -4.76 105.19 114.68 2w3r n GLY 95 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 4.21 0.11 1.61 0.74 -1.01 -4.49 119.66 120.83 2w3r s GLN 96 Ca 0.00 2.22 -0.32 0.00 0.05 0.00 0.00 55.36 57.31 2w3r s GLN 96 Cb 0.00 -3.69 -0.12 0.00 1.10 0.00 0.00 33.01 30.31 2w3r s GLN 96 CO 0.00 -0.73 1.77 -2.30 -0.55 0.00 0.00 175.29 173.49 2w3r n PRO 97 N 5.92 2.55 -0.10 1.67 -0.02 -1.26 -0.19 135.00 143.56 2w3r n PRO 97 Ca 0.16 0.93 -0.21 0.00 -2.02 0.00 0.00 63.50 62.35 2w3r n PRO 97 Cb 0.42 -2.78 -0.07 0.00 -0.02 0.00 0.00 33.50 31.05 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 4.41 1.11 -4.32 4.25 5.41 0.14 -1.39 119.36 128.96 2w3r n ILE 98 Ca 0.18 -0.27 -0.17 0.00 1.00 0.00 0.00 62.75 63.49 2w3r n ILE 98 Cb 0.34 -1.78 -0.10 0.00 -0.71 0.00 0.00 39.64 37.38 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 -2.37 1.54 -0.10 1.39 -0.12 -1.20 -3.96 117.98 113.16 2w3r s PHE 99 Ca -0.28 -1.15 0.02 0.00 -0.05 0.00 0.00 56.93 55.47 2w3r s PHE 99 Cb 0.11 -0.91 0.01 0.00 -0.63 0.00 0.00 43.02 41.60 2w3r s PHE 99 CO 0.35 -0.30 -0.17 -1.17 -0.05 0.00 0.00 175.22 173.89 2w3r s LEU 100 N -3.31 1.80 -0.15 -1.99 2.96 0.43 -0.86 118.68 117.55 2w3r s LEU 100 Ca 0.37 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.79 2w3r s LEU 100 Cb 0.08 -1.12 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 2w3r s LEU 100 CO 0.13 0.04 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.51 2w3r s VAL 101 N 0.83 4.20 -0.34 1.68 1.01 0.09 0.54 120.40 128.41 2w3r s VAL 101 Ca -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 2w3r s VAL 101 Cb -0.16 -2.84 0.08 0.00 0.00 0.00 0.00 36.38 33.46 2w3r s VAL 101 CO 0.01 0.50 0.07 0.00 0.00 0.00 0.00 175.10 175.69 2w3r s ALA 102 N 0.16 2.94 0.43 5.51 0.00 0.22 -1.89 121.76 129.13 2w3r s ALA 102 Ca 0.01 -2.16 0.06 0.00 0.00 0.00 0.00 51.96 49.86 2w3r s ALA 102 Cb -0.13 -2.09 -0.06 0.00 0.00 0.00 0.00 23.12 20.83 2w3r s ALA 102 CO 0.02 -1.52 0.02 0.00 0.00 0.00 0.00 175.76 174.28 2w3r s ALA 103 N 1.15 3.43 -0.91 0.00 0.00 -0.37 0.86 121.76 125.92 2w3r s ALA 103 Ca 0.02 -1.85 0.28 0.00 0.00 0.00 0.00 51.96 50.41 2w3r s ALA 103 Cb -0.21 0.09 1.05 0.00 0.00 0.00 0.00 23.12 24.05 2w3r s ALA 103 CO -0.04 -0.10 1.84 0.25 0.00 0.00 0.00 175.76 177.71 2w3r n THR 104 N -1.06 0.19 -3.86 0.00 -2.24 -0.86 -0.69 114.28 105.76 2w3r n THR 104 Ca -0.08 -0.09 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 2w3r n THR 104 Cb 0.67 -0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 68.34 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 -3.49 0.06 0.19 3.42 1.04 -1.26 -4.75 113.70 108.91 2w3r s SER 105 Ca 0.13 -0.39 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 2w3r s SER 105 Cb 0.17 0.27 0.20 0.00 0.10 0.00 0.00 66.02 66.76 2w3r s SER 105 CO 0.56 -0.54 1.74 -0.74 0.98 0.00 0.00 173.24 175.25 2w3r h HIS 106 N 3.54 0.31 -0.32 5.02 2.76 -1.88 -2.12 115.15 122.47 2w3r h HIS 106 Ca -0.32 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 2w3r h HIS 106 Cb 1.19 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 30.07 2w3r h HIS 106 CO 0.51 0.09 0.21 0.00 -1.30 0.00 0.00 177.93 177.44 2w3r h ARG 107 N 0.35 0.41 -0.78 5.26 2.47 -1.97 -2.33 114.38 117.80 2w3r h ARG 107 Ca 0.26 -0.02 0.09 0.00 -1.26 0.00 0.00 59.98 59.05 2w3r h ARG 107 Cb 0.29 -0.09 -0.07 0.00 -1.65 0.00 0.00 29.97 28.44 2w3r h ARG 107 CO -0.27 0.27 0.43 0.00 0.56 0.00 0.00 179.97 180.97 2w3r h ALA 108 N 1.12 1.11 -0.38 0.04 0.00 -1.72 0.13 119.26 119.55 2w3r h ALA 108 Ca 0.12 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2w3r h ALA 108 Cb -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2w3r h ALA 108 CO -0.03 0.04 -0.16 0.00 0.00 0.00 0.00 179.25 179.11 2w3r h ALA 109 N 1.45 0.53 0.28 0.00 0.00 -1.28 -1.19 119.26 119.05 2w3r h ALA 109 Ca 0.38 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2w3r h ALA 109 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2w3r h ALA 109 CO -0.26 0.45 -0.18 0.00 0.00 0.00 0.00 179.25 179.27 2w3r h ARG 110 N 0.58 -0.43 -0.47 0.00 2.47 -0.87 -0.59 114.38 115.06 2w3r h ARG 110 Ca 0.09 0.03 0.09 0.00 -1.26 0.00 0.00 59.98 58.93 2w3r h ARG 110 Cb 0.70 0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 29.04 2w3r h ARG 110 CO 0.05 -0.29 0.04 0.82 0.56 0.00 0.00 179.97 181.15 2w3r h ILE 111 N -0.45 0.67 -0.19 2.04 2.04 -0.75 -2.64 117.51 118.23 2w3r h ILE 111 Ca -0.03 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 2w3r h ILE 111 Cb 0.38 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2w3r h ILE 111 CO 0.02 0.03 -0.31 0.00 0.00 0.00 0.00 178.15 177.89 2w3r h ALA 112 N 1.40 1.13 0.00 1.87 0.00 -1.05 -3.05 119.26 119.56 2w3r h ALA 112 Ca 0.24 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2w3r h ALA 112 Cb 0.34 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 112 CO -0.36 0.55 -0.00 0.00 0.00 0.00 0.00 179.25 179.44 2w3r h ALA 113 N 1.35 1.09 0.00 0.00 0.00 -0.72 -2.01 119.26 118.97 2w3r h ALA 113 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2w3r h ALA 113 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2w3r h ALA 113 CO 0.05 0.00 -0.72 0.54 0.00 0.00 0.00 179.25 179.12 2w3r n ARG 114 N -3.21 0.16 -0.06 0.00 1.74 -1.15 -4.35 116.66 109.79 2w3r n ARG 114 Ca -0.03 0.02 0.11 0.00 -0.77 0.00 0.00 57.85 57.18 2w3r n ARG 114 Cb 0.09 -1.58 0.41 0.00 -1.02 0.00 0.00 32.46 30.36 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 -1.80 1.64 -1.79 5.56 5.02 -0.76 -4.93 118.16 121.10 2w3r n LYS 115 Ca 0.04 -0.96 -0.33 0.00 -2.02 0.00 0.00 58.31 55.04 2w3r n LYS 115 Cb 0.39 -1.39 0.04 0.00 -0.02 0.00 0.00 35.03 34.05 2w3r n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2w3r s ALA 116 N -1.83 2.51 -0.25 7.82 0.00 -1.26 -4.34 121.76 124.40 2w3r s ALA 116 Ca 0.32 0.52 -0.04 0.00 0.00 0.00 0.00 51.96 52.76 2w3r s ALA 116 Cb 0.17 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.99 2w3r s ALA 116 CO 0.26 -1.22 -0.00 1.03 0.00 0.00 0.00 175.76 175.83 2w3r s ARG 117 N -4.11 3.20 -0.08 0.00 0.52 -0.16 -5.02 118.95 113.30 2w3r s ARG 117 Ca 0.66 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 55.13 2w3r s ARG 117 Cb -0.20 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.16 2w3r s ARG 117 CO 0.41 -0.31 -0.10 0.42 0.02 0.00 0.00 175.30 175.74 2w3r s ILE 118 N 1.46 1.07 -0.17 1.52 1.01 -1.26 -0.15 121.20 124.68 2w3r s ILE 118 Ca 0.04 -0.40 -0.06 0.00 0.00 0.00 0.00 60.65 60.24 2w3r s ILE 118 Cb -0.16 -1.02 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 2w3r s ILE 118 CO -0.01 0.35 0.01 0.42 0.00 0.00 0.00 174.94 175.71 2w3r s THR 119 N 1.05 4.31 0.34 2.92 -4.23 -0.85 -4.97 115.64 114.21 2w3r s THR 119 Ca -0.07 -0.20 0.08 0.00 -1.18 0.00 0.00 61.69 60.31 2w3r s THR 119 Cb -0.15 -2.92 -0.03 0.00 1.34 0.00 0.00 72.50 70.74 2w3r s THR 119 CO -0.01 0.47 0.23 -0.31 -0.54 0.00 0.00 174.62 174.46 2w3r s TYR 120 N 0.43 2.82 -0.70 3.99 1.51 -1.26 0.42 117.35 124.56 2w3r s TYR 120 Ca -0.00 -0.33 0.04 0.00 -1.01 0.00 0.00 57.07 55.76 2w3r s TYR 120 Cb -0.13 -1.72 0.17 0.00 -0.11 0.00 0.00 41.96 40.16 2w3r s TYR 120 CO 0.02 0.26 0.49 0.00 -1.11 0.00 0.00 175.55 175.21 2w3r s ALA 121 N -2.35 3.79 0.18 3.71 0.00 0.26 -4.72 121.76 122.62 2w3r s ALA 121 Ca 0.39 -3.72 -0.32 0.00 0.00 0.00 0.00 51.96 48.31 2w3r s ALA 121 Cb -0.04 -2.28 -0.16 0.00 0.00 0.00 0.00 23.12 20.63 2w3r s ALA 121 CO 0.25 -2.09 1.00 -2.30 0.00 0.00 0.00 175.76 172.62 2w3r n PRO 122 N 2.28 0.83 -4.46 0.00 -0.02 -1.26 -2.16 135.00 130.20 2w3r n PRO 122 Ca 0.17 0.29 -0.23 0.00 -2.02 0.00 0.00 63.50 61.71 2w3r n PRO 122 Cb 0.35 -1.67 -0.10 0.00 -0.02 0.00 0.00 33.50 32.05 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 -0.65 1.64 -0.16 -0.52 0.52 0.63 -4.90 118.95 115.52 2w3r s ARG 123 Ca 0.71 -1.80 -0.29 0.00 -0.52 0.00 0.00 55.73 53.84 2w3r s ARG 123 Cb -0.89 -1.50 -0.05 0.00 0.52 0.00 0.00 34.95 33.02 2w3r s ARG 123 CO 0.55 0.18 1.98 -2.14 0.02 0.00 0.00 175.30 175.89 2w3r s PRO 124 N -3.61 3.57 0.38 3.54 0.02 -1.26 -4.64 135.00 132.99 2w3r s PRO 124 Ca 0.29 2.05 -0.22 0.00 0.02 0.00 0.00 61.00 63.14 2w3r s PRO 124 Cb -0.00 -4.22 -0.10 0.00 0.02 0.00 0.00 34.50 30.19 2w3r s PRO 124 CO 0.13 -1.59 0.91 0.00 -0.33 0.00 0.00 177.00 176.13 2w3r s ALA 125 N 6.45 3.14 -0.41 -1.55 0.00 -1.26 -4.96 121.76 123.17 2w3r s ALA 125 Ca 0.89 0.39 -0.06 0.00 0.00 0.00 0.00 51.96 53.18 2w3r s ALA 125 Cb -0.33 -3.10 0.09 0.00 0.00 0.00 0.00 23.12 19.78 2w3r s ALA 125 CO 0.35 0.17 0.22 0.42 0.00 0.00 0.00 175.76 176.93 2w3r s ILE 126 N -1.95 3.71 -0.11 0.00 1.01 -1.26 -4.95 121.20 117.65 2w3r s ILE 126 Ca 0.57 -1.70 0.04 0.00 0.00 0.00 0.00 60.65 59.56 2w3r s ILE 126 Cb -0.12 -3.38 -0.10 0.00 0.01 0.00 0.00 42.46 38.87 2w3r s ILE 126 CO 0.17 -0.56 -0.04 0.18 0.00 0.00 0.00 174.94 174.69 2w3r n LEU 127 N 4.76 1.56 -5.01 2.97 4.77 -1.26 0.00 117.00 124.80 2w3r n LEU 127 Ca -0.07 -0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.70 2w3r n LEU 127 Cb 0.42 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2w3r n LEU 127 CO 0.36 0.48 0.13 0.42 -1.33 0.00 0.00 177.39 177.45 2w3r s THR 128 N -2.23 3.21 0.18 -5.08 -4.23 -1.26 -4.87 115.64 101.35 2w3r s THR 128 Ca -0.11 -1.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.35 2w3r s THR 128 Cb 0.03 -3.08 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 2w3r s THR 128 CO 0.33 -0.03 1.51 -0.07 -0.54 0.00 0.00 174.62 175.82 2w3r h LEU 129 N 0.69 0.75 -0.85 4.79 4.07 -1.98 -2.53 115.31 120.25 2w3r h LEU 129 Ca -0.41 -0.37 -0.05 0.00 0.08 0.00 0.00 57.88 57.14 2w3r h LEU 129 Cb 1.28 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.77 2w3r h LEU 129 CO 0.47 1.10 0.30 0.44 -1.08 0.00 0.00 178.44 179.66 2w3r h ASP 130 N 0.55 1.05 -0.08 -0.43 3.32 -1.98 0.19 116.42 119.04 2w3r h ASP 130 Ca 0.03 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.92 2w3r h ASP 130 Cb 1.02 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 2w3r h ASP 130 CO 0.10 0.94 0.04 1.56 -1.72 0.00 0.00 179.24 180.15 2w3r h GLN 131 N 1.11 0.11 -0.72 3.56 4.20 -1.95 0.12 115.11 121.55 2w3r h GLN 131 Ca 0.25 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 2w3r h GLN 131 Cb 0.22 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2w3r h GLN 131 CO -0.02 0.19 0.37 0.00 -0.67 0.00 0.00 178.83 178.71 2w3r h ALA 132 N 0.91 0.93 -0.64 3.87 0.00 -1.16 -0.09 119.26 123.09 2w3r h ALA 132 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2w3r h ALA 132 Cb 0.12 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2w3r h ALA 132 CO -0.00 0.46 0.07 1.25 0.00 0.00 0.00 179.25 181.03 2w3r h LEU 133 N 1.00 1.05 -0.16 0.00 5.85 -0.41 0.22 115.31 122.85 2w3r h LEU 133 Ca 0.25 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 2w3r h LEU 133 Cb 0.08 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 2w3r h LEU 133 CO -0.04 1.06 -0.06 0.00 -0.34 0.00 0.00 178.44 179.06 2w3r h ALA 134 N 1.05 0.22 0.00 1.25 0.00 -0.48 -3.06 119.26 118.25 2w3r h ALA 134 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2w3r h ALA 134 Cb 0.48 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2w3r h ALA 134 CO 0.02 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2w3r n ALA 135 N -2.37 2.31 -2.58 0.00 0.00 -0.07 -4.89 120.51 112.91 2w3r n ALA 135 Ca -0.05 -0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.05 2w3r n ALA 135 Cb 0.29 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.32 -5.95 -4.56 0.00 2.03 0.10 -4.94 116.55 101.91 2w3r n ASP 136 Ca 0.11 -0.10 -0.40 0.00 0.52 0.00 0.00 54.79 54.92 2w3r n ASP 136 Cb 0.23 -4.90 -0.03 0.00 -0.72 0.00 0.00 41.12 35.70 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 -2.27 5.89 0.12 1.67 0.15 0.54 -4.95 113.70 114.85 2w3r s SER 137 Ca 0.09 0.00 -0.11 0.00 0.70 0.00 0.00 55.95 56.64 2w3r s SER 137 Cb -0.04 -2.55 0.01 0.00 -1.71 0.00 0.00 66.02 61.73 2w3r s SER 137 CO 0.12 -1.96 0.28 0.00 1.20 0.00 0.00 173.24 172.87 2w3r s ARG 138 N 6.05 0.98 0.23 5.44 1.70 -1.26 -0.30 118.95 131.79 2w3r s ARG 138 Ca 0.50 -0.93 0.05 0.00 -0.47 0.00 0.00 55.73 54.88 2w3r s ARG 138 Cb -0.10 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.64 2w3r s ARG 138 CO 0.20 -0.35 0.32 -0.06 -1.08 0.00 0.00 175.30 174.33 2w3r s PHE 139 N -3.87 3.39 -0.37 5.89 0.40 0.09 -4.48 117.98 119.03 2w3r s PHE 139 Ca 0.07 -0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.38 2w3r s PHE 139 Cb 0.04 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 42.01 2w3r s PHE 139 CO -0.09 0.46 0.00 0.39 0.70 0.00 0.00 175.22 176.68 2w3r n GLU 140 N -1.27 -1.26 -3.84 0.44 1.02 -1.26 -4.09 120.64 110.37 2w3r n GLU 140 Ca -0.09 0.50 -0.31 0.00 -0.02 0.00 0.00 57.16 57.24 2w3r n GLU 140 Cb 0.57 -4.54 0.01 0.00 -0.02 0.00 0.00 31.44 27.46 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 -0.53 -1.12 0.00 0.62 0.00 -1.26 -4.83 105.19 98.07 2w3r n GLY 141 Ca -0.03 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.48 2w3r n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 142 N -1.81 3.34 3.83 -0.02 0.00 -1.26 -5.09 105.19 104.19 2w3r n GLY 142 Ca -0.21 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.60 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 -2.65 4.09 -0.15 1.61 0.04 -1.26 -4.76 135.00 131.91 2w3r s PRO 143 Ca 0.00 0.97 -0.19 0.00 0.04 0.00 0.00 61.00 61.82 2w3r s PRO 143 Cb 0.00 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2w3r s PRO 143 CO 0.00 -0.08 0.53 0.08 0.04 0.00 0.00 177.00 177.57 2w3r s VAL 144 N -2.30 5.13 -0.20 -0.36 1.01 -0.25 -4.89 120.40 118.55 2w3r s VAL 144 Ca 0.59 1.02 0.01 0.00 0.00 0.00 0.00 61.98 63.61 2w3r s VAL 144 Cb -0.09 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.46 2w3r s VAL 144 CO 0.20 0.25 -0.13 -0.63 0.00 0.00 0.00 175.10 174.79 2w3r s ILE 145 N 1.09 1.80 0.02 2.22 1.01 -1.26 -0.25 121.20 125.82 2w3r s ILE 145 Ca 0.27 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.93 2w3r s ILE 145 Cb -0.16 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 2w3r s ILE 145 CO 0.11 0.27 -0.05 0.26 0.00 0.00 0.00 174.94 175.52 2w3r s TRP 146 N 1.35 2.91 -0.16 3.97 0.51 -0.12 -4.98 118.94 122.41 2w3r s TRP 146 Ca 0.00 -0.03 -0.10 0.00 -2.12 0.00 0.00 56.10 53.85 2w3r s TRP 146 Cb -0.15 -1.59 0.05 0.00 -0.81 0.00 0.00 33.47 30.97 2w3r s TRP 146 CO -0.09 0.40 0.40 0.00 -0.51 0.00 0.00 176.95 177.15 2w3r s ALA 147 N -1.06 -1.02 -0.14 0.98 0.00 -1.26 -0.06 121.76 119.20 2w3r s ALA 147 Ca 0.19 1.44 0.01 0.00 0.00 0.00 0.00 51.96 53.60 2w3r s ALA 147 Cb -0.11 -0.87 -0.00 0.00 0.00 0.00 0.00 23.12 22.14 2w3r s ALA 147 CO 0.10 -0.25 -0.17 0.50 0.00 0.00 0.00 175.76 175.93 2w3r s ARG 148 N 1.18 3.18 3.36 0.00 3.52 0.79 -4.98 118.95 126.01 2w3r s ARG 148 Ca -0.08 -0.78 0.00 0.00 -0.13 0.00 0.00 55.73 54.75 2w3r s ARG 148 Cb -0.07 -2.55 0.00 0.00 -1.56 0.00 0.00 34.95 30.77 2w3r s ARG 148 CO -0.10 0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 2w3r n GLY 149 N 3.90 0.19 2.94 8.12 0.00 -1.26 -1.17 105.19 117.91 2w3r n GLY 149 Ca -0.19 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 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 4.35 0.06 1.61 -1.08 -1.26 -4.90 116.67 111.45 2w3r s ASP 150 Ca 0.00 -1.73 -0.20 0.00 -0.52 0.00 0.00 52.55 50.10 2w3r s ASP 150 Cb 0.00 -1.34 -0.11 0.00 -1.46 0.00 0.00 42.92 40.01 2w3r s ASP 150 CO 0.00 -0.33 1.48 -0.37 0.52 0.00 0.00 175.17 176.47 2w3r h VAL 151 N 6.61 1.27 -0.71 1.11 -1.51 -1.88 -2.49 116.25 118.64 2w3r h VAL 151 Ca -0.11 -0.91 0.03 0.00 -1.23 0.00 0.00 66.70 64.48 2w3r h VAL 151 Cb 1.03 1.50 -0.04 0.00 -2.13 0.00 0.00 31.29 31.65 2w3r h VAL 151 CO 0.48 0.28 0.44 -0.08 -1.23 0.00 0.00 177.57 177.46 2w3r h GLU 152 N 0.07 0.84 -0.05 5.19 4.57 -1.99 -0.27 114.58 122.95 2w3r h GLU 152 Ca 0.05 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2w3r h GLU 152 Cb 0.42 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2w3r h GLU 152 CO 0.01 0.56 -0.01 1.15 -1.18 0.00 0.00 179.01 179.54 2w3r h THR 153 N 0.87 1.29 -0.06 0.32 2.02 -1.99 -2.59 112.91 112.76 2w3r h THR 153 Ca 0.28 -0.89 0.01 0.00 0.77 0.00 0.00 66.41 66.58 2w3r h THR 153 Cb 0.02 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 2w3r h THR 153 CO -0.11 0.24 0.01 0.00 0.37 0.00 0.00 175.52 176.03 2w3r h ALA 154 N 0.66 0.06 -0.82 6.16 0.00 -1.16 -2.74 119.26 121.42 2w3r h ALA 154 Ca 0.01 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2w3r h ALA 154 Cb 0.39 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2w3r h ALA 154 CO 0.00 -0.47 0.47 -0.07 0.00 0.00 0.00 179.25 179.18 2w3r h LEU 155 N 0.04 1.00 -0.80 0.00 3.38 -1.13 -2.38 115.31 115.41 2w3r h LEU 155 Ca 0.03 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.00 2w3r h LEU 155 Cb 0.02 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.45 2w3r h LEU 155 CO -0.04 0.79 0.47 0.00 0.09 0.00 0.00 178.44 179.75 2w3r h ALA 156 N 1.38 1.12 -0.60 1.53 0.00 -1.16 -2.15 119.26 119.37 2w3r h ALA 156 Ca 0.29 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2w3r h ALA 156 Cb -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2w3r h ALA 156 CO -0.05 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.75 2w3r n GLY 157 N -1.32 2.01 3.67 0.00 0.00 -1.08 -4.96 105.19 103.51 2w3r n GLY 157 Ca 0.12 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.34 3.60 0.45 4.61 0.00 -0.81 -4.90 121.76 123.37 2w3r s ALA 158 Ca 0.42 0.67 0.15 0.00 0.00 0.00 0.00 51.96 53.20 2w3r s ALA 158 Cb 0.23 -3.61 1.09 0.00 0.00 0.00 0.00 23.12 20.84 2w3r s ALA 158 CO 0.26 -1.05 1.99 0.00 0.00 0.00 0.00 175.76 176.97 2w3r h ALA 159 N 8.14 2.08 -3.63 0.00 0.00 -1.79 -3.42 119.26 120.63 2w3r h ALA 159 Ca -0.33 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.21 2w3r h ALA 159 Cb 1.15 -0.06 -0.25 0.00 0.00 0.00 0.00 17.79 18.63 2w3r h ALA 159 CO 0.93 -0.20 -0.76 -1.01 0.00 0.00 0.00 179.25 178.20 2w3r s HIS 160 N -5.32 0.85 -0.06 0.00 3.76 -1.17 -4.99 115.29 108.36 2w3r s HIS 160 Ca -0.07 -0.32 -0.11 0.00 -0.15 0.00 0.00 55.06 54.41 2w3r s HIS 160 Cb 0.19 -0.51 0.02 0.00 1.11 0.00 0.00 32.58 33.39 2w3r s HIS 160 CO 0.74 -0.02 0.26 -1.17 -0.85 0.00 0.00 174.74 173.70 2w3r s LEU 161 N -0.96 1.04 -0.06 0.89 0.20 -1.26 -0.87 118.68 117.66 2w3r s LEU 161 Ca -0.02 0.27 -0.01 0.00 0.69 0.00 0.00 54.13 55.06 2w3r s LEU 161 Cb -0.07 0.98 0.03 0.00 -0.43 0.00 0.00 46.19 46.70 2w3r s LEU 161 CO 0.01 -0.25 0.01 0.00 -0.29 0.00 0.00 176.35 175.83 2w3r s ALA 162 N -0.57 0.59 0.01 5.97 0.00 0.46 -4.96 121.76 123.26 2w3r s ALA 162 Ca -0.07 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.87 2w3r s ALA 162 Cb -0.04 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 2w3r s ALA 162 CO 0.02 -0.46 -0.01 -1.21 0.00 0.00 0.00 175.76 174.10 2w3r s GLU 163 N 1.99 2.70 0.07 0.00 2.02 -1.26 -0.54 118.70 123.69 2w3r s GLU 163 Ca 0.05 -0.67 -0.25 0.00 0.02 0.00 0.00 54.97 54.11 2w3r s GLU 163 Cb -0.12 -2.61 0.09 0.00 0.10 0.00 0.00 34.13 31.58 2w3r s GLU 163 CO -0.05 0.61 1.18 0.20 0.02 0.00 0.00 175.26 177.22 2w3r s GLY 164 N -1.64 0.01 -0.29 -1.39 0.00 -0.77 -5.02 107.32 98.22 2w3r s GLY 164 Ca 0.20 -0.18 -0.16 0.00 0.00 0.00 0.00 44.72 44.59 2w3r s GLY 164 CO 0.11 4.54 0.87 0.00 0.00 0.00 0.00 173.10 178.62 2w3r s PHE 166 N 1.61 0.06 -0.08 0.00 -0.12 -1.01 -5.02 117.98 113.41 2w3r s PHE 166 Ca -0.09 -0.46 -0.12 0.00 -0.05 0.00 0.00 56.93 56.21 2w3r s PHE 166 Cb -0.05 0.02 -0.05 0.00 -0.63 0.00 0.00 43.02 42.31 2w3r s PHE 166 CO -0.17 -0.58 0.28 -1.21 -0.05 0.00 0.00 175.22 173.49 2w3r s GLU 167 N -3.84 3.84 -0.23 1.99 0.41 -1.26 -2.04 118.70 117.57 2w3r s GLU 167 Ca 0.04 0.14 0.00 0.00 -0.41 0.00 0.00 54.97 54.74 2w3r s GLU 167 Cb 0.04 -3.26 0.03 0.00 -1.78 0.00 0.00 34.13 29.16 2w3r s GLU 167 CO -0.11 0.61 -0.12 0.42 -0.49 0.00 0.00 175.26 175.57 2w3r s ILE 168 N -0.67 2.45 0.60 -1.63 1.01 0.18 -1.54 121.20 121.60 2w3r s ILE 168 Ca 0.19 -1.15 -0.16 0.00 0.00 0.00 0.00 60.65 59.52 2w3r s ILE 168 Cb -0.14 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 2w3r s ILE 168 CO 0.08 0.24 1.09 -0.83 0.00 0.00 0.00 174.94 175.52 2w3r s GLY 169 N 1.26 2.24 0.00 6.18 0.00 -0.95 -0.59 107.32 115.46 2w3r s GLY 169 Ca -0.01 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.24 2w3r s GLY 169 CO -0.07 0.87 0.00 0.61 0.00 0.00 0.00 173.10 174.51 2w3r n GLY 170 N -0.58 -1.62 3.45 0.20 0.00 -1.26 -4.71 105.19 100.66 2w3r n GLY 170 Ca 0.10 -1.53 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.22 0.57 -0.05 1.61 0.74 -1.21 -4.76 119.66 115.34 2w3r s GLN 171 Ca 0.00 0.93 -0.20 0.00 0.05 0.00 0.00 55.36 56.14 2w3r s GLN 171 Cb 0.00 0.13 -0.05 0.00 1.10 0.00 0.00 33.01 34.19 2w3r s GLN 171 CO 0.00 -0.13 0.59 -2.00 -0.55 0.00 0.00 175.29 173.19 2w3r s GLU 172 N 1.17 4.35 0.15 1.67 2.56 -1.26 -0.39 118.70 126.95 2w3r s GLU 172 Ca -0.07 0.69 -0.17 0.00 0.00 0.00 0.00 54.97 55.42 2w3r s GLU 172 Cb -0.06 -3.39 0.05 0.00 2.00 0.00 0.00 34.13 32.73 2w3r s GLU 172 CO -0.11 0.24 1.74 0.45 -0.56 0.00 0.00 175.26 177.02 2w3r h HIS 173 N 6.19 0.15 -6.46 5.30 3.86 -1.96 -3.47 115.15 118.75 2w3r h HIS 173 Ca -0.43 0.02 -0.49 0.00 -1.16 0.00 0.00 60.37 58.30 2w3r h HIS 173 Cb 1.19 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.60 2w3r h HIS 173 CO 0.65 0.05 -0.88 0.34 0.86 0.00 0.00 177.93 178.94 2w3r n PHE 174 N -5.06 -1.66 -1.78 2.45 7.35 -1.26 -4.95 117.46 112.54 2w3r n PHE 174 Ca 0.01 0.75 -0.41 0.00 -0.76 0.00 0.00 57.45 57.03 2w3r n PHE 174 Cb 0.14 -3.79 -0.01 0.00 0.35 0.00 0.00 39.48 36.16 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 -3.94 2.74 0.28 -5.13 -0.85 -1.26 -4.94 117.35 104.24 2w3r s TYR 175 Ca 0.00 0.80 -0.02 0.00 -0.52 0.00 0.00 57.07 57.34 2w3r s TYR 175 Cb -0.00 -4.07 0.39 0.00 0.38 0.00 0.00 41.96 38.66 2w3r s TYR 175 CO 0.88 -3.57 1.83 -0.07 -1.52 0.00 0.00 175.55 173.09 2w3r h LEU 176 N 4.73 0.79 -9.19 -3.49 -0.00 -1.86 -3.38 115.31 102.91 2w3r h LEU 176 Ca -0.47 -0.14 -0.58 0.00 -0.00 0.00 0.00 57.88 56.69 2w3r h LEU 176 Cb 1.22 -0.21 -0.08 0.00 -0.00 0.00 0.00 40.66 41.60 2w3r h LEU 176 CO 0.78 0.77 0.14 -0.70 -0.00 0.00 0.00 178.44 179.44 2w3r s GLU 177 N -5.24 4.29 0.70 1.13 2.12 -0.96 -5.07 118.70 115.67 2w3r s GLU 177 Ca -0.10 0.73 -0.12 0.00 0.36 0.00 0.00 54.97 55.85 2w3r s GLU 177 Cb 0.16 -3.54 0.17 0.00 0.26 0.00 0.00 34.13 31.18 2w3r s GLU 177 CO 0.80 -0.16 0.64 0.41 -0.54 0.00 0.00 175.26 176.41 2w3r n GLY 178 N 3.55 -2.55 3.74 -1.50 0.00 -1.26 -4.74 105.19 102.43 2w3r n GLY 178 Ca -0.01 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 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 -4.46 4.56 -0.10 1.61 -1.52 -1.26 -4.94 119.66 113.55 2w3r s GLN 179 Ca 0.41 1.80 -0.25 0.00 -1.95 0.00 0.00 55.36 55.37 2w3r s GLN 179 Cb -0.04 -3.24 0.06 0.00 -0.22 0.00 0.00 33.01 29.57 2w3r s GLN 179 CO 0.31 0.04 0.60 0.00 -0.25 0.00 0.00 175.29 176.00 2w3r s ALA 180 N -0.40 -1.54 0.10 6.09 0.00 -1.26 -1.48 121.76 123.27 2w3r s ALA 180 Ca 0.49 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.68 2w3r s ALA 180 Cb -0.31 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 2w3r s ALA 180 CO 0.37 -0.33 0.17 0.00 0.00 0.00 0.00 175.76 175.97 2w3r s ALA 181 N -0.75 0.02 -0.26 0.00 0.00 0.52 -0.92 121.76 120.37 2w3r s ALA 181 Ca -0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 2w3r s ALA 181 Cb -0.02 0.57 0.15 0.00 0.00 0.00 0.00 23.12 23.82 2w3r s ALA 181 CO 0.06 -0.52 0.41 -1.17 0.00 0.00 0.00 175.76 174.54 2w3r s LEU 182 N -2.91 -0.76 -0.16 0.00 2.96 0.22 -0.92 118.68 117.12 2w3r s LEU 182 Ca 0.10 0.07 -0.15 0.00 -0.22 0.00 0.00 54.13 53.92 2w3r s LEU 182 Cb 0.05 1.21 -0.04 0.00 0.50 0.00 0.00 46.19 47.91 2w3r s LEU 182 CO -0.07 -0.32 0.34 0.00 -1.32 0.00 0.00 176.35 174.98 2w3r s ALA 183 N 2.57 3.56 -0.29 5.97 0.00 0.19 -1.30 121.76 132.47 2w3r s ALA 183 Ca 0.12 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 2w3r s ALA 183 Cb -0.14 -2.47 0.05 0.00 0.00 0.00 0.00 23.12 20.56 2w3r s ALA 183 CO -0.21 0.03 -0.03 -0.51 0.00 0.00 0.00 175.76 175.04 2w3r s LEU 184 N 0.59 3.71 -0.30 0.00 1.43 0.08 -1.76 118.68 122.43 2w3r s LEU 184 Ca 0.19 -1.24 -0.30 0.00 -1.03 0.00 0.00 54.13 51.75 2w3r s LEU 184 Cb -0.14 -1.68 -0.07 0.00 0.03 0.00 0.00 46.19 44.34 2w3r s LEU 184 CO 0.06 -0.23 2.25 -0.81 0.23 0.00 0.00 176.35 177.85 2w3r n PRO 185 N 4.59 1.58 -3.86 1.29 -0.04 -1.26 -0.95 135.00 136.35 2w3r n PRO 185 Ca -0.14 0.40 -0.34 0.00 -0.04 0.00 0.00 63.50 63.38 2w3r n PRO 185 Cb 0.44 -3.02 -0.13 0.00 -0.04 0.00 0.00 33.50 30.75 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 8.53 3.14 0.00 0.55 0.00 -0.53 -4.95 121.76 128.50 2w3r s ALA 186 Ca 1.04 -2.70 0.00 0.00 0.00 0.00 0.00 51.96 50.30 2w3r s ALA 186 Cb -0.48 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.36 2w3r s ALA 186 CO 0.38 -1.83 0.00 -0.85 0.00 0.00 0.00 175.76 173.47 2w3r n GLU 187 N 4.20 0.00 0.00 0.00 0.28 -1.26 -0.99 120.64 122.87 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 0.40 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.27 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 0.25 2.88 0.00 -1.84 0.00 -1.26 -4.96 105.19 100.26 2w3r n GLY 188 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.10 5.12 3.12 -0.02 0.00 -0.16 -5.03 105.19 108.13 2w3r n GLY 189 Ca 0.00 -1.38 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.93 0.64 -0.22 1.61 -7.23 -0.74 -1.46 120.40 112.07 2w3r s VAL 190 Ca 0.00 -1.50 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 2w3r s VAL 190 Cb 0.00 -1.14 0.02 0.00 0.56 0.00 0.00 36.38 35.82 2w3r s VAL 190 CO 0.00 -0.61 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.38 2w3r s VAL 191 N -2.44 2.62 -0.35 1.32 1.01 -0.12 -1.85 120.40 120.59 2w3r s VAL 191 Ca 0.01 -0.95 -0.14 0.00 0.00 0.00 0.00 61.98 60.90 2w3r s VAL 191 Cb -0.03 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 2w3r s VAL 191 CO -0.02 0.34 0.29 -0.63 0.00 0.00 0.00 175.10 175.08 2w3r s ILE 192 N 1.32 5.24 -0.15 2.22 -1.09 0.29 -0.74 121.20 128.30 2w3r s ILE 192 Ca 0.02 -0.19 -0.12 0.00 -2.23 0.00 0.00 60.65 58.13 2w3r s ILE 192 Cb -0.15 -3.78 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 2w3r s ILE 192 CO -0.07 -0.08 0.25 -1.00 -1.23 0.00 0.00 174.94 172.80 2w3r s HIS 193 N 1.82 3.49 0.16 3.97 3.76 -0.42 -0.55 115.29 127.52 2w3r s HIS 193 Ca 0.08 0.56 -0.22 0.00 -0.15 0.00 0.00 55.06 55.33 2w3r s HIS 193 Cb -0.17 -2.24 0.07 0.00 1.11 0.00 0.00 32.58 31.34 2w3r s HIS 193 CO 0.11 0.36 0.59 0.00 -0.85 0.00 0.00 174.74 174.94 2w3r n SER 195 N -0.37 5.52 -4.21 0.00 2.88 -0.10 -4.71 113.62 112.62 2w3r n SER 195 Ca -0.17 -3.07 -0.20 0.00 -1.33 0.00 0.00 58.87 54.11 2w3r n SER 195 Cb 0.65 -1.43 -0.12 0.00 -0.75 0.00 0.00 64.21 62.56 2w3r n SER 195 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2w3r s SER 196 N 1.38 1.97 0.00 -3.46 0.15 -1.26 -4.63 113.70 107.85 2w3r s SER 196 Ca 0.35 -0.66 0.28 0.00 0.70 0.00 0.00 55.95 56.62 2w3r s SER 196 Cb -0.05 -0.08 0.99 0.00 -1.71 0.00 0.00 66.02 65.17 2w3r s SER 196 CO -0.03 -0.04 1.71 0.00 1.20 0.00 0.00 173.24 176.07 2w3r n GLN 197 N 1.14 1.70 -3.05 5.44 6.02 -0.60 -4.65 117.38 123.37 2w3r n GLN 197 Ca -0.20 -1.02 -0.16 0.00 -0.01 0.00 0.00 57.00 55.60 2w3r n GLN 197 Cb 0.54 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 30.29 2w3r n GLN 197 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2w3r n HIS 198 N 0.24 -2.12 0.11 1.08 -0.00 -1.26 -1.15 115.22 112.12 2w3r n HIS 198 Ca 0.19 -2.51 0.01 0.00 0.46 0.00 0.00 57.72 55.87 2w3r n HIS 198 Cb 0.37 0.74 0.33 0.00 -0.12 0.00 0.00 29.99 31.31 2w3r n HIS 198 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2w3r h PRO 199 N 4.86 0.24 -0.27 1.57 0.11 -1.92 -1.73 132.00 134.85 2w3r h PRO 199 Ca 0.10 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 2w3r h PRO 199 Cb 0.98 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 2w3r h PRO 199 CO 0.27 0.46 -0.05 0.77 -0.21 0.00 0.00 178.00 179.24 2w3r h SER 200 N 0.22 0.40 -0.00 -2.05 0.02 -1.94 0.57 113.55 110.78 2w3r h SER 200 Ca 0.04 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2w3r h SER 200 Cb 0.52 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2w3r h SER 200 CO 0.04 0.50 -0.12 -0.08 -1.14 0.00 0.00 176.83 176.02 2w3r h GLU 201 N 0.41 0.08 -0.97 3.45 4.81 -1.76 -2.33 114.58 118.27 2w3r h GLU 201 Ca 0.09 -0.09 0.28 0.00 -0.13 0.00 0.00 59.36 59.51 2w3r h GLU 201 Cb 0.35 0.03 -0.14 0.00 0.63 0.00 0.00 28.75 29.61 2w3r h GLU 201 CO 0.01 0.85 0.50 0.82 -0.73 0.00 0.00 179.01 180.47 2w3r h ILE 202 N -0.65 0.36 0.64 2.32 1.08 -1.03 0.16 117.51 120.39 2w3r h ILE 202 Ca -0.02 -0.12 -0.03 0.00 -0.39 0.00 0.00 64.86 64.30 2w3r h ILE 202 Cb 0.90 -0.03 0.01 0.00 -3.07 0.00 0.00 36.82 34.62 2w3r h ILE 202 CO 0.02 0.07 -0.31 -0.61 -0.69 0.00 0.00 178.15 176.63 2w3r h GLN 203 N 0.36 -0.83 -0.89 2.37 4.15 -0.89 -2.09 115.11 117.29 2w3r h GLN 203 Ca 0.67 0.06 0.14 0.00 0.77 0.00 0.00 58.65 60.29 2w3r h GLN 203 Cb 1.44 0.19 -0.09 0.00 0.21 0.00 0.00 27.48 29.22 2w3r h GLN 203 CO -0.58 -0.54 0.50 1.25 -1.93 0.00 0.00 178.83 177.52 2w3r h HIS 204 N -0.89 0.88 0.03 3.99 2.76 -0.18 0.73 115.15 122.47 2w3r h HIS 204 Ca -0.09 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.11 2w3r h HIS 204 Cb 0.67 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.37 2w3r h HIS 204 CO -0.03 0.25 -0.01 0.87 -1.30 0.00 0.00 177.93 177.71 2w3r h LYS 205 N 0.72 -0.03 -1.00 5.26 1.79 -1.10 -2.86 116.57 119.33 2w3r h LYS 205 Ca 0.48 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 59.02 2w3r h LYS 205 Cb 0.64 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 31.23 2w3r h LYS 205 CO -0.34 0.65 0.65 0.28 -1.08 0.00 0.00 179.45 179.61 2w3r h VAL 206 N -0.79 1.09 0.01 0.50 2.07 -1.08 0.18 116.25 118.23 2w3r h VAL 206 Ca -0.00 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.14 2w3r h VAL 206 Cb 0.70 -0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2w3r h VAL 206 CO 0.01 0.22 -0.29 0.00 0.02 0.00 0.00 177.57 177.53 2w3r h ALA 207 N 1.45 -0.41 0.00 1.67 0.00 -0.92 -1.96 119.26 119.10 2w3r h ALA 207 Ca 0.43 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.27 2w3r h ALA 207 Cb 0.16 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2w3r h ALA 207 CO -0.17 -0.80 -0.28 0.45 0.00 0.00 0.00 179.25 178.45 2w3r h HIS 208 N -0.44 0.00 0.00 0.00 -0.00 -1.08 0.12 115.15 113.76 2w3r h HIS 208 Ca 0.06 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.36 2w3r h HIS 208 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.92 2w3r h HIS 208 CO -0.31 0.28 -0.34 0.00 -0.00 0.00 0.00 177.93 177.56 2w3r h ALA 209 N 1.72 1.04 -0.07 2.45 0.00 -0.30 -2.71 119.26 121.39 2w3r h ALA 209 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2w3r h ALA 209 Cb 0.57 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2w3r h ALA 209 CO 0.04 0.42 0.00 1.28 0.00 0.00 0.00 179.25 180.99 2w3r n LEU 210 N -3.56 2.17 -2.94 0.00 4.77 -0.77 -3.98 117.00 112.69 2w3r n LEU 210 Ca -0.00 -1.14 -0.20 0.00 -0.03 0.00 0.00 56.01 54.63 2w3r n LEU 210 Cb 0.47 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.58 2w3r n LEU 210 CO 0.36 0.43 0.11 0.61 -1.33 0.00 0.00 177.39 177.57 2w3r n GLY 211 N 0.69 -0.36 3.54 -0.72 0.00 -0.39 -4.96 105.19 102.99 2w3r n GLY 211 Ca 0.08 0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -6.21 2.89 0.59 0.99 1.43 0.30 -5.02 118.68 113.65 2w3r s LEU 212 Ca 0.39 -0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 52.85 2w3r s LEU 212 Cb -0.17 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2w3r s LEU 212 CO 0.49 0.18 1.13 0.00 0.23 0.00 0.00 176.35 178.37 2w3r s ALA 213 N -1.20 2.59 0.30 4.21 0.00 -1.26 -4.29 121.76 122.11 2w3r s ALA 213 Ca 0.20 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.95 2w3r s ALA 213 Cb -0.11 -3.36 0.71 0.00 0.00 0.00 0.00 23.12 20.37 2w3r s ALA 213 CO 0.12 -1.01 1.79 0.74 0.00 0.00 0.00 175.76 177.40 2w3r h PHE 214 N 0.71 1.08 0.00 0.00 -1.00 -1.94 -0.21 116.94 115.58 2w3r h PHE 214 Ca -0.49 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.33 2w3r h PHE 214 Cb 1.26 -0.33 0.00 0.00 3.61 0.00 0.00 35.95 40.49 2w3r h PHE 214 CO 0.52 0.28 0.00 -2.39 -1.61 0.00 0.00 178.31 175.11 2w3r n HIS 215 N -4.72 0.00 0.70 -0.55 1.44 -1.26 -1.70 115.22 109.12 2w3r n HIS 215 Ca 0.22 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.04 2w3r n HIS 215 Cb 0.53 -0.12 0.13 0.00 0.12 0.00 0.00 29.99 30.65 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 -1.12 3.03 -4.00 4.39 8.00 -0.09 -4.89 116.55 121.87 2w3r n ASP 216 Ca 0.08 -1.94 -0.30 0.00 0.71 0.00 0.00 54.79 53.34 2w3r n ASP 216 Cb 0.07 -0.08 -0.16 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.70 1.57 -0.14 2.53 1.01 -0.69 -1.80 120.40 121.18 2w3r s VAL 217 Ca 0.30 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 2w3r s VAL 217 Cb 0.19 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 2w3r s VAL 217 CO 0.28 0.32 -0.14 -0.60 0.00 0.00 0.00 175.10 174.97 2w3r s ARG 218 N 1.46 3.32 -0.19 2.72 3.52 -0.77 -4.94 118.95 124.07 2w3r s ARG 218 Ca 0.02 -0.71 0.00 0.00 -0.13 0.00 0.00 55.73 54.92 2w3r s ARG 218 Cb -0.14 -2.64 0.02 0.00 -1.56 0.00 0.00 34.95 30.62 2w3r s ARG 218 CO -0.09 0.12 -0.17 0.08 -0.81 0.00 0.00 175.30 174.43 2w3r s VAL 219 N 0.57 2.27 -0.21 7.11 1.01 -1.26 0.11 120.40 130.00 2w3r s VAL 219 Ca -0.08 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 2w3r s VAL 219 Cb -0.16 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.24 2w3r s VAL 219 CO 0.03 0.48 -0.12 -1.61 0.00 0.00 0.00 175.10 173.89 2w3r s GLU 220 N 1.31 3.04 -0.20 2.72 2.02 0.29 -2.21 118.70 125.66 2w3r s GLU 220 Ca 0.04 -0.83 -0.01 0.00 0.02 0.00 0.00 54.97 54.20 2w3r s GLU 220 Cb -0.14 -2.81 0.05 0.00 0.10 0.00 0.00 34.13 31.33 2w3r s GLU 220 CO -0.11 -0.27 -0.03 1.41 0.02 0.00 0.00 175.26 176.28 2w3r s MET 221 N 1.35 1.31 -0.14 1.61 -2.45 0.16 -3.85 119.30 117.29 2w3r s MET 221 Ca 0.03 -0.69 -0.11 0.00 -1.25 0.00 0.00 55.69 53.68 2w3r s MET 221 Cb -0.15 -2.27 -0.07 0.00 1.25 0.00 0.00 34.83 33.59 2w3r s MET 221 CO -0.08 -0.55 -0.01 -0.09 1.05 0.00 0.00 175.02 175.34 2w3r h ARG 222 N 8.08 0.00 -3.78 4.11 9.65 -1.86 0.05 114.38 130.64 2w3r h ARG 222 Ca -0.20 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.60 2w3r h ARG 222 Cb 1.10 0.00 -0.12 0.00 -1.39 0.00 0.00 29.97 29.56 2w3r h ARG 222 CO 0.39 0.24 -0.26 -0.98 2.80 0.00 0.00 179.97 182.17 2w3r s ARG 223 N -2.12 1.20 -0.02 0.20 1.70 -1.26 -4.33 118.95 114.32 2w3r s ARG 223 Ca -0.15 -1.12 0.04 0.00 -0.47 0.00 0.00 55.73 54.04 2w3r s ARG 223 Cb 0.02 0.40 -0.01 0.00 -0.57 0.00 0.00 34.95 34.79 2w3r s ARG 223 CO 0.27 -0.45 -0.15 -1.64 -1.08 0.00 0.00 175.30 172.25 2w3r s MET 224 N -3.95 1.37 0.00 3.89 -1.94 0.66 -4.80 119.30 114.53 2w3r s MET 224 Ca 0.16 -0.54 0.00 0.00 -1.71 0.00 0.00 55.69 53.60 2w3r s MET 224 Cb 0.03 -1.27 0.00 0.00 2.01 0.00 0.00 34.83 35.59 2w3r s MET 224 CO -0.00 0.28 1.32 0.41 -0.01 0.00 0.00 175.02 177.02 2w3r n GLY 225 N 2.90 2.00 0.00 -0.03 0.00 -1.26 -4.30 105.19 104.51 2w3r n GLY 225 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 1.08 3.61 1.22 -0.02 0.00 -1.21 -2.26 105.19 107.61 2w3r n GLY 226 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 2w3r n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3r n GLY 227 N 0.12 -0.03 2.82 -0.02 0.00 -1.26 -4.85 105.19 101.97 2w3r n GLY 227 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2w3r n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2w3r n PHE 228 N -3.04 0.00 0.00 1.61 3.01 -1.26 -0.03 117.46 117.75 2w3r n PHE 228 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2w3r n PHE 228 Cb 0.00 -2.57 0.00 0.00 -0.01 0.00 0.00 39.48 36.90 2w3r n PHE 228 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2w3r n GLY 229 N 0.35 3.22 0.00 1.37 0.00 -1.26 -0.51 105.19 108.36 2w3r n GLY 229 Ca -0.09 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.40 -0.67 0.18 -0.02 0.00 0.95 -2.52 105.19 101.71 2w3r n GLY 230 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.26 1.06 0.15 1.61 5.02 -1.25 -4.41 118.16 119.07 2w3r n LYS 231 Ca 0.06 -1.76 0.00 0.00 -2.02 0.00 0.00 58.31 54.59 2w3r n LYS 231 Cb 0.09 -1.04 0.20 0.00 -0.02 0.00 0.00 35.03 34.27 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 0.00 0.00 1.97 4.81 -1.84 -1.60 114.58 117.92 2w3r h GLU 232 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2w3r h GLU 232 Cb 1.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2w3r h GLU 232 CO 0.00 0.56 0.00 -1.13 -0.73 0.00 0.00 179.01 177.71 2w3r n SER 233 N -3.71 0.00 0.25 1.04 3.41 -1.26 -4.64 113.62 108.71 2w3r n SER 233 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.72 2w3r n SER 233 Cb 0.60 0.00 0.66 0.00 -0.26 0.00 0.00 64.21 65.21 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 -1.79 -2.46 115.11 116.27 2w3r h GLN 234 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 2w3r h GLN 234 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2w3r h GLN 234 CO 0.00 0.14 -0.03 0.78 -0.95 0.00 0.00 178.83 178.77 2w3r h GLY 235 N 1.19 0.00 0.44 3.46 0.00 -1.83 -3.22 103.07 103.10 2w3r h GLY 235 Ca -0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.49 2w3r h GLY 235 CO 0.02 0.00 0.58 3.43 0.00 0.00 0.00 176.54 180.57 2w3r h ASN 236 N 0.00 0.57 0.11 0.19 -0.26 -1.76 -2.63 115.58 111.81 2w3r h ASN 236 Ca -0.00 0.04 -0.20 0.00 -0.56 0.00 0.00 56.30 55.59 2w3r h ASN 236 Cb 0.30 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 2w3r h ASN 236 CO 0.00 0.27 -0.75 0.45 -1.06 0.00 0.00 177.43 176.34 2w3r h HIS 237 N 0.59 0.74 0.01 1.19 3.86 -1.80 -2.47 115.15 117.28 2w3r h HIS 237 Ca 0.46 -0.33 -0.22 0.00 -1.16 0.00 0.00 60.37 59.12 2w3r h HIS 237 Cb 0.88 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.23 2w3r h HIS 237 CO -0.00 1.11 -0.95 -0.07 0.86 0.00 0.00 177.93 178.88 2w3r h LEU 238 N 0.37 0.47 -0.65 2.43 4.07 -1.74 -2.38 115.31 117.89 2w3r h LEU 238 Ca -0.04 -0.38 -0.09 0.00 0.08 0.00 0.00 57.88 57.45 2w3r h LEU 238 Cb 1.34 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.91 2w3r h LEU 238 CO 0.14 1.19 0.07 0.00 -1.08 0.00 0.00 178.44 178.75 2w3r h ALA 239 N 0.78 0.87 -0.14 1.53 0.00 -1.47 -0.11 119.26 120.72 2w3r h ALA 239 Ca -0.08 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.44 2w3r h ALA 239 Cb 1.59 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2w3r h ALA 239 CO 0.16 0.67 -0.34 0.82 0.00 0.00 0.00 179.25 180.56 2w3r h ILE 240 N 1.02 1.37 -0.43 0.00 2.04 -1.49 -1.96 117.51 118.05 2w3r h ILE 240 Ca 0.19 -1.62 0.06 0.00 1.00 0.00 0.00 64.86 64.49 2w3r h ILE 240 Cb 0.49 2.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.58 2w3r h ILE 240 CO 0.02 0.48 0.15 0.00 0.00 0.00 0.00 178.15 178.80 2w3r h ALA 241 N 0.53 0.51 -0.52 1.87 0.00 -1.38 -0.44 119.26 119.83 2w3r h ALA 241 Ca -0.00 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2w3r h ALA 241 Cb 0.95 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2w3r h ALA 241 CO 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 179.25 179.07 2w3r h ALA 243 N 0.94 -0.45 -0.61 0.00 0.00 -1.03 -1.85 119.26 116.25 2w3r h ALA 243 Ca 0.15 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2w3r h ALA 243 Cb 0.54 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2w3r h ALA 243 CO 0.03 -0.67 0.26 0.28 0.00 0.00 0.00 179.25 179.14 2w3r h VAL 244 N -0.62 1.23 -0.39 0.00 2.07 -1.15 0.46 116.25 117.85 2w3r h VAL 244 Ca -0.05 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2w3r h VAL 244 Cb 0.45 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2w3r h VAL 244 CO 0.08 0.28 0.25 0.00 0.02 0.00 0.00 177.57 178.19 2w3r h ALA 245 N 1.10 0.49 -0.04 1.67 0.00 -1.50 -1.00 119.26 119.98 2w3r h ALA 245 Ca 0.21 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2w3r h ALA 245 Cb 0.19 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2w3r h ALA 245 CO -0.02 -0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.22 2w3r h ALA 246 N 1.13 0.05 -0.69 0.00 0.00 -1.06 0.55 119.26 119.24 2w3r h ALA 246 Ca 0.14 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2w3r h ALA 246 Cb -0.04 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.65 2w3r h ALA 246 CO -0.03 -0.43 0.26 -0.09 0.00 0.00 0.00 179.25 178.95 2w3r h ARG 247 N 0.02 0.40 -0.00 0.00 2.43 -0.72 0.58 114.38 117.10 2w3r h ARG 247 Ca 0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2w3r h ARG 247 Cb 0.03 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2w3r h ARG 247 CO -0.00 0.27 -0.01 0.00 -1.51 0.00 0.00 179.97 178.71 2w3r h ALA 248 N 1.49 0.00 0.00 2.80 0.00 -0.92 -3.32 119.26 119.32 2w3r h ALA 248 Ca 0.36 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2w3r h ALA 248 Cb 0.51 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2w3r h ALA 248 CO -0.37 -0.15 -0.71 1.79 0.00 0.00 0.00 179.25 179.81 2w3r h THR 249 N -0.65 1.28 0.00 0.00 1.35 -0.81 -3.47 112.91 110.60 2w3r h THR 249 Ca -0.00 -2.66 0.00 0.00 -0.55 0.00 0.00 66.41 63.20 2w3r h THR 249 Cb 0.68 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.64 2w3r h THR 249 CO 0.00 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 2w3r n GLY 250 N 1.09 2.36 3.91 5.82 0.00 0.20 -5.04 105.19 113.54 2w3r n GLY 250 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.34 3.59 0.33 1.61 0.52 -1.24 -4.83 118.95 118.59 2w3r s ARG 251 Ca 0.00 0.08 -0.29 0.00 -0.52 0.00 0.00 55.73 55.00 2w3r s ARG 251 Cb 0.00 -2.51 -0.11 0.00 0.52 0.00 0.00 34.95 32.85 2w3r s ARG 251 CO 0.00 0.01 1.56 -2.14 0.02 0.00 0.00 175.30 174.74 2w3r s PRO 252 N -4.19 4.11 -0.10 3.54 0.02 -1.26 -4.30 135.00 132.82 2w3r s PRO 252 Ca 0.46 2.58 0.01 0.00 0.02 0.00 0.00 61.00 64.07 2w3r s PRO 252 Cb -0.10 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.44 2w3r s PRO 252 CO 0.37 -0.60 -0.13 0.00 -0.33 0.00 0.00 177.00 176.31 2w3r s LYS 254 N 1.08 2.20 -0.06 0.00 2.20 -0.50 -0.63 119.74 124.02 2w3r s LYS 254 Ca -0.05 -0.89 -0.02 0.00 -0.36 0.00 0.00 55.97 54.64 2w3r s LYS 254 Cb -0.15 -2.21 0.04 0.00 -1.51 0.00 0.00 37.83 34.01 2w3r s LYS 254 CO -0.02 0.57 0.12 1.41 -0.36 0.00 0.00 175.35 177.06 2w3r s MET 255 N -1.05 0.02 -0.03 4.03 1.75 -0.09 -1.29 119.30 122.63 2w3r s MET 255 Ca 0.13 0.41 0.01 0.00 -1.25 0.00 0.00 55.69 54.98 2w3r s MET 255 Cb -0.10 -0.28 0.02 0.00 2.84 0.00 0.00 34.83 37.30 2w3r s MET 255 CO 0.02 -0.24 -0.04 -0.98 -0.65 0.00 0.00 175.02 173.13 2w3r s ARG 256 N 1.71 0.69 0.24 4.11 1.70 -1.26 -0.35 118.95 125.79 2w3r s ARG 256 Ca -0.03 -0.11 -0.30 0.00 -0.47 0.00 0.00 55.73 54.83 2w3r s ARG 256 Cb -0.12 -0.71 -0.09 0.00 -0.57 0.00 0.00 34.95 33.46 2w3r s ARG 256 CO -0.05 -0.04 1.28 0.71 -1.08 0.00 0.00 175.30 176.12 2w3r s TYR 257 N 0.69 3.25 0.83 5.89 4.12 -0.55 -5.01 117.35 126.56 2w3r s TYR 257 Ca -0.09 1.33 -0.11 0.00 0.02 0.00 0.00 57.07 58.23 2w3r s TYR 257 Cb -0.12 -3.58 0.09 0.00 -1.52 0.00 0.00 41.96 36.83 2w3r s TYR 257 CO -0.00 -1.70 1.12 0.34 0.02 0.00 0.00 175.55 175.32 2w3r s ASP 258 N -0.03 3.84 0.25 2.29 -1.08 -1.26 -4.67 116.67 116.01 2w3r s ASP 258 Ca 0.53 2.00 -0.04 0.00 -0.52 0.00 0.00 52.55 54.52 2w3r s ASP 258 Cb -0.37 -2.54 0.39 0.00 -1.46 0.00 0.00 42.92 38.94 2w3r s ASP 258 CO 0.42 -2.49 1.83 -0.09 0.52 0.00 0.00 175.17 175.37 2w3r h ARG 259 N -1.39 0.89 0.56 4.34 9.65 -1.95 -0.28 114.38 126.20 2w3r h ARG 259 Ca -0.43 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 58.36 2w3r h ARG 259 Cb 1.25 -0.20 0.01 0.00 -1.39 0.00 0.00 29.97 29.63 2w3r h ARG 259 CO 0.47 0.59 -0.27 -0.44 2.80 0.00 0.00 179.97 183.12 2w3r h ASP 260 N 0.91 -0.64 -0.45 -3.80 3.45 -1.92 -1.61 116.42 112.36 2w3r h ASP 260 Ca 0.40 0.01 0.07 0.00 0.43 0.00 0.00 57.03 57.94 2w3r h ASP 260 Cb 0.29 0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 39.17 2w3r h ASP 260 CO -0.21 -0.44 0.12 0.44 -1.57 0.00 0.00 179.24 177.58 2w3r h ASP 261 N -0.78 0.08 -0.23 6.45 5.19 -1.83 -1.49 116.42 123.81 2w3r h ASP 261 Ca -0.08 0.07 0.06 0.00 -0.62 0.00 0.00 57.03 56.46 2w3r h ASP 261 Cb 0.59 0.07 -0.07 0.00 0.18 0.00 0.00 39.33 40.10 2w3r h ASP 261 CO 0.13 0.08 -0.29 -0.78 -3.12 0.00 0.00 179.24 175.25 2w3r h ASP 262 N 0.27 -0.93 0.52 6.45 3.58 -0.91 0.53 116.42 125.94 2w3r h ASP 262 Ca 0.22 0.15 -0.05 0.00 0.42 0.00 0.00 57.03 57.77 2w3r h ASP 262 Cb 0.25 0.42 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 2w3r h ASP 262 CO -0.25 -0.32 -0.22 0.24 -2.88 0.00 0.00 179.24 175.81 2w3r h MET 263 N -0.31 0.00 0.08 0.28 2.86 -0.87 -2.10 114.93 114.87 2w3r h MET 263 Ca 0.13 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.46 2w3r h MET 263 Cb 0.51 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 2w3r h MET 263 CO -0.41 0.22 -1.70 0.28 1.06 0.00 0.00 176.91 176.37 2w3r h VAL 264 N 0.00 0.75 -0.05 -2.22 2.07 -0.51 -3.41 116.25 112.89 2w3r h VAL 264 Ca -0.00 -2.28 -0.02 0.00 0.82 0.00 0.00 66.70 65.21 2w3r h VAL 264 Cb 0.54 2.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.71 2w3r h VAL 264 CO 0.03 0.67 -0.06 0.40 0.02 0.00 0.00 177.57 178.63 2w3r h ILE 265 N -0.35 1.40 -4.50 4.57 2.04 0.03 -3.45 117.51 117.24 2w3r h ILE 265 Ca -0.39 -1.27 -0.48 0.00 1.00 0.00 0.00 64.86 63.71 2w3r h ILE 265 Cb 1.75 2.14 0.09 0.00 -0.74 0.00 0.00 36.82 40.06 2w3r h ILE 265 CO -0.03 0.35 0.40 0.42 0.00 0.00 0.00 178.15 179.29 2w3r s THR 266 N -4.15 2.89 0.90 -0.27 -4.23 -0.79 -4.79 115.64 105.20 2w3r s THR 266 Ca -0.15 0.29 -0.14 0.00 -1.18 0.00 0.00 61.69 60.51 2w3r s THR 266 Cb 0.03 -3.26 0.21 0.00 1.34 0.00 0.00 72.50 70.81 2w3r s THR 266 CO 0.70 -0.38 1.23 0.61 -0.54 0.00 0.00 174.62 176.25 2w3r n GLY 267 N -3.01 -1.23 3.19 3.99 0.00 -1.25 -4.78 105.19 102.09 2w3r n GLY 267 Ca 0.07 -1.75 -0.18 0.00 0.00 0.00 0.00 46.02 44.17 2w3r n GLY 267 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w3r n LYS 268 N -3.57 0.47 -2.28 1.61 5.02 -1.26 -4.79 118.16 113.36 2w3r n LYS 268 Ca 0.16 -3.14 -0.41 0.00 -2.02 0.00 0.00 58.31 52.89 2w3r n LYS 268 Cb 0.55 2.68 -0.03 0.00 -0.02 0.00 0.00 35.03 38.21 2w3r n LYS 268 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2w3r s ARG 269 N -3.20 4.41 -0.04 1.97 3.52 0.48 -1.13 118.95 124.96 2w3r s ARG 269 Ca 0.37 1.96 -0.33 0.00 -0.13 0.00 0.00 55.73 57.60 2w3r s ARG 269 Cb 0.01 -3.24 -0.12 0.00 -1.56 0.00 0.00 34.95 30.05 2w3r s ARG 269 CO 0.26 -0.23 1.87 0.72 -0.81 0.00 0.00 175.30 177.10 2w3r n HIS 270 N 2.98 2.36 -2.70 5.12 8.25 -1.26 -3.34 115.22 126.64 2w3r n HIS 270 Ca 0.07 -0.04 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 2w3r n HIS 270 Cb 0.44 -2.68 -0.06 0.00 1.12 0.00 0.00 29.99 28.82 2w3r n HIS 270 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2w3r s ASP 271 N 3.80 6.80 0.05 0.41 -4.77 -1.26 -4.66 116.67 117.04 2w3r s ASP 271 Ca 0.91 1.60 0.04 0.00 -3.30 0.00 0.00 52.55 51.80 2w3r s ASP 271 Cb -0.65 -2.51 -0.02 0.00 -1.09 0.00 0.00 42.92 38.65 2w3r s ASP 271 CO 0.49 -0.43 -0.12 -0.36 0.70 0.00 0.00 175.17 175.44 2w3r s PHE 272 N -2.33 1.05 -0.17 2.11 0.08 0.24 -1.58 117.98 117.38 2w3r s PHE 272 Ca 0.60 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 57.25 2w3r s PHE 272 Cb -0.09 -0.62 0.00 0.00 -0.57 0.00 0.00 43.02 41.74 2w3r s PHE 272 CO 0.20 0.01 -0.16 0.50 -0.10 0.00 0.00 175.22 175.68 2w3r s ARG 273 N -1.37 3.16 -0.20 0.44 3.52 -0.32 0.48 118.95 124.65 2w3r s ARG 273 Ca -0.02 -0.76 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 2w3r s ARG 273 Cb -0.09 -2.64 0.02 0.00 -1.56 0.00 0.00 34.95 30.68 2w3r s ARG 273 CO 0.01 -0.07 -0.15 0.42 -0.81 0.00 0.00 175.30 174.70 2w3r s ILE 274 N 1.02 2.35 -0.15 4.11 1.01 -0.87 -1.63 121.20 127.04 2w3r s ILE 274 Ca -0.02 -0.95 -0.08 0.00 0.00 0.00 0.00 60.65 59.60 2w3r s ILE 274 Cb -0.15 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2w3r s ILE 274 CO -0.04 0.43 0.13 -0.60 0.00 0.00 0.00 174.94 174.87 2w3r s ARG 275 N 1.30 3.77 0.01 2.79 3.52 -0.70 -2.42 118.95 127.22 2w3r s ARG 275 Ca 0.03 -0.17 -0.03 0.00 -0.13 0.00 0.00 55.73 55.43 2w3r s ARG 275 Cb -0.14 -3.29 -0.01 0.00 -1.56 0.00 0.00 34.95 29.95 2w3r s ARG 275 CO -0.10 0.57 0.04 1.52 -0.81 0.00 0.00 175.30 176.51 2w3r s TYR 276 N -0.42 0.14 -0.11 5.12 -0.85 -0.60 -0.48 117.35 120.16 2w3r s TYR 276 Ca 0.12 -0.30 -0.01 0.00 -0.52 0.00 0.00 57.07 56.35 2w3r s TYR 276 Cb -0.12 -0.11 0.04 0.00 0.38 0.00 0.00 41.96 42.15 2w3r s TYR 276 CO 0.01 -0.20 -0.01 1.03 -1.52 0.00 0.00 175.55 174.87 2w3r s ARG 277 N -1.21 0.87 -0.09 -3.49 0.52 0.00 -1.85 118.95 113.71 2w3r s ARG 277 Ca -0.13 -0.13 0.03 0.00 -0.52 0.00 0.00 55.73 54.98 2w3r s ARG 277 Cb -0.08 -1.43 0.00 0.00 0.52 0.00 0.00 34.95 33.97 2w3r s ARG 277 CO -0.00 -0.38 -0.21 -1.50 0.02 0.00 0.00 175.30 173.23 2w3r s ILE 278 N 1.87 1.82 0.17 1.52 2.07 0.30 -0.32 121.20 128.63 2w3r s ILE 278 Ca 0.03 -0.88 0.09 0.00 -1.41 0.00 0.00 60.65 58.49 2w3r s ILE 278 Cb -0.14 -1.59 -0.04 0.00 0.13 0.00 0.00 42.46 40.82 2w3r s ILE 278 CO -0.07 0.51 -0.15 -0.83 -1.91 0.00 0.00 174.94 172.49 2w3r s GLY 279 N 0.45 1.72 0.10 1.50 0.00 0.05 -0.40 107.32 110.74 2w3r s GLY 279 Ca -0.17 -1.48 -0.00 0.00 0.00 0.00 0.00 44.72 43.06 2w3r s GLY 279 CO 0.07 -1.49 -0.00 0.00 0.00 0.00 0.00 173.10 171.68 2w3r s ALA 280 N -1.55 0.81 0.88 3.20 0.00 -0.05 -2.16 121.76 122.87 2w3r s ALA 280 Ca 0.22 -1.37 -0.12 0.00 0.00 0.00 0.00 51.96 50.69 2w3r s ALA 280 Cb -0.09 0.50 0.12 0.00 0.00 0.00 0.00 23.12 23.64 2w3r s ALA 280 CO 0.13 -0.39 1.12 0.34 0.00 0.00 0.00 175.76 176.96 2w3r s ASP 281 N -3.01 3.79 0.50 0.00 -1.08 0.47 -2.55 116.67 114.79 2w3r s ASP 281 Ca 0.16 1.10 0.28 0.00 -0.52 0.00 0.00 52.55 53.57 2w3r s ASP 281 Cb 0.07 -1.73 1.24 0.00 -1.46 0.00 0.00 42.92 41.04 2w3r s ASP 281 CO -0.03 -2.39 1.96 0.00 0.52 0.00 0.00 175.17 175.22 2w3r h ALA 282 N -1.38 1.08 0.00 3.66 0.00 -1.94 -2.43 119.26 118.25 2w3r h ALA 282 Ca -0.50 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2w3r h ALA 282 Cb 1.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2w3r h ALA 282 CO 0.61 0.17 -0.45 0.66 0.00 0.00 0.00 179.25 180.23 2w3r h SER 283 N 0.00 0.00 0.00 0.00 4.64 -2.03 -3.48 113.55 112.68 2w3r h SER 283 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2w3r h SER 283 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2w3r h SER 283 CO 0.02 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 2w3r n GLY 284 N 1.22 1.13 3.77 -0.77 0.00 -0.91 -5.09 105.19 104.53 2w3r n GLY 284 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.46 3.82 0.27 1.61 -0.14 -1.26 -4.46 119.74 119.11 2w3r s LYS 285 Ca 0.00 2.23 -0.29 0.00 -1.36 0.00 0.00 55.97 56.55 2w3r s LYS 285 Cb 0.00 -2.68 -0.09 0.00 -1.68 0.00 0.00 37.83 33.38 2w3r s LYS 285 CO 0.00 -0.64 1.13 -0.51 -0.76 0.00 0.00 175.35 174.56 2w3r s LEU 286 N -2.61 4.53 -0.18 3.17 1.43 -1.26 0.18 118.68 123.93 2w3r s LEU 286 Ca 0.59 2.29 0.01 0.00 -1.03 0.00 0.00 54.13 56.00 2w3r s LEU 286 Cb -0.40 -3.63 -0.12 0.00 0.03 0.00 0.00 46.19 42.08 2w3r s LEU 286 CO 0.51 -0.20 -0.16 0.18 0.23 0.00 0.00 176.35 176.91 2w3r n LEU 287 N 1.37 2.99 -3.62 1.79 4.77 -0.92 -4.50 117.00 118.88 2w3r n LEU 287 Ca -0.00 -0.09 -0.07 0.00 -0.03 0.00 0.00 56.01 55.81 2w3r n LEU 287 Cb 0.45 -0.62 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 2w3r n LEU 287 CO 0.55 0.80 0.91 -0.83 -1.33 0.00 0.00 177.39 177.49 2w3r s GLY 288 N -5.71 -0.06 -0.06 -0.72 0.00 -1.24 -2.90 107.32 96.62 2w3r s GLY 288 Ca -0.24 2.61 -0.00 0.00 0.00 0.00 0.00 44.72 47.09 2w3r s GLY 288 CO 0.41 1.39 -0.03 0.00 0.00 0.00 0.00 173.10 174.87 2w3r s ALA 289 N -0.58 0.74 -0.19 3.20 0.00 0.87 -0.77 121.76 125.03 2w3r s ALA 289 Ca 0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 2w3r s ALA 289 Cb -0.02 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 2w3r s ALA 289 CO -0.05 -0.26 -0.03 0.34 0.00 0.00 0.00 175.76 175.76 2w3r s ASP 290 N 1.48 4.64 0.04 0.00 2.15 0.56 -1.94 116.67 123.60 2w3r s ASP 290 Ca -0.02 -0.23 0.08 0.00 0.43 0.00 0.00 52.55 52.81 2w3r s ASP 290 Cb -0.13 -1.78 -0.03 0.00 -0.30 0.00 0.00 42.92 40.69 2w3r s ASP 290 CO -0.03 0.08 -0.24 -0.36 -0.17 0.00 0.00 175.17 174.45 2w3r s PHE 291 N 0.88 2.11 -0.20 -5.34 0.40 0.09 -0.82 117.98 115.10 2w3r s PHE 291 Ca -0.00 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 2w3r s PHE 291 Cb -0.14 -1.27 0.04 0.00 0.51 0.00 0.00 43.02 42.16 2w3r s PHE 291 CO 0.02 0.09 -0.09 0.08 0.70 0.00 0.00 175.22 176.02 2w3r s VAL 292 N -0.77 1.53 -0.27 -0.44 1.01 0.37 -1.40 120.40 120.43 2w3r s VAL 292 Ca 0.10 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2w3r s VAL 292 Cb -0.09 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 2w3r s VAL 292 CO 0.02 0.12 0.18 -1.00 0.00 0.00 0.00 175.10 174.42 2w3r s HIS 293 N 1.44 3.23 -0.31 5.22 3.76 0.38 -1.72 115.29 127.28 2w3r s HIS 293 Ca -0.02 0.10 -0.03 0.00 -0.15 0.00 0.00 55.06 54.96 2w3r s HIS 293 Cb -0.16 -2.35 0.05 0.00 1.11 0.00 0.00 32.58 31.22 2w3r s HIS 293 CO -0.08 -0.14 0.03 -0.51 -0.85 0.00 0.00 174.74 173.20 2w3r s LEU 294 N 1.63 4.03 -0.11 0.89 1.43 -0.64 0.11 118.68 126.01 2w3r s LEU 294 Ca 0.07 -1.25 -0.03 0.00 -1.03 0.00 0.00 54.13 51.89 2w3r s LEU 294 Cb -0.16 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2w3r s LEU 294 CO 0.09 -0.28 0.01 0.00 0.23 0.00 0.00 176.35 176.40 2w3r s ALA 295 N 1.29 3.26 -0.46 4.21 0.00 0.15 -1.18 121.76 129.03 2w3r s ALA 295 Ca -0.04 -0.80 -0.26 0.00 0.00 0.00 0.00 51.96 50.87 2w3r s ALA 295 Cb -0.20 -1.57 0.03 0.00 0.00 0.00 0.00 23.12 21.38 2w3r s ALA 295 CO -0.00 0.46 0.94 0.50 0.00 0.00 0.00 175.76 177.66 2w3r s ARG 296 N -0.47 3.54 -0.06 0.00 3.52 -0.62 -1.71 118.95 123.16 2w3r s ARG 296 Ca 0.08 0.17 0.18 0.00 -0.13 0.00 0.00 55.73 56.04 2w3r s ARG 296 Cb -0.12 -3.93 -0.23 0.00 -1.56 0.00 0.00 34.95 29.11 2w3r s ARG 296 CO 0.02 -1.24 0.46 0.00 -0.81 0.00 0.00 175.30 173.73 2w3r n GLY 298 N 1.50 -1.77 0.22 0.00 0.00 -1.25 -0.82 105.19 103.07 2w3r n GLY 298 Ca -0.17 -1.92 0.11 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 -4.02 1.61 5.08 -0.81 -2.80 115.95 115.01 2w3r h TRP 299 Ca 0.00 0.00 -0.48 0.00 1.08 0.00 0.00 58.89 59.49 2w3r h TRP 299 Cb 0.00 0.00 -0.23 0.00 -3.00 0.00 0.00 29.16 25.93 2w3r h TRP 299 CO 0.00 0.14 -0.80 0.45 -1.28 0.00 0.00 178.44 176.95 2w3r s SER 300 N -6.15 1.97 0.10 0.11 0.15 -1.26 -4.95 113.70 103.67 2w3r s SER 300 Ca 0.04 -0.55 -0.34 0.00 0.70 0.00 0.00 55.95 55.80 2w3r s SER 300 Cb 0.07 -0.11 -0.14 0.00 -1.71 0.00 0.00 66.02 64.13 2w3r s SER 300 CO 0.65 0.03 1.57 0.00 1.20 0.00 0.00 173.24 176.69 2w3r h ALA 301 N 4.60 -0.94 -0.71 5.45 0.00 -1.89 -3.43 119.26 122.33 2w3r h ALA 301 Ca -0.41 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2w3r h ALA 301 Cb 1.18 0.79 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2w3r h ALA 301 CO 0.42 -1.09 0.00 -3.47 0.00 0.00 0.00 179.25 175.11 2w3r n ASP 302 N -5.50 0.00 -0.30 0.00 -0.08 -1.26 -1.74 116.55 107.67 2w3r n ASP 302 Ca -0.09 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.28 2w3r n ASP 302 Cb 0.41 0.00 0.17 0.00 2.34 0.00 0.00 41.12 44.05 2w3r n ASP 302 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2w3r n LEU 303 N 0.00 2.74 -0.14 -2.67 4.77 -1.26 -3.67 117.00 116.77 2w3r n LEU 303 Ca 0.00 -3.14 -0.00 0.00 -0.03 0.00 0.00 56.01 52.84 2w3r n LEU 303 Cb 0.00 -0.47 0.25 0.00 -2.33 0.00 0.00 43.42 40.87 2w3r n LEU 303 CO 0.00 0.75 1.11 0.28 -1.33 0.00 0.00 177.39 178.21 2w3r h SER 304 N 0.47 0.76 0.87 -1.43 0.02 -1.57 -0.70 113.55 111.96 2w3r h SER 304 Ca 0.01 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 2w3r h SER 304 Cb 1.11 -0.19 0.01 0.00 0.14 0.00 0.00 62.40 63.47 2w3r h SER 304 CO 0.06 0.64 -0.43 0.25 -1.14 0.00 0.00 176.83 176.20 2w3r h LEU 305 N 0.85 -1.03 -1.61 5.07 6.46 -1.86 -0.86 115.31 122.33 2w3r h LEU 305 Ca 0.21 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.98 2w3r h LEU 305 Cb 0.07 0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.26 2w3r h LEU 305 CO -0.03 -0.72 -0.05 1.55 -0.62 0.00 0.00 178.44 178.57 2w3r h PRO 306 N -1.19 0.19 0.04 5.25 0.13 -1.91 -2.19 132.00 132.32 2w3r h PRO 306 Ca -0.12 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2w3r h PRO 306 Cb 0.91 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2w3r h PRO 306 CO 0.19 0.25 -0.02 0.28 -0.23 0.00 0.00 178.00 178.47 2w3r h VAL 307 N 0.18 0.95 0.00 1.56 2.07 -0.92 -2.35 116.25 117.74 2w3r h VAL 307 Ca 0.04 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.43 2w3r h VAL 307 Cb 0.21 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2w3r h VAL 307 CO 0.01 0.00 -0.62 0.00 0.02 0.00 0.00 177.57 176.98 2w3r h ASP 309 N 0.00 -0.26 0.36 0.00 5.19 -1.32 -1.82 116.42 118.57 2w3r h ASP 309 Ca -0.01 0.09 -0.06 0.00 -0.62 0.00 0.00 57.03 56.43 2w3r h ASP 309 Cb 1.12 0.18 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 2w3r h ASP 309 CO 0.08 -0.09 -0.31 -0.09 -3.12 0.00 0.00 179.24 175.71 2w3r h ARG 310 N 0.02 0.00 -0.55 3.56 2.43 -0.83 -0.30 114.38 118.70 2w3r h ARG 310 Ca 0.15 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.24 2w3r h ARG 310 Cb 0.22 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2w3r h ARG 310 CO -0.31 0.31 0.03 0.00 -1.51 0.00 0.00 179.97 178.49 2w3r h ALA 311 N 1.69 0.74 -0.29 2.80 0.00 -1.01 -2.65 119.26 120.54 2w3r h ALA 311 Ca -0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 2w3r h ALA 311 Cb 0.57 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2w3r h ALA 311 CO 0.04 0.54 -0.04 0.52 0.00 0.00 0.00 179.25 180.31 2w3r h MET 312 N 0.84 0.54 -0.72 0.00 2.86 -0.77 -2.54 114.93 115.14 2w3r h MET 312 Ca 0.16 -0.19 0.15 0.00 -2.06 0.00 0.00 59.70 57.75 2w3r h MET 312 Cb 0.50 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.08 2w3r h MET 312 CO 0.02 0.72 0.49 -0.07 1.06 0.00 0.00 176.91 179.13 2w3r h LEU 313 N 0.31 0.35 -2.53 1.22 4.07 -1.01 -1.90 115.31 115.82 2w3r h LEU 313 Ca 0.08 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.06 2w3r h LEU 313 Cb 0.50 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.19 2w3r h LEU 313 CO 0.02 0.18 0.00 1.41 -1.08 0.00 0.00 178.44 178.98 2w3r n HIS 314 N -4.47 0.56 0.54 1.13 8.25 -1.01 -4.40 115.22 115.84 2w3r n HIS 314 Ca 0.14 -0.37 0.07 0.00 -0.26 0.00 0.00 57.72 57.30 2w3r n HIS 314 Cb 0.53 -0.01 0.33 0.00 1.12 0.00 0.00 29.99 31.96 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 1.12 1.71 0.33 -1.41 0.00 -0.72 -1.42 120.51 120.13 2w3r n ALA 315 Ca 0.17 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.68 2w3r n ALA 315 Cb 0.52 -1.25 0.21 0.00 0.00 0.00 0.00 19.45 18.93 2w3r n ALA 315 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2w3r h ASP 316 N 0.00 0.00 0.00 0.00 2.03 -1.77 -3.40 116.42 113.27 2w3r h ASP 316 Ca 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 2w3r h ASP 316 Cb 0.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.75 2w3r h ASP 316 CO 0.00 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.83 2w3r n GLY 317 N 1.17 3.28 1.32 7.15 0.00 -0.51 -2.43 105.19 115.18 2w3r n GLY 317 Ca 0.04 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.89 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 2.88 3.87 -4.24 1.61 7.64 -1.26 -4.72 113.62 119.40 2w3r n SER 318 Ca 0.00 -2.35 -0.28 0.00 1.01 0.00 0.00 58.87 57.25 2w3r n SER 318 Cb 0.00 -0.51 -0.16 0.00 -1.01 0.00 0.00 64.21 62.53 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 -1.77 1.97 -0.06 1.43 1.51 -1.02 -3.29 117.35 116.12 2w3r s TYR 319 Ca 0.41 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.78 2w3r s TYR 319 Cb 0.26 -1.27 -0.03 0.00 -0.11 0.00 0.00 41.96 40.82 2w3r s TYR 319 CO 0.20 -0.05 1.08 0.12 -1.11 0.00 0.00 175.55 175.79 2w3r s PHE 320 N -0.47 3.43 -0.16 2.71 5.36 -0.98 -4.87 117.98 123.00 2w3r s PHE 320 Ca 0.07 1.46 -0.01 0.00 -0.96 0.00 0.00 56.93 57.50 2w3r s PHE 320 Cb -0.09 -3.27 0.04 0.00 -0.34 0.00 0.00 43.02 39.36 2w3r s PHE 320 CO -0.00 -0.64 -0.04 0.08 -1.46 0.00 0.00 175.22 173.16 2w3r s VAL 321 N 1.82 1.00 0.42 3.12 1.01 -1.26 -4.72 120.40 121.79 2w3r s VAL 321 Ca 0.52 -0.57 0.12 0.00 0.00 0.00 0.00 61.98 62.05 2w3r s VAL 321 Cb -0.22 -1.21 0.18 0.00 0.00 0.00 0.00 36.38 35.13 2w3r s VAL 321 CO 0.22 0.10 1.97 -0.65 0.00 0.00 0.00 175.10 176.74 2w3r h PRO 322 N 8.15 0.13 -4.15 2.72 0.11 -1.79 -3.40 132.00 133.76 2w3r h PRO 322 Ca -0.23 -0.03 -0.50 0.00 0.11 0.00 0.00 66.00 65.36 2w3r h PRO 322 Cb 1.11 -0.02 -0.36 0.00 0.11 0.00 0.00 31.00 31.84 2w3r h PRO 322 CO 0.38 0.27 -0.79 0.00 -0.21 0.00 0.00 178.00 177.65 2w3r s ALA 323 N -4.73 1.14 -0.17 -0.75 0.00 -1.14 -4.38 121.76 111.72 2w3r s ALA 323 Ca -0.05 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 51.44 2w3r s ALA 323 Cb 0.16 -0.79 0.07 0.00 0.00 0.00 0.00 23.12 22.56 2w3r s ALA 323 CO 0.71 -0.31 0.37 -1.17 0.00 0.00 0.00 175.76 175.36 2w3r s LEU 324 N 1.54 -0.25 0.01 0.00 0.20 -0.32 -0.09 118.68 119.77 2w3r s LEU 324 Ca 0.01 0.84 0.07 0.00 0.69 0.00 0.00 54.13 55.73 2w3r s LEU 324 Cb -0.13 1.18 -0.02 0.00 -0.43 0.00 0.00 46.19 46.79 2w3r s LEU 324 CO -0.05 -0.21 -0.22 -0.60 -0.29 0.00 0.00 176.35 174.98 2w3r s ARG 325 N 1.95 1.62 -0.05 1.98 3.52 -0.82 -0.15 118.95 127.00 2w3r s ARG 325 Ca -0.05 -0.85 0.02 0.00 -0.13 0.00 0.00 55.73 54.72 2w3r s ARG 325 Cb -0.10 -1.64 0.01 0.00 -1.56 0.00 0.00 34.95 31.66 2w3r s ARG 325 CO -0.12 0.44 -0.10 0.42 -0.81 0.00 0.00 175.30 175.13 2w3r s ILE 326 N -0.62 0.96 -0.31 4.11 1.01 0.91 -0.73 121.20 126.53 2w3r s ILE 326 Ca 0.08 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.35 2w3r s ILE 326 Cb -0.09 -0.89 0.07 0.00 0.01 0.00 0.00 42.46 41.57 2w3r s ILE 326 CO 0.00 0.31 0.00 -0.70 0.00 0.00 0.00 174.94 174.56 2w3r s GLU 327 N 0.62 2.12 -0.26 2.79 2.12 -0.49 -0.94 118.70 124.65 2w3r s GLU 327 Ca -0.12 -1.49 -0.09 0.00 0.36 0.00 0.00 54.97 53.63 2w3r s GLU 327 Cb -0.14 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.05 2w3r s GLU 327 CO 0.02 -0.73 0.13 0.45 -0.54 0.00 0.00 175.26 174.60 2w3r s SER 328 N 1.22 5.60 -0.33 -1.70 0.15 0.65 -0.47 113.70 118.82 2w3r s SER 328 Ca -0.01 -0.10 -0.09 0.00 0.70 0.00 0.00 55.95 56.45 2w3r s SER 328 Cb -0.20 -2.03 0.01 0.00 -1.71 0.00 0.00 66.02 62.10 2w3r s SER 328 CO -0.04 -0.04 0.14 -1.00 1.20 0.00 0.00 173.24 173.50 2w3r s HIS 329 N 1.68 3.20 -0.94 3.44 3.76 0.30 -1.09 115.29 125.63 2w3r s HIS 329 Ca 0.07 -0.89 -0.14 0.00 -0.15 0.00 0.00 55.06 53.94 2w3r s HIS 329 Cb -0.16 -2.34 0.20 0.00 1.11 0.00 0.00 32.58 31.39 2w3r s HIS 329 CO 0.07 -0.57 0.99 -0.98 -0.85 0.00 0.00 174.74 173.40 2w3r s ARG 330 N 1.54 3.75 0.06 1.40 3.03 -1.26 -0.67 118.95 126.80 2w3r s ARG 330 Ca 0.03 -2.41 -0.24 0.00 2.03 0.00 0.00 55.73 55.14 2w3r s ARG 330 Cb -0.18 -4.64 -0.06 0.00 -1.03 0.00 0.00 34.95 29.04 2w3r s ARG 330 CO 0.05 -1.46 0.72 -0.51 -1.13 0.00 0.00 175.30 172.96 2w3r s LEU 331 N 0.75 4.48 -0.08 -1.89 1.43 -0.69 -0.73 118.68 121.95 2w3r s LEU 331 Ca 0.26 1.41 -0.20 0.00 -1.03 0.00 0.00 54.13 54.57 2w3r s LEU 331 Cb -0.08 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 2w3r s LEU 331 CO -0.08 0.10 0.57 -0.60 0.23 0.00 0.00 176.35 176.56 2w3r s ARG 332 N -0.40 4.36 0.02 1.70 3.52 0.59 -1.39 118.95 127.34 2w3r s ARG 332 Ca 0.36 0.64 0.01 0.00 -0.13 0.00 0.00 55.73 56.60 2w3r s ARG 332 Cb -0.20 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.75 2w3r s ARG 332 CO 0.22 0.17 -0.04 0.95 -0.81 0.00 0.00 175.30 175.79 2w3r s THR 333 N 0.52 0.27 0.00 4.11 -4.23 -1.06 -4.61 115.64 110.65 2w3r s THR 333 Ca 0.31 -0.72 -0.03 0.00 -1.18 0.00 0.00 61.69 60.07 2w3r s THR 333 Cb -0.16 -0.34 -0.15 0.00 1.34 0.00 0.00 72.50 73.18 2w3r s THR 333 CO 0.14 -0.29 2.43 0.59 -0.54 0.00 0.00 174.62 176.95 2w3r n ASN 334 N 1.99 3.73 -3.41 3.99 4.13 0.10 -1.53 115.26 124.26 2w3r n ASN 334 Ca -0.20 -2.15 -0.19 0.00 1.68 0.00 0.00 54.58 53.72 2w3r n ASN 334 Cb 0.56 -0.96 -0.04 0.00 -1.54 0.00 0.00 39.78 37.80 2w3r n ASN 334 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2w3r n THR 335 N 2.43 0.00 -1.66 3.41 -2.24 -1.26 -4.38 114.28 110.58 2w3r n THR 335 Ca 0.24 -1.55 -0.44 0.00 -2.27 0.00 0.00 64.05 60.02 2w3r n THR 335 Cb 0.59 0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 2w3r n THR 335 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w3r n GLN 336 N -0.72 1.93 -1.98 -0.78 3.00 -1.26 -2.24 117.38 115.33 2w3r n GLN 336 Ca -0.09 0.68 -0.39 0.00 -0.01 0.00 0.00 57.00 57.20 2w3r n GLN 336 Cb 0.41 -2.28 -0.03 0.00 0.00 0.00 0.00 30.24 28.34 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 5.22 0.48 1.08 0.15 -1.26 -4.14 113.70 115.27 2w3r s SER 337 Ca 0.64 0.51 -0.24 0.00 0.70 0.00 0.00 55.95 57.56 2w3r s SER 337 Cb -0.65 -2.53 -0.07 0.00 -1.71 0.00 0.00 66.02 61.07 2w3r s SER 337 CO 0.54 -2.38 1.38 0.20 1.20 0.00 0.00 173.24 174.18 2w3r s ASN 338 N 8.43 5.69 0.00 5.45 0.01 0.00 -3.96 114.94 130.56 2w3r s ASN 338 Ca 0.72 2.82 0.00 0.00 -0.71 0.00 0.00 52.86 55.69 2w3r s ASN 338 Cb -0.14 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.88 2w3r s ASN 338 CO 0.22 -1.29 0.00 1.07 -1.51 0.00 0.00 177.10 175.59 2w3r n THR 339 N -0.49 0.00 -2.12 1.60 5.66 -0.29 -4.46 114.28 114.19 2w3r n THR 339 Ca 0.07 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.70 2w3r n THR 339 Cb 0.43 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.22 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 2.89 -0.30 1.79 0.00 -1.26 -4.44 121.76 118.44 2w3r s ALA 340 Ca 0.00 1.03 -0.07 0.00 0.00 0.00 0.00 51.96 52.92 2w3r s ALA 340 Cb 0.00 -3.43 0.15 0.00 0.00 0.00 0.00 23.12 19.84 2w3r s ALA 340 CO 0.00 -0.88 0.64 0.12 0.00 0.00 0.00 175.76 175.64 2w3r s PHE 341 N -1.50 -1.42 0.00 0.00 5.99 -1.26 -3.88 117.98 115.90 2w3r s PHE 341 Ca 0.67 2.09 0.00 0.00 0.00 0.00 0.00 56.93 59.69 2w3r s PHE 341 Cb -0.31 0.71 0.00 0.00 0.00 0.00 0.00 43.02 43.42 2w3r s PHE 341 CO 0.37 -0.74 0.00 -2.13 -0.00 0.00 0.00 175.22 172.73 2w3r n ARG 342 N 5.43 0.00 0.00 10.12 0.63 0.33 -0.16 116.66 133.02 2w3r n ARG 342 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2w3r n ARG 342 Cb 0.50 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.41 2w3r n ARG 342 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w3r n GLY 343 N 0.00 3.08 3.40 5.14 0.00 -1.26 -4.94 105.19 110.61 2w3r n GLY 343 Ca 0.00 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.36 0.00 1.61 7.35 0.78 -1.44 117.46 123.40 2w3r n PHE 344 Ca 0.00 0.78 0.00 0.00 -0.76 0.00 0.00 57.45 57.47 2w3r n PHE 344 Cb 0.00 -3.77 0.00 0.00 0.35 0.00 0.00 39.48 36.06 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 -1.55 2.02 0.37 7.13 0.00 -1.26 -4.50 105.19 107.40 2w3r n GLY 345 Ca -0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.39 1.01 -0.02 0.00 -1.40 -2.73 103.07 99.54 2w3r h GLY 346 Ca 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.81 2w3r h GLY 346 CO 0.00 -0.20 0.50 -2.55 0.00 0.00 0.00 176.54 174.30 2w3r h PRO 347 N -0.28 1.10 -0.18 4.80 0.11 -1.89 -1.32 132.00 134.35 2w3r h PRO 347 Ca 0.16 -0.09 0.05 0.00 0.11 0.00 0.00 66.00 66.23 2w3r h PRO 347 Cb 0.56 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 31.39 2w3r h PRO 347 CO -0.57 0.77 -0.15 1.96 -0.21 0.00 0.00 178.00 179.79 2w3r h GLN 348 N 1.12 -0.16 -0.70 1.05 7.50 -1.91 0.32 115.11 122.32 2w3r h GLN 348 Ca 0.29 0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.44 2w3r h GLN 348 Cb -0.06 0.04 -0.03 0.00 0.05 0.00 0.00 27.48 27.48 2w3r h GLN 348 CO -0.06 -0.11 0.36 0.78 -1.50 0.00 0.00 178.83 178.31 2w3r h GLY 349 N -0.17 1.05 1.09 3.46 0.00 -1.16 -1.62 103.07 105.73 2w3r h GLY 349 Ca 0.11 -0.48 -0.19 0.00 0.00 0.00 0.00 47.33 46.77 2w3r h GLY 349 CO -0.28 0.46 -0.61 0.00 0.00 0.00 0.00 176.54 176.11 2w3r h ALA 350 N 1.41 0.34 -0.58 3.60 0.00 -0.78 -3.10 119.26 120.16 2w3r h ALA 350 Ca 0.25 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2w3r h ALA 350 Cb 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2w3r h ALA 350 CO -0.04 0.60 0.30 1.25 0.00 0.00 0.00 179.25 181.37 2w3r h LEU 351 N 0.49 0.72 -0.35 0.00 5.85 -0.18 -1.55 115.31 120.29 2w3r h LEU 351 Ca -0.02 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.72 2w3r h LEU 351 Cb 1.24 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 42.01 2w3r h LEU 351 CO 0.13 0.59 -0.14 1.23 -0.34 0.00 0.00 178.44 179.91 2w3r h GLY 352 N 0.88 0.16 1.44 3.75 0.00 -1.22 -0.52 103.07 107.56 2w3r h GLY 352 Ca 0.21 0.17 -0.10 0.00 0.00 0.00 0.00 47.33 47.61 2w3r h GLY 352 CO -0.03 -0.16 -0.22 1.98 0.00 0.00 0.00 176.54 178.11 2w3r h MET 353 N -0.07 0.65 -0.30 4.80 1.85 -1.35 -2.70 114.93 117.81 2w3r h MET 353 Ca 0.17 -0.25 -0.13 0.00 -0.61 0.00 0.00 59.70 58.89 2w3r h MET 353 Cb 0.33 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.31 2w3r h MET 353 CO -0.40 0.82 -0.34 0.93 -0.40 0.00 0.00 176.91 177.53 2w3r h GLU 354 N 0.58 0.65 -0.41 0.39 4.39 -0.87 -1.34 114.58 117.97 2w3r h GLU 354 Ca 0.09 -0.30 -0.14 0.00 0.34 0.00 0.00 59.36 59.34 2w3r h GLU 354 Cb 0.68 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2w3r h GLU 354 CO 0.05 0.90 -0.30 -0.09 -1.16 0.00 0.00 179.01 178.41 2w3r h ARG 355 N 0.55 0.92 -0.10 2.33 1.12 -1.04 -1.65 114.38 116.52 2w3r h ARG 355 Ca 0.06 -0.45 -0.01 0.00 -1.11 0.00 0.00 59.98 58.47 2w3r h ARG 355 Cb 0.84 -0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.79 2w3r h ARG 355 CO 0.07 1.10 0.01 0.00 -3.11 0.00 0.00 179.97 178.04 2w3r h ALA 356 N 0.80 0.13 -0.06 2.80 0.00 -1.38 -0.60 119.26 120.95 2w3r h ALA 356 Ca 0.08 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2w3r h ALA 356 Cb 0.88 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2w3r h ALA 356 CO 0.08 -0.20 -0.26 0.97 0.00 0.00 0.00 179.25 179.84 2w3r h ILE 357 N -0.09 1.21 -0.21 0.00 2.10 -1.27 0.15 117.51 119.40 2w3r h ILE 357 Ca 0.03 -1.00 -0.05 0.00 1.08 0.00 0.00 64.86 64.92 2w3r h ILE 357 Cb 0.33 1.46 -0.01 0.00 -1.09 0.00 0.00 36.82 37.51 2w3r h ILE 357 CO 0.00 0.29 -0.05 -0.08 -1.08 0.00 0.00 178.15 177.24 2w3r h GLU 358 N 0.09 0.41 -0.61 2.19 4.57 -1.17 -0.02 114.58 120.04 2w3r h GLU 358 Ca 0.01 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 2w3r h GLU 358 Cb 0.51 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 2w3r h GLU 358 CO 0.04 0.65 0.38 1.25 -1.18 0.00 0.00 179.01 180.15 2w3r h HIS 359 N 0.14 0.80 -0.75 0.92 2.76 -0.54 -0.24 115.15 118.23 2w3r h HIS 359 Ca 0.05 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.21 2w3r h HIS 359 Cb 0.50 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.16 2w3r h HIS 359 CO 0.05 0.53 0.39 1.25 -1.30 0.00 0.00 177.93 178.85 2w3r h LEU 360 N 0.83 0.96 -0.24 0.26 5.85 -0.66 -0.04 115.31 122.26 2w3r h LEU 360 Ca 0.22 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2w3r h LEU 360 Cb -0.04 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 2w3r h LEU 360 CO -0.04 0.80 0.05 0.00 -0.34 0.00 0.00 178.44 178.91 2w3r h ALA 361 N 1.20 0.32 0.00 1.25 0.00 -0.56 -2.88 119.26 118.59 2w3r h ALA 361 Ca 0.26 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2w3r h ALA 361 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2w3r h ALA 361 CO -0.04 -0.02 -0.29 0.00 0.00 0.00 0.00 179.25 178.91 2w3r h ARG 362 N 0.22 0.00 -0.36 0.00 2.47 -0.89 -1.73 114.38 114.09 2w3r h ARG 362 Ca 0.08 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.67 2w3r h ARG 362 Cb 0.29 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 2w3r h ARG 362 CO 0.00 0.29 -0.30 0.78 0.56 0.00 0.00 179.97 181.30 2w3r h GLY 363 N 1.19 0.83 -2.55 0.04 0.00 -0.86 -3.26 103.07 98.47 2w3r h GLY 363 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2w3r h GLY 363 CO 0.04 0.69 0.00 1.15 0.00 0.00 0.00 176.54 178.42 2w3r n MET 364 N -4.08 3.74 -3.13 4.80 0.00 -1.10 -4.96 117.12 112.39 2w3r n MET 364 Ca -0.01 -2.87 -0.23 0.00 0.00 0.00 0.00 57.70 54.59 2w3r n MET 364 Cb 0.48 -1.93 0.04 0.00 0.00 0.00 0.00 33.22 31.81 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 0.39 -0.53 3.34 3.17 0.00 -1.05 -4.99 105.19 105.52 2w3r n GLY 365 Ca 0.24 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 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 -5.82 2.18 -0.01 1.61 3.52 -0.68 -5.05 118.95 114.70 2w3r s ARG 366 Ca 0.36 -0.89 -0.33 0.00 -0.13 0.00 0.00 55.73 54.74 2w3r s ARG 366 Cb -0.16 -2.10 -0.12 0.00 -1.56 0.00 0.00 34.95 31.01 2w3r s ARG 366 CO 0.44 0.57 1.84 -3.47 -0.81 0.00 0.00 175.30 173.87 2w3r n ASP 367 N 2.42 3.54 -0.35 -2.12 2.03 -1.26 -4.40 116.55 116.41 2w3r n ASP 367 Ca -0.16 0.98 0.02 0.00 0.52 0.00 0.00 54.79 56.15 2w3r n ASP 367 Cb 0.51 -1.42 0.16 0.00 -0.72 0.00 0.00 41.12 39.66 2w3r n ASP 367 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2w3r h PRO 368 N 8.75 1.05 -0.87 -0.67 0.11 -1.95 -1.98 132.00 136.43 2w3r h PRO 368 Ca -0.48 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 2w3r h PRO 368 Cb 1.26 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2w3r h PRO 368 CO 0.94 0.70 0.48 0.00 -0.21 0.00 0.00 178.00 179.91 2w3r h ALA 369 N 1.44 1.12 -0.34 -0.75 0.00 -1.90 -1.71 119.26 117.12 2w3r h ALA 369 Ca 0.41 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2w3r h ALA 369 Cb 0.18 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2w3r h ALA 369 CO -0.18 0.63 -0.31 1.49 0.00 0.00 0.00 179.25 180.88 2w3r h GLU 370 N 1.22 0.74 -0.10 0.00 4.22 -1.76 -1.23 114.58 117.65 2w3r h GLU 370 Ca 0.31 -0.33 -0.14 0.00 0.08 0.00 0.00 59.36 59.28 2w3r h GLU 370 Cb 0.02 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2w3r h GLU 370 CO -0.05 0.95 -0.54 1.25 -2.18 0.00 0.00 179.01 178.44 2w3r h LEU 371 N 0.63 0.33 0.04 1.64 5.85 -1.14 -2.19 115.31 120.46 2w3r h LEU 371 Ca 0.07 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 2w3r h LEU 371 Cb 0.83 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2w3r h LEU 371 CO 0.07 0.80 -0.02 0.03 -0.34 0.00 0.00 178.44 178.99 2w3r h ARG 372 N 0.23 -0.05 -0.73 1.25 3.08 -1.20 -2.97 114.38 114.00 2w3r h ARG 372 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.20 2w3r h ARG 372 Cb 1.02 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.03 2w3r h ARG 372 CO 0.09 0.42 0.49 0.00 -1.07 0.00 0.00 179.97 179.90 2w3r h ALA 373 N 0.37 2.09 0.00 0.04 0.00 -1.23 0.11 119.26 120.64 2w3r h ALA 373 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2w3r h ALA 373 Cb 0.50 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2w3r h ALA 373 CO 0.01 -0.28 -0.14 1.25 0.00 0.00 0.00 179.25 180.10 2w3r h LEU 374 N 0.42 0.00 -3.02 0.00 5.85 -1.38 -3.30 115.31 113.88 2w3r h LEU 374 Ca 0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2w3r h LEU 374 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.81 2w3r h LEU 374 CO -0.11 0.14 0.00 0.59 -0.34 0.00 0.00 178.44 178.71 2w3r n ASN 375 N -3.25 2.60 -4.78 1.25 3.02 0.33 -4.92 115.26 109.51 2w3r n ASN 375 Ca 0.01 -2.49 -0.34 0.00 -0.03 0.00 0.00 54.58 51.73 2w3r n ASN 375 Cb 0.41 -0.26 0.03 0.00 -0.61 0.00 0.00 39.78 39.35 2w3r n ASN 375 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2w3r s PHE 376 N -1.85 2.68 0.71 3.10 2.99 -0.78 -2.32 117.98 122.51 2w3r s PHE 376 Ca 0.21 1.55 -0.16 0.00 0.00 0.00 0.00 56.93 58.52 2w3r s PHE 376 Cb 0.16 -3.19 0.02 0.00 0.00 0.00 0.00 43.02 40.01 2w3r s PHE 376 CO 0.05 -1.58 1.20 0.66 -0.00 0.00 0.00 175.22 175.55 2w3r n TYR 377 N -1.99 1.47 -1.31 0.36 4.02 -1.21 -4.59 117.16 113.91 2w3r n TYR 377 Ca 0.11 0.41 -0.31 0.00 -0.01 0.00 0.00 57.90 58.09 2w3r n TYR 377 Cb 0.52 -2.18 0.09 0.00 -0.02 0.00 0.00 39.34 37.74 2w3r n TYR 377 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2w3r s ASP 378 N -1.63 4.46 0.88 7.72 1.01 -1.26 -4.80 116.67 123.05 2w3r s ASP 378 Ca 0.78 1.91 -0.11 0.00 0.71 0.00 0.00 52.55 55.84 2w3r s ASP 378 Cb -0.35 -2.53 0.12 0.00 1.01 0.00 0.00 42.92 41.17 2w3r s ASP 378 CO 0.45 -2.07 1.09 -2.84 0.21 0.00 0.00 175.17 172.02 2w3r s PRO 379 N -4.69 1.34 0.52 8.23 0.02 -1.26 -4.37 135.00 134.79 2w3r s PRO 379 Ca 0.63 1.02 -0.23 0.00 0.02 0.00 0.00 61.00 62.44 2w3r s PRO 379 Cb -0.19 -1.80 -0.06 0.00 0.02 0.00 0.00 34.50 32.47 2w3r s PRO 379 CO 0.53 -2.24 1.38 -2.14 -0.33 0.00 0.00 177.00 174.20 2w3r s PRO 380 N -4.85 3.27 0.07 5.54 0.02 -1.26 -4.94 135.00 132.85 2w3r s PRO 380 Ca 0.64 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.95 2w3r s PRO 380 Cb -0.19 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 31.97 2w3r s PRO 380 CO 0.57 -1.10 0.00 0.39 -0.33 0.00 0.00 177.00 176.53 2w3r n GLU 381 N -0.82 -1.71 -0.81 5.54 4.71 -1.26 -5.12 120.64 121.17 2w3r n GLU 381 Ca 0.09 1.51 0.08 0.00 -0.01 0.00 0.00 57.16 58.83 2w3r n GLU 381 Cb 0.44 -1.31 -0.04 0.00 -1.01 0.00 0.00 31.44 29.52 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 0.49 -1.92 -2.87 3.49 3.00 -1.26 -5.68 118.16 113.40 2w3r n LYS 398 Ca 0.00 1.56 -0.38 0.00 -0.00 0.00 0.00 58.31 59.49 2w3r n LYS 398 Cb 0.00 -2.16 -0.06 0.00 0.00 0.00 0.00 35.03 32.81 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 -3.92 4.57 0.17 1.64 0.00 -1.26 -5.04 119.74 115.91 2w3r s LYS 399 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 55.97 56.91 2w3r s LYS 399 Cb 0.00 -3.00 -0.07 0.00 0.00 0.00 0.00 37.83 34.75 2w3r s LYS 399 CO 0.00 0.41 1.06 0.99 0.00 0.00 0.00 175.35 177.81 2w3r s THR 400 N -1.42 3.98 0.64 3.79 2.01 -1.26 -5.01 115.64 118.37 2w3r s THR 400 Ca 0.44 1.73 -0.17 0.00 0.31 0.00 0.00 61.69 63.99 2w3r s THR 400 Cb -0.21 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 2w3r s THR 400 CO 0.25 0.30 0.91 0.00 -0.69 0.00 0.00 174.62 175.40 2w3r n GLN 401 N 2.34 0.73 -4.29 4.92 6.02 -1.26 -4.83 117.38 121.01 2w3r n GLN 401 Ca 0.02 0.29 -0.23 0.00 -0.01 0.00 0.00 57.00 57.07 2w3r n GLN 401 Cb 0.47 -2.13 -0.07 0.00 1.02 0.00 0.00 30.24 29.52 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 -1.62 3.35 0.91 5.09 -4.23 -1.26 -2.12 115.64 115.75 2w3r s THR 402 Ca 0.75 -1.91 -0.12 0.00 -1.18 0.00 0.00 61.69 59.23 2w3r s THR 402 Cb -0.39 -2.84 0.14 0.00 1.34 0.00 0.00 72.50 70.74 2w3r s THR 402 CO 0.48 -0.35 1.11 0.42 -0.54 0.00 0.00 174.62 175.74 2w3r s THR 403 N -2.35 2.37 0.59 3.99 -4.23 0.61 -4.80 115.64 111.82 2w3r s THR 403 Ca 0.32 0.12 0.29 0.00 -1.18 0.00 0.00 61.69 61.24 2w3r s THR 403 Cb -0.06 -2.75 0.36 0.00 1.34 0.00 0.00 72.50 71.39 2w3r s THR 403 CO 0.20 -0.16 2.14 1.12 -0.54 0.00 0.00 174.62 177.38 2w3r h HIS 404 N -1.53 0.00 -0.35 3.99 2.07 -1.91 0.42 115.15 117.85 2w3r h HIS 404 Ca -0.51 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.01 2w3r h HIS 404 Cb 1.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.29 2w3r h HIS 404 CO 0.35 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 177.69 2w3r n TYR 405 N -3.85 0.62 -2.74 6.12 0.18 -1.26 -4.58 117.16 111.65 2w3r n TYR 405 Ca 0.00 -0.27 -0.05 0.00 1.88 0.00 0.00 57.90 59.46 2w3r n TYR 405 Cb 0.26 -0.07 0.02 0.00 -0.38 0.00 0.00 39.34 39.16 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 0.89 0.60 3.24 -7.48 0.00 0.15 -2.55 105.19 100.04 2w3r n GLY 406 Ca 0.13 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 -5.28 3.11 0.31 1.61 0.74 -1.24 -4.46 119.66 114.45 2w3r s GLN 407 Ca 0.13 -0.84 -0.29 0.00 0.05 0.00 0.00 55.36 54.41 2w3r s GLN 407 Cb -0.06 -2.39 -0.11 0.00 1.10 0.00 0.00 33.01 31.55 2w3r s GLN 407 CO 0.17 0.14 1.53 -1.21 -0.55 0.00 0.00 175.29 175.37 2w3r s GLU 408 N 0.45 4.15 -0.76 1.67 2.02 -1.26 -0.28 118.70 124.68 2w3r s GLU 408 Ca -0.15 2.52 -0.06 0.00 0.02 0.00 0.00 54.97 57.30 2w3r s GLU 408 Cb -0.17 -3.02 0.20 0.00 0.10 0.00 0.00 34.13 31.23 2w3r s GLU 408 CO 0.06 -0.55 0.63 0.08 0.02 0.00 0.00 175.26 175.51 2w3r s VAL 409 N -0.40 4.46 -2.02 2.63 1.01 -0.90 -4.87 120.40 120.31 2w3r s VAL 409 Ca 0.59 -3.06 0.22 0.00 0.00 0.00 0.00 61.98 59.73 2w3r s VAL 409 Cb -0.46 -3.82 0.58 0.00 0.00 0.00 0.00 36.38 32.68 2w3r s VAL 409 CO 0.52 -0.98 1.49 0.00 0.00 0.00 0.00 175.10 176.13 2w3r n ALA 410 N 3.31 2.37 -1.10 5.51 0.00 -1.26 -4.31 120.51 125.03 2w3r n ALA 410 Ca 0.13 -1.23 0.04 0.00 0.00 0.00 0.00 53.44 52.39 2w3r n ALA 410 Cb 0.40 -0.88 0.05 0.00 0.00 0.00 0.00 19.45 19.02 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 1.56 1.30 -4.68 0.00 5.75 -1.26 -4.39 116.55 114.84 2w3r n ASP 411 Ca 0.23 -2.28 -0.43 0.00 -0.01 0.00 0.00 54.79 52.30 2w3r n ASP 411 Cb 0.61 -0.22 -0.02 0.00 -1.03 0.00 0.00 41.12 40.45 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 4.87 0.87 -0.35 0.00 0.24 -1.26 -4.06 118.33 118.63 2w3r n VAL 413 Ca 0.11 -0.90 -0.00 0.00 -2.04 0.00 0.00 64.34 61.51 2w3r n VAL 413 Cb 0.46 0.53 0.13 0.00 -1.47 0.00 0.00 33.84 33.50 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 0.00 1.03 -0.06 1.34 3.38 -1.90 -1.54 115.31 117.56 2w3r h LEU 414 Ca 0.00 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2w3r h LEU 414 Cb 0.64 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 2w3r h LEU 414 CO 0.00 0.70 -0.49 1.23 0.09 0.00 0.00 178.44 179.96 2w3r h GLY 415 N 1.19 -0.96 1.75 0.83 0.00 -1.88 0.46 103.07 104.46 2w3r h GLY 415 Ca 0.38 0.61 -0.11 0.00 0.00 0.00 0.00 47.33 48.21 2w3r h GLY 415 CO -0.13 -0.23 -0.42 -2.09 0.00 0.00 0.00 176.54 173.68 2w3r h GLU 416 N -0.60 0.28 -0.06 4.80 4.81 -1.91 -2.49 114.58 119.41 2w3r h GLU 416 Ca 0.04 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.10 2w3r h GLU 416 Cb 0.68 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2w3r h GLU 416 CO -0.38 0.65 -0.10 1.25 -0.73 0.00 0.00 179.01 179.69 2w3r h LEU 417 N 0.23 0.19 -0.43 1.64 6.46 -0.93 -2.33 115.31 120.14 2w3r h LEU 417 Ca 0.02 -0.55 -0.02 0.00 -0.12 0.00 0.00 57.88 57.20 2w3r h LEU 417 Cb 0.84 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 2w3r h LEU 417 CO 0.07 0.71 0.18 0.58 -0.62 0.00 0.00 178.44 179.36 2w3r h VAL 418 N -0.32 1.20 -0.56 1.05 2.07 -0.08 -0.63 116.25 118.98 2w3r h VAL 418 Ca 0.00 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 66.96 2w3r h VAL 418 Cb 0.67 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2w3r h VAL 418 CO 0.02 0.22 0.32 0.74 0.02 0.00 0.00 177.57 178.90 2w3r h THR 419 N 0.56 1.02 -0.63 2.57 2.02 -1.52 0.44 112.91 117.37 2w3r h THR 419 Ca 0.15 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.06 2w3r h THR 419 Cb 0.18 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 2w3r h THR 419 CO -0.01 0.11 0.19 -0.09 0.37 0.00 0.00 175.52 176.09 2w3r h ARG 420 N 0.62 0.96 -0.15 6.66 2.43 -1.11 -2.94 114.38 120.84 2w3r h ARG 420 Ca 0.24 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2w3r h ARG 420 Cb 0.08 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2w3r h ARG 420 CO -0.13 0.83 -0.05 1.25 -1.51 0.00 0.00 179.97 180.36 2w3r h LEU 421 N 0.93 0.31 -0.95 3.80 5.85 -0.25 -2.61 115.31 122.39 2w3r h LEU 421 Ca 0.21 -0.39 0.03 0.00 0.84 0.00 0.00 57.88 58.57 2w3r h LEU 421 Cb 0.27 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 2w3r h LEU 421 CO -0.01 0.63 0.62 1.56 -0.34 0.00 0.00 178.44 180.90 2w3r h GLN 422 N -0.01 1.18 -0.15 1.25 4.20 -0.91 -0.51 115.11 120.17 2w3r h GLN 422 Ca 0.04 -0.07 -0.21 0.00 0.06 0.00 0.00 58.65 58.46 2w3r h GLN 422 Cb 0.50 -0.27 0.01 0.00 0.30 0.00 0.00 27.48 28.02 2w3r h GLN 422 CO 0.02 0.78 -0.76 0.87 -0.67 0.00 0.00 178.83 179.07 2w3r h LYS 423 N 1.22 0.72 0.00 1.46 1.79 -1.55 0.14 116.57 120.35 2w3r h LYS 423 Ca 0.37 -0.58 -0.08 0.00 -2.18 0.00 0.00 60.65 58.17 2w3r h LYS 423 Cb -0.04 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 2w3r h LYS 423 CO -0.11 1.19 -0.40 0.66 -1.08 0.00 0.00 179.45 179.72 2w3r h SER 424 N 0.50 0.00 0.23 0.86 4.64 -1.22 -2.89 113.55 115.67 2w3r h SER 424 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2w3r h SER 424 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2w3r h SER 424 CO 0.15 0.40 -0.16 0.00 -0.87 0.00 0.00 176.83 176.35 2w3r n ALA 425 N -2.27 2.89 -3.29 5.18 0.00 -0.22 -4.96 120.51 117.84 2w3r n ALA 425 Ca 0.00 -0.36 -0.15 0.00 0.00 0.00 0.00 53.44 52.93 2w3r n ALA 425 Cb 0.56 -1.21 0.07 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.61 -5.63 0.18 0.00 4.05 -0.98 -4.95 115.26 107.32 2w3r n ASN 426 Ca 0.14 -0.69 -0.07 0.00 0.45 0.00 0.00 54.58 54.41 2w3r n ASN 426 Cb 0.32 -5.20 -0.03 0.00 1.23 0.00 0.00 39.78 36.10 2w3r n ASN 426 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 2w3r h PHE 427 N -1.26 -0.44 -0.61 1.20 3.57 -0.98 -2.87 116.94 115.54 2w3r h PHE 427 Ca -0.61 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 60.92 2w3r h PHE 427 Cb 1.32 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 40.16 2w3r h PHE 427 CO 0.33 -0.27 0.36 1.15 -2.23 0.00 0.00 178.31 177.65 2w3r h THR 428 N -0.64 1.03 0.19 4.41 2.02 -1.94 0.16 112.91 118.15 2w3r h THR 428 Ca -0.05 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 2w3r h THR 428 Cb 0.36 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2w3r h THR 428 CO 0.08 0.13 -0.09 0.74 0.37 0.00 0.00 175.52 176.74 2w3r h THR 429 N 0.70 0.89 -1.00 3.16 2.02 -1.98 -0.64 112.91 116.06 2w3r h THR 429 Ca 0.26 -0.42 0.08 0.00 0.77 0.00 0.00 66.41 67.10 2w3r h THR 429 Cb 0.08 1.14 -0.07 0.00 -1.74 0.00 0.00 68.15 67.55 2w3r h THR 429 CO -0.13 0.10 0.65 0.03 0.37 0.00 0.00 175.52 176.53 2w3r h ARG 430 N -0.46 1.11 -0.63 6.66 3.08 -1.25 0.85 114.38 123.74 2w3r h ARG 430 Ca -0.03 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2w3r h ARG 430 Cb 0.35 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2w3r h ARG 430 CO 0.04 0.73 0.33 -0.09 -1.07 0.00 0.00 179.97 179.92 2w3r h ARG 431 N 1.14 0.89 -0.30 0.04 2.43 -0.45 -1.64 114.38 116.49 2w3r h ARG 431 Ca 0.45 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.38 2w3r h ARG 431 Cb 0.23 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2w3r h ARG 431 CO -0.19 0.69 -0.28 0.00 -1.51 0.00 0.00 179.97 178.68 2w3r h ALA 432 N 1.15 0.44 -0.89 2.80 0.00 -0.48 -3.06 119.26 119.22 2w3r h ALA 432 Ca 0.22 -0.40 0.12 0.00 0.00 0.00 0.00 54.91 54.85 2w3r h ALA 432 Cb 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 2w3r h ALA 432 CO -0.03 0.45 0.57 0.93 0.00 0.00 0.00 179.25 181.17 2w3r h GLU 433 N 0.48 0.78 -0.62 0.00 5.08 -0.65 -2.06 114.58 117.60 2w3r h GLU 433 Ca 0.05 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 2w3r h GLU 433 Cb 0.85 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2w3r h GLU 433 CO 0.07 0.52 0.17 0.82 -1.00 0.00 0.00 179.01 179.59 2w3r h ILE 434 N 0.81 1.25 -0.28 3.13 2.04 -1.21 -0.47 117.51 122.77 2w3r h ILE 434 Ca 0.43 -0.87 0.01 0.00 1.00 0.00 0.00 64.86 65.42 2w3r h ILE 434 Cb 0.53 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2w3r h ILE 434 CO -0.19 0.33 0.18 0.00 0.00 0.00 0.00 178.15 178.47 2w3r h ALA 435 N 1.06 0.35 -0.02 1.87 0.00 -1.30 0.16 119.26 121.38 2w3r h ALA 435 Ca 0.20 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2w3r h ALA 435 Cb 0.32 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2w3r h ALA 435 CO -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 179.25 179.03 2w3r h ALA 436 N 1.11 -0.00 -0.26 0.00 0.00 -1.36 -2.76 119.26 115.99 2w3r h ALA 436 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 436 Cb -0.03 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2w3r h ALA 436 CO -0.03 -0.52 0.05 2.35 0.00 0.00 0.00 179.25 181.10 2w3r h TRP 437 N -0.04 0.37 -0.47 0.00 7.01 -0.73 -2.46 115.95 119.63 2w3r h TRP 437 Ca 0.02 -0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.92 2w3r h TRP 437 Cb 0.06 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 2w3r h TRP 437 CO -0.11 0.34 -0.05 -0.91 -2.79 0.00 0.00 178.44 174.92 2w3r h ASN 438 N 0.37 0.85 0.46 2.65 2.35 -0.52 -2.78 115.58 118.97 2w3r h ASN 438 Ca 0.09 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2w3r h ASN 438 Cb 0.17 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2w3r h ASN 438 CO -0.00 0.98 0.00 -1.54 -1.65 0.00 0.00 177.43 175.22 2w3r n SER 439 N -4.31 0.00 -0.02 5.81 3.41 -0.94 -2.23 113.62 115.34 2w3r n SER 439 Ca 0.00 0.40 -0.08 0.00 -0.26 0.00 0.00 58.87 58.94 2w3r n SER 439 Cb 0.34 -0.45 -0.14 0.00 -0.26 0.00 0.00 64.21 63.70 2w3r n SER 439 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2w3r n THR 440 N -1.45 1.53 -4.08 6.66 -1.04 -1.07 -4.96 114.28 109.88 2w3r n THR 440 Ca 0.04 -0.79 -0.24 0.00 -2.04 0.00 0.00 64.05 61.02 2w3r n THR 440 Cb 0.16 -0.94 -0.05 0.00 -1.82 0.00 0.00 70.33 67.68 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 -5.99 5.62 0.00 8.00 -0.87 -0.95 -5.01 114.94 115.75 2w3r s ASN 441 Ca -0.05 -0.14 0.00 0.00 -1.57 0.00 0.00 52.86 51.10 2w3r s ASN 441 Cb 0.08 -1.48 0.00 0.00 -0.02 0.00 0.00 41.25 39.82 2w3r s ASN 441 CO 0.82 0.02 0.19 -2.11 -2.57 0.00 0.00 177.10 173.46 2w3r n ARG 442 N -0.71 0.02 0.00 -0.60 1.85 -1.26 -4.77 116.66 111.18 2w3r n ARG 442 Ca -0.08 -0.20 0.00 0.00 -1.00 0.00 0.00 57.85 56.57 2w3r n ARG 442 Cb 0.56 -0.54 0.00 0.00 -1.05 0.00 0.00 32.46 31.43 2w3r n ARG 442 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2w3r n THR 443 N -0.01 0.00 -4.29 8.89 -1.04 -1.26 -4.90 114.28 111.67 2w3r n THR 443 Ca 0.00 -0.10 -0.23 0.00 -2.04 0.00 0.00 64.05 61.68 2w3r n THR 443 Cb 0.30 0.60 -0.12 0.00 -1.82 0.00 0.00 70.33 69.30 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 -2.78 2.35 -0.05 -4.42 1.43 -1.26 -0.01 118.68 113.93 2w3r s LEU 444 Ca 0.00 -0.74 -0.05 0.00 -1.03 0.00 0.00 54.13 52.31 2w3r s LEU 444 Cb 0.00 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.41 2w3r s LEU 444 CO 0.00 0.01 0.14 0.00 0.23 0.00 0.00 176.35 176.74 2w3r s ALA 445 N -1.49 -0.36 0.00 4.21 0.00 -0.95 -4.73 121.76 118.45 2w3r s ALA 445 Ca 0.09 0.38 0.02 0.00 0.00 0.00 0.00 51.96 52.45 2w3r s ALA 445 Cb -0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 2w3r s ALA 445 CO 0.05 -0.08 0.00 1.03 0.00 0.00 0.00 175.76 176.77 2w3r s ARG 446 N 0.00 2.78 -0.02 0.00 0.52 -1.26 -1.22 118.95 119.76 2w3r s ARG 446 Ca -0.01 -0.62 0.02 0.00 -0.52 0.00 0.00 55.73 54.60 2w3r s ARG 446 Cb -0.01 -2.67 0.01 0.00 0.52 0.00 0.00 34.95 32.79 2w3r s ARG 446 CO 0.00 0.62 -0.07 0.20 0.02 0.00 0.00 175.30 176.08 2w3r s GLY 447 N -1.60 0.42 -0.04 -3.53 0.00 -0.76 -4.44 107.32 97.36 2w3r s GLY 447 Ca 0.20 -0.23 0.04 0.00 0.00 0.00 0.00 44.72 44.73 2w3r s GLY 447 CO 0.11 0.00 -0.15 -1.50 0.00 0.00 0.00 173.10 171.56 2w3r s ILE 448 N 0.26 1.30 -0.05 0.90 2.07 -1.26 -1.27 121.20 123.14 2w3r s ILE 448 Ca -0.03 -0.65 -0.20 0.00 -1.41 0.00 0.00 60.65 58.36 2w3r s ILE 448 Cb -0.08 -1.12 0.04 0.00 0.13 0.00 0.00 42.46 41.43 2w3r s ILE 448 CO 0.00 0.38 0.45 0.00 -1.91 0.00 0.00 174.94 173.86 2w3r s ALA 449 N 0.05 -1.15 -0.12 1.50 0.00 -0.91 -4.77 121.76 116.36 2w3r s ALA 449 Ca -0.03 0.80 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 2w3r s ALA 449 Cb -0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2w3r s ALA 449 CO 0.02 -0.29 -0.12 -1.17 0.00 0.00 0.00 175.76 174.20 2w3r s LEU 450 N -1.00 2.80 0.01 0.00 0.20 -1.26 -1.55 118.68 117.87 2w3r s LEU 450 Ca -0.10 -0.28 0.07 0.00 0.69 0.00 0.00 54.13 54.51 2w3r s LEU 450 Cb -0.03 -1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 44.08 2w3r s LEU 450 CO 0.05 0.19 -0.22 -0.94 -0.29 0.00 0.00 176.35 175.14 2w3r s SER 451 N 0.20 2.62 0.18 3.68 1.04 -0.52 -4.88 113.70 116.02 2w3r s SER 451 Ca -0.07 -0.46 0.03 0.00 0.48 0.00 0.00 55.95 55.92 2w3r s SER 451 Cb -0.15 -0.26 -0.03 0.00 0.10 0.00 0.00 66.02 65.67 2w3r s SER 451 CO 0.05 0.23 0.32 -2.16 0.98 0.00 0.00 173.24 172.66 2w3r s PRO 452 N -0.82 3.45 -0.03 4.02 0.04 -1.26 -1.54 135.00 138.86 2w3r s PRO 452 Ca 0.09 -0.60 0.07 0.00 0.04 0.00 0.00 61.00 60.59 2w3r s PRO 452 Cb -0.09 -2.93 -0.02 0.00 0.04 0.00 0.00 34.50 31.51 2w3r s PRO 452 CO 0.00 0.48 -0.24 0.08 0.04 0.00 0.00 177.00 177.36 2w3r s VAL 453 N -1.83 1.89 -0.24 -0.36 1.01 0.34 -4.82 120.40 116.39 2w3r s VAL 453 Ca 0.35 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 2w3r s VAL 453 Cb -0.10 -1.57 0.09 0.00 0.00 0.00 0.00 36.38 34.79 2w3r s VAL 453 CO 0.29 0.53 0.16 -0.75 0.00 0.00 0.00 175.10 175.33 2w3r s LYS 454 N -0.46 0.17 -0.15 2.72 2.20 -1.26 -3.18 119.74 119.79 2w3r s LYS 454 Ca 0.06 -0.20 0.02 0.00 -0.36 0.00 0.00 55.97 55.50 2w3r s LYS 454 Cb -0.10 -1.28 0.01 0.00 -1.51 0.00 0.00 37.83 34.95 2w3r s LYS 454 CO 0.00 -0.85 -0.21 0.12 -0.36 0.00 0.00 175.35 174.05 2w3r s PHE 455 N 2.20 2.67 0.16 4.03 5.36 -0.57 -4.89 117.98 126.94 2w3r s PHE 455 Ca 0.07 -1.40 -0.26 0.00 -0.96 0.00 0.00 56.93 54.38 2w3r s PHE 455 Cb -0.16 -1.82 -0.08 0.00 -0.34 0.00 0.00 43.02 40.62 2w3r s PHE 455 CO -0.23 -0.65 0.79 0.20 -1.46 0.00 0.00 175.22 173.87 2w3r s GLY 456 N 0.92 2.93 -0.22 13.12 0.00 -1.26 -0.05 107.32 122.75 2w3r s GLY 456 Ca -0.05 0.38 -0.04 0.00 0.00 0.00 0.00 44.72 45.01 2w3r s GLY 456 CO -0.04 0.92 -0.03 -0.42 0.00 0.00 0.00 173.10 173.53 2w3r s ILE 457 N -1.03 3.48 0.00 0.90 -1.09 -0.68 -4.96 121.20 117.81 2w3r s ILE 457 Ca 0.36 -0.46 0.00 0.00 -2.23 0.00 0.00 60.65 58.32 2w3r s ILE 457 Cb -0.23 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.06 2w3r s ILE 457 CO 0.26 0.41 0.00 -1.20 -1.23 0.00 0.00 174.94 173.18 2w3r n SER 458 N 4.81 0.00 -4.68 3.58 7.64 -1.26 -2.17 113.62 121.54 2w3r n SER 458 Ca -0.18 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.28 2w3r n SER 458 Cb 0.51 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 2w3r n SER 458 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2w3r s PHE 459 N -2.00 2.74 0.39 1.43 0.40 -1.26 -4.91 117.98 114.77 2w3r s PHE 459 Ca 0.00 0.74 0.08 0.00 -0.60 0.00 0.00 56.93 57.16 2w3r s PHE 459 Cb 0.00 -3.69 0.79 0.00 0.51 0.00 0.00 43.02 40.62 2w3r s PHE 459 CO 0.00 -2.61 1.95 1.79 0.70 0.00 0.00 175.22 177.05 2w3r h THR 460 N 5.01 1.16 -1.69 0.64 1.35 -1.96 -3.24 112.91 114.18 2w3r h THR 460 Ca -0.37 -0.63 -0.48 0.00 -0.55 0.00 0.00 66.41 64.37 2w3r h THR 460 Cb 1.17 1.02 -0.06 0.00 -1.73 0.00 0.00 68.15 68.55 2w3r h THR 460 CO 0.91 0.21 1.17 -0.76 -0.25 0.00 0.00 175.52 176.80 2w3r s LEU 461 N -8.98 3.26 0.27 3.87 2.01 -1.26 -4.90 118.68 112.96 2w3r s LEU 461 Ca -0.06 -0.35 -0.02 0.00 0.01 0.00 0.00 54.13 53.71 2w3r s LEU 461 Cb 0.16 -2.55 0.44 0.00 0.01 0.00 0.00 46.19 44.25 2w3r s LEU 461 CO 0.74 -2.18 1.88 0.74 1.01 0.00 0.00 176.35 178.54 2w3r h THR 462 N 6.72 1.07 0.00 5.49 2.02 -1.96 -1.77 112.91 124.48 2w3r h THR 462 Ca -0.12 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2w3r h THR 462 Cb 1.08 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 2w3r h THR 462 CO 1.26 0.21 0.00 0.00 0.37 0.00 0.00 175.52 177.36 2w3r n HIS 463 N -4.50 0.00 1.37 3.16 1.44 -1.26 -1.92 115.22 113.50 2w3r n HIS 463 Ca 0.15 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 56.00 2w3r n HIS 463 Cb 0.20 -0.24 0.57 0.00 0.12 0.00 0.00 29.99 30.64 2w3r n HIS 463 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2w3r n LEU 464 N -1.24 0.54 -3.73 2.39 4.77 -0.67 -4.47 117.00 114.59 2w3r n LEU 464 Ca 0.08 -0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 2w3r n LEU 464 Cb 0.11 -0.18 -0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2w3r n LEU 464 CO 0.11 0.10 2.43 0.59 -1.33 0.00 0.00 177.39 179.29 2w3r n ASN 465 N -0.93 5.01 -3.85 -1.43 3.02 -0.81 -4.73 115.26 111.55 2w3r n ASN 465 Ca 0.14 -2.95 -0.11 0.00 -0.03 0.00 0.00 54.58 51.63 2w3r n ASN 465 Cb 0.29 -1.56 -0.09 0.00 -0.61 0.00 0.00 39.78 37.81 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 1.70 0.56 0.08 3.52 -2.07 -1.26 -2.01 119.66 120.17 2w3r s GLN 466 Ca 0.46 -0.41 -0.14 0.00 -1.82 0.00 0.00 55.36 53.45 2w3r s GLN 466 Cb 0.13 0.24 0.02 0.00 -1.09 0.00 0.00 33.01 32.31 2w3r s GLN 466 CO -0.05 -0.15 0.33 0.00 -1.32 0.00 0.00 175.29 174.11 2w3r s ALA 467 N -1.63 -0.74 0.05 2.60 0.00 -0.60 -4.47 121.76 116.98 2w3r s ALA 467 Ca -0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 51.96 51.75 2w3r s ALA 467 Cb -0.06 0.47 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 2w3r s ALA 467 CO 0.01 -0.51 -0.00 0.20 0.00 0.00 0.00 175.76 175.46 2w3r s GLY 468 N -2.43 0.41 0.05 0.00 0.00 -1.26 -0.40 107.32 103.69 2w3r s GLY 468 Ca -0.01 -1.09 -0.10 0.00 0.00 0.00 0.00 44.72 43.51 2w3r s GLY 468 CO -0.07 -1.21 0.22 0.00 0.00 0.00 0.00 173.10 172.04 2w3r s ALA 469 N -3.75 -0.43 -0.06 3.20 0.00 0.85 -2.09 121.76 119.49 2w3r s ALA 469 Ca 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 51.96 51.73 2w3r s ALA 469 Cb 0.06 0.33 0.03 0.00 0.00 0.00 0.00 23.12 23.54 2w3r s ALA 469 CO -0.09 -0.40 0.02 -1.17 0.00 0.00 0.00 175.76 174.11 2w3r s LEU 470 N -2.22 0.54 -0.08 0.00 2.96 0.21 -0.72 118.68 119.36 2w3r s LEU 470 Ca -0.03 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 2w3r s LEU 470 Cb 0.00 -0.35 -0.02 0.00 0.50 0.00 0.00 46.19 46.32 2w3r s LEU 470 CO -0.05 -0.20 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.94 2w3r s VAL 471 N 1.92 2.94 -0.10 1.68 1.01 0.16 -1.72 120.40 126.28 2w3r s VAL 471 Ca 0.03 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.31 2w3r s VAL 471 Cb -0.12 -2.18 0.00 0.00 0.00 0.00 0.00 36.38 34.08 2w3r s VAL 471 CO -0.04 0.56 -0.23 -1.10 0.00 0.00 0.00 175.10 174.29 2w3r s GLN 472 N -0.22 2.98 -0.15 2.72 -1.52 0.14 -2.46 119.66 121.15 2w3r s GLN 472 Ca 0.00 -0.85 0.02 0.00 -1.95 0.00 0.00 55.36 52.58 2w3r s GLN 472 Cb -0.13 -2.27 0.01 0.00 -0.22 0.00 0.00 33.01 30.39 2w3r s GLN 472 CO 0.03 0.15 -0.19 0.42 -0.25 0.00 0.00 175.29 175.44 2w3r s ILE 473 N 0.42 2.27 0.59 1.08 1.01 -0.82 -0.17 121.20 125.59 2w3r s ILE 473 Ca -0.17 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.59 2w3r s ILE 473 Cb -0.18 -1.93 0.06 0.00 0.01 0.00 0.00 42.46 40.43 2w3r s ILE 473 CO 0.07 0.54 0.82 -0.31 0.00 0.00 0.00 174.94 176.06 2w3r s TYR 474 N 0.85 2.38 -0.30 3.97 1.51 -0.53 -4.81 117.35 120.42 2w3r s TYR 474 Ca -0.06 -0.17 0.28 0.00 -1.01 0.00 0.00 57.07 56.11 2w3r s TYR 474 Cb -0.15 -2.75 1.04 0.00 -0.11 0.00 0.00 41.96 39.99 2w3r s TYR 474 CO -0.02 -1.10 1.81 1.79 -1.11 0.00 0.00 175.55 176.92 2w3r h THR 475 N -0.05 0.00 -0.00 -0.71 1.35 -1.94 -2.00 112.91 109.55 2w3r h THR 475 Ca -0.39 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2w3r h THR 475 Cb 1.29 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 2w3r h THR 475 CO 0.47 0.00 -0.10 -0.90 -0.25 0.00 0.00 175.52 174.75 2w3r n ASP 476 N -2.63 0.26 0.00 5.36 3.85 -1.26 -4.28 116.55 117.85 2w3r n ASP 476 Ca 0.02 -0.24 0.00 0.00 -0.71 0.00 0.00 54.79 53.86 2w3r n ASP 476 Cb 0.31 -0.17 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 2w3r n ASP 476 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2w3r n GLY 477 N 1.34 0.81 3.91 6.12 0.00 -0.75 -4.77 105.19 111.85 2w3r n GLY 477 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.18 6.13 -0.03 1.61 1.04 -1.26 -4.81 113.70 114.20 2w3r s SER 478 Ca 0.00 0.86 0.03 0.00 0.48 0.00 0.00 55.95 57.32 2w3r s SER 478 Cb 0.00 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.99 2w3r s SER 478 CO 0.00 -0.66 -0.10 -0.69 0.98 0.00 0.00 173.24 172.76 2w3r s VAL 479 N -2.77 0.90 -0.18 5.02 1.01 0.10 -1.45 120.40 123.03 2w3r s VAL 479 Ca 0.48 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 2w3r s VAL 479 Cb -0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 2w3r s VAL 479 CO 0.45 0.28 -0.03 0.00 0.00 0.00 0.00 175.10 175.79 2w3r s ALA 480 N 0.18 2.98 -0.10 5.51 0.00 0.77 -0.27 121.76 130.83 2w3r s ALA 480 Ca -0.03 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.02 2w3r s ALA 480 Cb -0.09 -1.64 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 2w3r s ALA 480 CO 0.01 0.03 -0.11 -1.17 0.00 0.00 0.00 175.76 174.52 2w3r s LEU 481 N 0.69 2.89 -0.05 0.00 2.96 0.66 -0.68 118.68 125.16 2w3r s LEU 481 Ca -0.01 -0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 53.67 2w3r s LEU 481 Cb -0.14 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 44.94 2w3r s LEU 481 CO 0.02 0.25 0.10 0.21 -1.32 0.00 0.00 176.35 175.62 2w3r s ASN 482 N -0.17 -0.06 0.25 3.68 3.84 -0.70 -1.18 114.94 120.60 2w3r s ASN 482 Ca 0.01 0.21 -0.03 0.00 0.21 0.00 0.00 52.86 53.25 2w3r s ASN 482 Cb -0.13 0.12 -0.02 0.00 -0.55 0.00 0.00 41.25 40.67 2w3r s ASN 482 CO 0.03 -0.12 0.29 -1.38 -2.79 0.00 0.00 177.10 173.13 2w3r s HIS 483 N 0.88 1.02 -0.93 0.43 -3.43 -1.26 0.65 115.29 112.65 2w3r s HIS 483 Ca -0.07 -1.24 0.24 0.00 -0.80 0.00 0.00 55.06 53.19 2w3r s HIS 483 Cb -0.09 -0.32 1.00 0.00 -1.43 0.00 0.00 32.58 31.73 2w3r s HIS 483 CO -0.04 -0.83 1.77 0.41 -2.00 0.00 0.00 174.74 174.05 2w3r n GLY 484 N -0.39 -1.37 3.79 -1.38 0.00 -0.89 -4.66 105.19 100.30 2w3r n GLY 484 Ca 0.02 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 2w3r n GLY 484 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w3r s GLY 485 N -3.10 2.65 -0.06 -0.02 0.00 -1.26 -4.83 107.32 100.70 2w3r s GLY 485 Ca 0.11 0.61 -0.01 0.00 0.00 0.00 0.00 44.72 45.44 2w3r s GLY 485 CO 0.45 1.00 -0.01 -0.51 0.00 0.00 0.00 173.10 174.04 2w3r s THR 486 N -1.79 4.20 -0.48 0.90 -4.23 -1.26 -4.71 115.64 108.27 2w3r s THR 486 Ca 0.59 -0.38 -0.23 0.00 -1.18 0.00 0.00 61.69 60.49 2w3r s THR 486 Cb -0.18 -2.80 0.03 0.00 1.34 0.00 0.00 72.50 70.89 2w3r s THR 486 CO 0.23 0.53 0.81 -0.70 -0.54 0.00 0.00 174.62 174.96 2w3r s GLU 487 N -1.09 3.37 0.00 3.99 2.56 -1.26 -4.84 118.70 121.43 2w3r s GLU 487 Ca 0.15 -0.19 0.15 0.00 0.00 0.00 0.00 54.97 55.08 2w3r s GLU 487 Cb -0.11 -3.98 0.21 0.00 2.00 0.00 0.00 34.13 32.25 2w3r s GLU 487 CO 0.05 -1.21 1.08 0.00 -0.56 0.00 0.00 175.26 174.62 2w3r n MET 488 N 6.85 1.60 0.00 4.30 0.00 -1.26 -0.25 117.12 128.36 2w3r n MET 488 Ca 0.02 -1.64 0.00 0.00 0.00 0.00 0.00 57.70 56.07 2w3r n MET 488 Cb 0.48 -1.31 0.00 0.00 0.00 0.00 0.00 33.22 32.39 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 0.85 1.53 0.00 3.17 0.00 -1.26 -3.30 105.19 106.17 2w3r n GLY 489 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 0.19 -2.17 1.61 0.00 -1.26 -4.84 117.38 110.92 2w3r n GLN 490 Ca 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 57.00 57.11 2w3r n GLN 490 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.74 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 -0.02 0.25 0.33 2.61 0.00 -1.26 -4.95 105.19 102.16 2w3r n GLY 491 Ca 0.07 -0.68 -0.03 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.07 0.93 0.08 0.99 5.85 -1.90 -2.97 115.31 118.21 2w3r h LEU 492 Ca -0.10 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 2w3r h LEU 492 Cb 1.08 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.87 2w3r h LEU 492 CO 0.12 0.80 -0.04 0.45 -0.34 0.00 0.00 178.44 179.43 2w3r h HIS 493 N 1.01 -0.10 -0.19 1.25 3.86 -1.93 -1.27 115.15 117.79 2w3r h HIS 493 Ca 0.24 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.51 2w3r h HIS 493 Cb 0.13 0.03 -0.07 0.00 1.06 0.00 0.00 27.41 28.56 2w3r h HIS 493 CO 0.01 0.19 -0.31 0.00 0.86 0.00 0.00 177.93 178.69 2w3r h ALA 494 N 0.49 -0.31 -0.47 2.45 0.00 -1.89 -0.16 119.26 119.37 2w3r h ALA 494 Ca -0.01 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2w3r h ALA 494 Cb 0.34 0.61 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 2w3r h ALA 494 CO 0.02 -0.77 -0.25 0.87 0.00 0.00 0.00 179.25 179.12 2w3r h LYS 495 N -0.35 -0.15 -0.66 0.00 1.57 -1.45 0.58 116.57 116.12 2w3r h LYS 495 Ca 0.11 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2w3r h LYS 495 Cb 0.53 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2w3r h LYS 495 CO -0.39 -0.10 0.44 0.52 -0.57 0.00 0.00 179.45 179.35 2w3r h MET 496 N -0.15 0.83 0.11 3.15 2.86 -0.49 -1.42 114.93 119.82 2w3r h MET 496 Ca 0.22 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 2w3r h MET 496 Cb 0.49 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2w3r h MET 496 CO -0.56 0.55 -0.05 0.28 1.06 0.00 0.00 176.91 178.18 2w3r h VAL 497 N 0.86 1.00 -0.69 -2.22 2.07 0.41 -2.22 116.25 115.45 2w3r h VAL 497 Ca 0.25 -0.43 0.13 0.00 0.82 0.00 0.00 66.70 67.47 2w3r h VAL 497 Cb -0.05 1.27 -0.09 0.00 -1.52 0.00 0.00 31.29 30.90 2w3r h VAL 497 CO -0.06 0.10 0.24 1.56 0.02 0.00 0.00 177.57 179.43 2w3r h GLN 498 N -0.35 0.37 -0.25 1.57 4.20 -0.35 0.28 115.11 120.58 2w3r h GLN 498 Ca -0.02 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.72 2w3r h GLN 498 Cb 0.29 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 2w3r h GLN 498 CO 0.03 0.24 -0.01 0.28 -0.67 0.00 0.00 178.83 178.70 2w3r h VAL 499 N 0.38 0.81 -0.23 -0.54 2.07 -1.21 -0.77 116.25 116.76 2w3r h VAL 499 Ca 0.37 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.86 2w3r h VAL 499 Cb 0.54 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2w3r h VAL 499 CO -0.39 0.01 0.10 0.00 0.02 0.00 0.00 177.57 177.31 2w3r h ALA 500 N 1.22 0.30 -0.77 1.67 0.00 -0.45 -1.46 119.26 119.77 2w3r h ALA 500 Ca 0.12 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2w3r h ALA 500 Cb 0.16 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2w3r h ALA 500 CO -0.21 -0.12 0.51 0.00 0.00 0.00 0.00 179.25 179.42 2w3r h ALA 501 N 0.96 1.44 0.08 0.00 0.00 -0.39 -0.67 119.26 120.68 2w3r h ALA 501 Ca 0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2w3r h ALA 501 Cb 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2w3r h ALA 501 CO -0.01 0.52 -0.04 0.00 0.00 0.00 0.00 179.25 179.72 2w3r h ALA 502 N 1.51 -0.11 0.00 0.00 0.00 -0.97 0.72 119.26 120.40 2w3r h ALA 502 Ca 0.28 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2w3r h ALA 502 Cb -0.11 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2w3r h ALA 502 CO -0.06 -0.39 -0.01 0.28 0.00 0.00 0.00 179.25 179.07 2w3r h VAL 503 N -0.47 0.03 0.00 0.00 2.07 -1.02 -2.67 116.25 114.19 2w3r h VAL 503 Ca -0.01 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2w3r h VAL 503 Cb 0.39 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2w3r h VAL 503 CO 0.02 0.01 -1.62 0.18 0.02 0.00 0.00 177.57 176.17 2w3r n LEU 504 N -3.11 0.36 -1.67 2.57 4.77 -0.28 -4.77 117.00 114.86 2w3r n LEU 504 Ca -0.00 -0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 55.70 2w3r n LEU 504 Cb 0.26 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.38 2w3r n LEU 504 CO 0.26 0.09 0.08 0.61 -1.33 0.00 0.00 177.39 177.09 2w3r n GLY 505 N 1.36 0.30 3.40 -0.72 0.00 0.15 -4.66 105.19 105.02 2w3r n GLY 505 Ca -0.01 -0.32 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.04 1.38 0.18 -0.61 -4.36 -0.66 -0.18 121.20 113.90 2w3r s ILE 506 Ca 0.21 -2.08 -0.31 0.00 -0.26 0.00 0.00 60.65 58.22 2w3r s ILE 506 Cb -0.09 -2.45 -0.09 0.00 1.25 0.00 0.00 42.46 41.08 2w3r s ILE 506 CO 0.26 -0.28 1.40 -0.62 0.24 0.00 0.00 174.94 175.95 2w3r s ASP 507 N -3.40 6.77 0.57 4.36 -1.08 -1.26 -4.62 116.67 118.02 2w3r s ASP 507 Ca 0.30 2.47 0.43 0.00 -0.52 0.00 0.00 52.55 55.22 2w3r s ASP 507 Cb 0.05 -2.60 1.49 0.00 -1.46 0.00 0.00 42.92 40.40 2w3r s ASP 507 CO 0.11 -0.65 1.51 -0.65 0.52 0.00 0.00 175.17 176.01 2w3r h PRO 508 N 5.95 0.00 0.00 4.34 0.11 -1.93 0.27 132.00 140.74 2w3r h PRO 508 Ca -0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2w3r h PRO 508 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2w3r h PRO 508 CO 0.82 0.00 -0.03 0.28 -0.21 0.00 0.00 178.00 178.86 2w3r h VAL 509 N 0.00 0.14 0.00 3.15 2.07 -2.00 -1.89 116.25 117.73 2w3r h VAL 509 Ca 0.78 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.93 2w3r h VAL 509 Cb 3.42 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 34.51 2w3r h VAL 509 CO -0.01 0.03 -0.09 0.00 0.02 0.00 0.00 177.57 177.52 2w3r n GLN 510 N -3.22 0.07 -3.78 1.57 1.13 0.96 -4.73 117.38 109.39 2w3r n GLN 510 Ca -0.01 0.05 -0.37 0.00 -1.94 0.00 0.00 57.00 54.73 2w3r n GLN 510 Cb 0.22 -1.57 -0.13 0.00 0.11 0.00 0.00 30.24 28.87 2w3r n GLN 510 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2w3r s VAL 511 N -3.03 3.94 -0.16 5.09 1.01 -0.71 0.01 120.40 126.56 2w3r s VAL 511 Ca 0.13 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.50 2w3r s VAL 511 Cb 0.17 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 2w3r s VAL 511 CO 0.58 0.18 -0.03 -0.60 0.00 0.00 0.00 175.10 175.23 2w3r s ARG 512 N 1.52 3.70 -0.07 2.72 6.06 0.63 -4.98 118.95 128.53 2w3r s ARG 512 Ca 0.04 -0.50 -0.27 0.00 -2.50 0.00 0.00 55.73 52.50 2w3r s ARG 512 Cb -0.16 -2.94 -0.03 0.00 0.06 0.00 0.00 34.95 31.88 2w3r s ARG 512 CO 0.02 0.25 0.86 -1.50 -2.50 0.00 0.00 175.30 172.43 2w3r s ILE 513 N 0.34 4.92 0.15 4.11 1.10 -1.26 -0.24 121.20 130.32 2w3r s ILE 513 Ca -0.03 1.77 0.03 0.00 -0.51 0.00 0.00 60.65 61.90 2w3r s ILE 513 Cb -0.14 -4.19 -0.04 0.00 0.15 0.00 0.00 42.46 38.24 2w3r s ILE 513 CO 0.03 0.14 0.27 0.42 -2.11 0.00 0.00 174.94 173.69 2w3r s THR 514 N 1.31 5.26 0.81 4.00 -4.23 -0.32 -4.92 115.64 117.54 2w3r s THR 514 Ca 0.44 -0.72 -0.13 0.00 -1.18 0.00 0.00 61.69 60.10 2w3r s THR 514 Cb -0.19 -3.71 0.08 0.00 1.34 0.00 0.00 72.50 70.03 2w3r s THR 514 CO 0.20 -0.09 1.17 0.00 -0.54 0.00 0.00 174.62 175.36 2w3r s ALA 515 N -1.74 1.88 0.17 3.99 0.00 -1.26 -4.75 121.76 120.05 2w3r s ALA 515 Ca 0.34 0.70 -0.31 0.00 0.00 0.00 0.00 51.96 52.69 2w3r s ALA 515 Cb -0.11 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 2w3r s ALA 515 CO 0.28 -2.21 1.47 0.99 0.00 0.00 0.00 175.76 176.29 2w3r s THR 516 N -2.34 2.87 -0.18 0.00 2.01 0.00 -4.86 115.64 113.14 2w3r s THR 516 Ca 0.70 0.65 -0.04 0.00 0.31 0.00 0.00 61.69 63.31 2w3r s THR 516 Cb -0.25 -3.42 0.09 0.00 0.01 0.00 0.00 72.50 68.93 2w3r s THR 516 CO 0.51 0.06 0.24 -0.62 -0.69 0.00 0.00 174.62 174.13 2w3r s ASP 517 N 0.93 1.01 0.25 3.53 3.68 -1.26 -0.66 116.67 124.15 2w3r s ASP 517 Ca 0.65 0.03 0.18 0.00 2.13 0.00 0.00 52.55 55.55 2w3r s ASP 517 Cb -0.41 0.50 0.93 0.00 -1.45 0.00 0.00 42.92 42.49 2w3r s ASP 517 CO 0.34 -0.30 1.55 0.35 0.13 0.00 0.00 175.17 177.24 2w3r n THR 518 N 5.33 1.18 1.14 1.71 -2.24 -0.94 -0.51 114.28 119.95 2w3r n THR 518 Ca -0.05 0.61 0.12 0.00 -2.27 0.00 0.00 64.05 62.46 2w3r n THR 518 Cb 0.50 -1.60 0.20 0.00 -2.10 0.00 0.00 70.33 67.33 2w3r n THR 518 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2w3r n SER 519 N -2.10 1.64 -0.09 3.42 3.41 -1.26 -3.90 113.62 114.74 2w3r n SER 519 Ca -0.01 -1.29 -0.16 0.00 -0.26 0.00 0.00 58.87 57.15 2w3r n SER 519 Cb 0.06 0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.18 0.44 -4.04 4.33 5.02 0.33 -4.93 118.16 119.15 2w3r n LYS 520 Ca 0.11 0.19 -0.33 0.00 -2.02 0.00 0.00 58.31 56.26 2w3r n LYS 520 Cb 0.42 -1.26 -0.15 0.00 -0.02 0.00 0.00 35.03 34.02 2w3r n LYS 520 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2w3r s VAL 521 N -2.54 2.35 0.39 -0.18 1.01 -0.45 -4.87 120.40 116.12 2w3r s VAL 521 Ca -0.27 -1.54 0.01 0.00 0.00 0.00 0.00 61.98 60.18 2w3r s VAL 521 Cb 0.08 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 2w3r s VAL 521 CO 0.36 -0.02 0.59 -2.16 0.00 0.00 0.00 175.10 173.88 2w3r s PRO 522 N 1.15 3.27 -1.44 2.72 0.04 -1.25 -4.27 135.00 135.21 2w3r s PRO 522 Ca -0.07 -0.47 -0.10 0.00 0.04 0.00 0.00 61.00 60.40 2w3r s PRO 522 Cb -0.20 -2.63 0.05 0.00 0.04 0.00 0.00 34.50 31.76 2w3r s PRO 522 CO -0.04 -0.04 0.99 0.09 0.04 0.00 0.00 177.00 178.04 2w3r n ASN 523 N -1.89 -4.48 -4.84 6.66 3.02 -1.26 -4.95 115.26 107.51 2w3r n ASN 523 Ca -0.02 -0.72 -0.35 0.00 -0.03 0.00 0.00 54.58 53.47 2w3r n ASN 523 Cb 0.57 -4.25 -0.06 0.00 -0.61 0.00 0.00 39.78 35.43 2w3r n ASN 523 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2w3r s THR 524 N -3.37 4.76 0.67 3.41 -4.23 -1.26 -5.02 115.64 110.61 2w3r s THR 524 Ca 0.51 0.92 -0.10 0.00 -1.18 0.00 0.00 61.69 61.84 2w3r s THR 524 Cb -0.25 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 69.87 2w3r s THR 524 CO 0.80 0.12 1.05 -0.44 -0.54 0.00 0.00 174.62 175.61 2w3r s SER 525 N -1.87 5.54 0.61 3.99 0.01 -1.26 -4.58 113.70 116.14 2w3r s SER 525 Ca 0.43 1.07 -0.19 0.00 1.31 0.00 0.00 55.95 58.57 2w3r s SER 525 Cb -0.14 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 2w3r s SER 525 CO 0.20 -1.24 1.16 0.00 0.41 0.00 0.00 173.24 173.76 2w3r n ALA 526 N -2.90 0.78 -2.37 1.44 0.00 -1.26 -4.88 120.51 111.32 2w3r n ALA 526 Ca 0.06 0.02 -0.37 0.00 0.00 0.00 0.00 53.44 53.16 2w3r n ALA 526 Cb 0.57 -2.23 -0.04 0.00 0.00 0.00 0.00 19.45 17.75 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 -1.42 3.71 0.37 0.00 2.01 -0.30 -4.87 115.64 115.12 2w3r s THR 527 Ca 0.78 -0.39 -0.04 0.00 0.31 0.00 0.00 61.69 62.34 2w3r s THR 527 Cb -0.40 -4.65 0.02 0.00 0.01 0.00 0.00 72.50 67.48 2w3r s THR 527 CO 0.44 -1.56 0.56 0.00 -0.69 0.00 0.00 174.62 173.37 2w3r n ALA 528 N 10.72 -0.63 -1.31 7.40 0.00 -1.26 -4.95 120.51 130.48 2w3r n ALA 528 Ca 0.29 -1.58 -0.11 0.00 0.00 0.00 0.00 53.44 52.04 2w3r n ALA 528 Cb 0.50 1.27 -0.05 0.00 0.00 0.00 0.00 19.45 21.17 2w3r n ALA 528 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n ALA 529 N -0.63 -0.16 -0.86 0.00 0.00 -1.26 -1.72 120.51 115.88 2w3r n ALA 529 Ca -0.14 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2w3r n ALA 529 Cb 0.60 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 -0.78 -3.96 -1.32 0.00 7.64 -1.26 -4.43 113.62 109.51 2w3r n SER 530 Ca -0.11 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.83 2w3r n SER 530 Cb 0.51 -2.96 0.26 0.00 -1.01 0.00 0.00 64.21 61.00 2w3r n SER 530 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2w3r n SER 531 N -0.63 3.85 -0.08 6.43 3.41 -0.70 -4.28 113.62 121.62 2w3r n SER 531 Ca 0.00 -2.49 -0.13 0.00 -0.26 0.00 0.00 58.87 55.99 2w3r n SER 531 Cb 0.32 -0.56 -0.05 0.00 -0.26 0.00 0.00 64.21 63.65 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 4.48 0.61 0.40 5.00 0.00 -1.89 -3.01 103.07 108.67 2w3r h GLY 532 Ca 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 2w3r h GLY 532 CO 0.26 0.55 -0.06 0.00 0.00 0.00 0.00 176.54 177.30 2w3r h ALA 533 N 0.68 0.02 -0.60 3.60 0.00 -1.94 -3.02 119.26 118.00 2w3r h ALA 533 Ca 0.04 -0.35 0.09 0.00 0.00 0.00 0.00 54.91 54.70 2w3r h ALA 533 Cb 0.76 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.44 2w3r h ALA 533 CO 0.05 -0.11 -0.41 -0.44 0.00 0.00 0.00 179.25 178.35 2w3r h ASP 534 N -0.57 -1.40 0.03 0.00 5.19 -1.80 0.63 116.42 118.49 2w3r h ASP 534 Ca -0.00 0.24 -0.26 0.00 -0.62 0.00 0.00 57.03 56.39 2w3r h ASP 534 Cb 0.71 0.65 -0.03 0.00 0.18 0.00 0.00 39.33 40.85 2w3r h ASP 534 CO 0.01 -0.33 -1.40 0.24 -3.12 0.00 0.00 179.24 174.64 2w3r h MET 535 N -0.20 0.06 -0.47 3.56 2.86 -1.67 -3.11 114.93 115.96 2w3r h MET 535 Ca 0.20 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 2w3r h MET 535 Cb 0.56 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 2w3r h MET 535 CO -0.70 1.05 0.04 -0.91 1.06 0.00 0.00 176.91 177.46 2w3r h ASN 536 N -0.76 0.71 -0.40 1.22 2.35 -1.62 0.12 115.58 117.20 2w3r h ASN 536 Ca -0.36 -0.15 0.08 0.00 -0.55 0.00 0.00 56.30 55.33 2w3r h ASN 536 Cb 1.46 -0.19 -0.09 0.00 0.05 0.00 0.00 38.32 39.56 2w3r h ASN 536 CO -0.14 0.75 -0.23 1.23 -1.65 0.00 0.00 177.43 177.39 2w3r h GLY 537 N 0.95 0.02 0.97 2.83 0.00 -1.00 0.70 103.07 107.53 2w3r h GLY 537 Ca 0.15 0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.72 2w3r h GLY 537 CO 0.01 -0.20 0.15 -0.33 0.00 0.00 0.00 176.54 176.17 2w3r h MET 538 N -0.16 0.78 -0.90 4.80 2.86 -1.37 -1.57 114.93 119.38 2w3r h MET 538 Ca 0.19 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2w3r h MET 538 Cb 0.46 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 2w3r h MET 538 CO -0.49 0.73 0.48 0.00 1.06 0.00 0.00 176.91 178.69 2w3r h ALA 539 N 1.01 1.15 -0.13 6.32 0.00 -0.11 0.11 119.26 127.61 2w3r h ALA 539 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2w3r h ALA 539 Cb 0.29 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2w3r h ALA 539 CO -0.00 0.67 0.05 0.28 0.00 0.00 0.00 179.25 180.25 2w3r h VAL 540 N 1.26 1.16 -0.36 0.00 2.07 0.49 -2.87 116.25 118.01 2w3r h VAL 540 Ca 0.31 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.43 2w3r h VAL 540 Cb 0.04 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 2w3r h VAL 540 CO -0.05 0.14 -0.03 0.50 0.02 0.00 0.00 177.57 178.15 2w3r h LYS 541 N 0.06 0.06 -0.28 1.57 3.64 -0.71 -0.93 116.57 119.97 2w3r h LYS 541 Ca 0.04 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 2w3r h LYS 541 Cb 0.18 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.91 2w3r h LYS 541 CO -0.00 0.04 -0.33 0.22 -2.27 0.00 0.00 179.45 177.10 2w3r h ASP 542 N 0.06 -1.07 -0.46 4.20 3.58 -0.98 0.41 116.42 122.15 2w3r h ASP 542 Ca 0.17 0.17 0.02 0.00 0.42 0.00 0.00 57.03 57.82 2w3r h ASP 542 Cb 0.25 0.48 -0.03 0.00 1.72 0.00 0.00 39.33 41.75 2w3r h ASP 542 CO -0.32 -0.34 0.27 0.00 -2.88 0.00 0.00 179.24 175.97 2w3r h ALA 543 N 0.58 0.59 -0.42 -0.78 0.00 -1.19 -2.38 119.26 115.66 2w3r h ALA 543 Ca 0.14 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 2w3r h ALA 543 Cb 0.55 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2w3r h ALA 543 CO -0.46 -0.04 -0.15 0.00 0.00 0.00 0.00 179.25 178.60 2w3r h GLU 545 N 0.70 0.66 -0.58 0.00 5.08 -0.77 0.26 114.58 119.92 2w3r h GLU 545 Ca 0.11 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2w3r h GLU 545 Cb 0.65 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2w3r h GLU 545 CO 0.05 0.73 0.21 1.15 -1.00 0.00 0.00 179.01 180.14 2w3r h THR 546 N 0.61 1.23 -0.13 1.13 2.02 -1.13 0.41 112.91 117.04 2w3r h THR 546 Ca 0.11 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 66.50 2w3r h THR 546 Cb 0.50 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 2w3r h THR 546 CO 0.03 0.29 -0.04 -0.07 0.37 0.00 0.00 175.52 176.09 2w3r h LEU 547 N 0.81 0.27 -1.34 2.58 3.38 -1.30 -0.77 115.31 118.93 2w3r h LEU 547 Ca 0.19 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 57.87 2w3r h LEU 547 Cb 0.24 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 2w3r h LEU 547 CO -0.01 0.59 0.52 -0.09 0.09 0.00 0.00 178.44 179.54 2w3r h ARG 548 N -0.06 0.71 0.20 1.13 2.43 -0.82 -1.00 114.38 116.96 2w3r h ARG 548 Ca 0.03 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2w3r h ARG 548 Cb 0.48 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2w3r h ARG 548 CO 0.02 0.47 -0.09 0.78 -1.51 0.00 0.00 179.97 179.63 2w3r h GLY 549 N 0.73 -0.28 0.87 2.80 0.00 0.13 -1.27 103.07 106.04 2w3r h GLY 549 Ca 0.37 0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.84 2w3r h GLY 549 CO -0.15 -0.10 0.44 3.21 0.00 0.00 0.00 176.54 179.94 2w3r h ARG 550 N -0.35 0.83 -0.29 4.80 3.08 -0.53 -1.98 114.38 119.94 2w3r h ARG 550 Ca -0.03 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 2w3r h ARG 550 Cb 0.27 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2w3r h ARG 550 CO 0.04 0.55 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.42 2w3r h LEU 551 N 0.86 0.51 0.02 3.04 3.38 -1.17 -2.41 115.31 119.53 2w3r h LEU 551 Ca 0.28 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2w3r h LEU 551 Cb 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2w3r h LEU 551 CO -0.11 0.70 -0.05 0.00 0.09 0.00 0.00 178.44 179.07 2w3r h ALA 552 N 0.82 -0.07 -0.87 1.53 0.00 -1.07 -1.25 119.26 118.35 2w3r h ALA 552 Ca 0.08 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2w3r h ALA 552 Cb 0.45 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 2w3r h ALA 552 CO 0.02 -0.55 0.56 0.78 0.00 0.00 0.00 179.25 180.06 2w3r h GLY 553 N -0.10 1.23 0.86 0.00 0.00 -1.38 0.57 103.07 104.26 2w3r h GLY 553 Ca 0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2w3r h GLY 553 CO -0.04 0.21 0.04 -2.75 0.00 0.00 0.00 176.54 174.00 2w3r h PHE 554 N 0.86 0.17 -0.59 5.60 3.57 -1.04 -0.70 116.94 124.81 2w3r h PHE 554 Ca 0.40 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.81 2w3r h PHE 554 Cb 0.39 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2w3r h PHE 554 CO -0.00 0.28 0.07 0.28 -2.23 0.00 0.00 178.31 176.71 2w3r h VAL 555 N 0.01 1.25 -0.28 1.41 2.07 -0.53 -1.02 116.25 119.17 2w3r h VAL 555 Ca 0.04 -1.01 0.03 0.00 0.82 0.00 0.00 66.70 66.57 2w3r h VAL 555 Cb 0.18 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2w3r h VAL 555 CO -0.00 0.37 0.09 0.00 0.02 0.00 0.00 177.57 178.05 2w3r h ALA 556 N 1.16 0.31 0.32 1.67 0.00 0.27 0.32 119.26 123.31 2w3r h ALA 556 Ca 0.18 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2w3r h ALA 556 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w3r h ALA 556 CO 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 179.25 178.80 2w3r h ALA 557 N 1.18 -0.43 -0.40 0.00 0.00 -1.03 0.26 119.26 118.83 2w3r h ALA 557 Ca 0.12 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.96 2w3r h ALA 557 Cb 0.09 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2w3r h ALA 557 CO -0.13 -0.61 0.28 -0.09 0.00 0.00 0.00 179.25 178.70 2w3r h ARG 558 N -0.69 0.12 -0.24 0.00 2.43 -1.06 -1.40 114.38 113.53 2w3r h ARG 558 Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2w3r h ARG 558 Cb 0.48 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2w3r h ARG 558 CO 0.07 0.08 0.00 0.39 -1.51 0.00 0.00 179.97 179.00 2w3r n GLU 559 N -4.45 2.57 -3.33 0.20 -0.58 0.09 -5.05 120.64 110.09 2w3r n GLU 559 Ca 0.06 -1.83 -0.20 0.00 -0.42 0.00 0.00 57.16 54.77 2w3r n GLU 559 Cb 0.39 -1.21 0.01 0.00 -0.57 0.00 0.00 31.44 30.07 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 0.33 -0.84 3.77 0.62 0.00 0.71 -4.98 105.19 104.80 2w3r n GLY 560 Ca 0.09 0.92 -0.03 0.00 0.00 0.00 0.00 46.02 47.00 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 -2.88 2.77 0.21 0.00 0.00 -1.26 -4.43 121.76 116.17 2w3r s ALA 562 Ca 0.15 1.13 -0.02 0.00 0.00 0.00 0.00 51.96 53.22 2w3r s ALA 562 Cb -0.01 -3.49 0.18 0.00 0.00 0.00 0.00 23.12 19.81 2w3r s ALA 562 CO 0.02 -1.13 1.57 0.00 0.00 0.00 0.00 175.76 176.22 2w3r h ALA 563 N 1.44 0.81 0.00 0.00 0.00 -1.92 -2.87 119.26 116.72 2w3r h ALA 563 Ca -0.50 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 53.95 2w3r h ALA 563 Cb 1.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2w3r h ALA 563 CO 0.57 0.66 0.00 2.89 0.00 0.00 0.00 179.25 183.37 2w3r n ARG 564 N -4.01 0.12 -0.04 0.00 1.85 -1.26 -1.21 116.66 112.10 2w3r n ARG 564 Ca -0.02 0.18 0.12 0.00 -1.00 0.00 0.00 57.85 57.14 2w3r n ARG 564 Cb 0.54 -1.50 0.26 0.00 -1.05 0.00 0.00 32.46 30.71 2w3r n ARG 564 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2w3r n ASP 565 N -1.24 2.54 -4.39 2.89 9.92 -1.08 -4.82 116.55 120.37 2w3r n ASP 565 Ca 0.04 -1.84 -0.44 0.00 -0.53 0.00 0.00 54.79 52.02 2w3r n ASP 565 Cb 0.05 -0.05 -0.05 0.00 -0.64 0.00 0.00 41.12 40.43 2w3r n ASP 565 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2w3r s VAL 566 N -1.90 4.76 -0.08 2.53 1.01 -0.35 -4.52 120.40 121.85 2w3r s VAL 566 Ca 0.33 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 2w3r s VAL 566 Cb 0.20 -4.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 2w3r s VAL 566 CO 0.31 -1.13 0.99 -0.63 0.00 0.00 0.00 175.10 174.64 2w3r s ILE 567 N 2.86 4.82 -0.22 2.22 1.01 0.51 -4.87 121.20 127.52 2w3r s ILE 567 Ca 0.13 2.02 -0.05 0.00 0.00 0.00 0.00 60.65 62.75 2w3r s ILE 567 Cb -0.23 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 37.92 2w3r s ILE 567 CO 0.07 0.05 0.01 -0.36 0.00 0.00 0.00 174.94 174.72 2w3r s PHE 568 N 1.73 3.04 -0.28 3.97 0.40 -1.26 -0.08 117.98 125.49 2w3r s PHE 568 Ca 0.49 -0.56 -0.23 0.00 -0.60 0.00 0.00 56.93 56.03 2w3r s PHE 568 Cb -0.19 -2.14 0.13 0.00 0.51 0.00 0.00 43.02 41.33 2w3r s PHE 568 CO 0.20 -0.35 1.04 0.34 0.70 0.00 0.00 175.22 177.15 2w3r s ASP 569 N 1.30 -0.45 -1.49 1.36 3.68 -0.63 -4.56 116.67 115.88 2w3r s ASP 569 Ca 0.04 0.83 -0.12 0.00 2.13 0.00 0.00 52.55 55.43 2w3r s ASP 569 Cb -0.15 0.90 0.07 0.00 -1.45 0.00 0.00 42.92 42.30 2w3r s ASP 569 CO 0.01 -0.14 1.02 0.00 0.13 0.00 0.00 175.17 176.19 2w3r n ALA 570 N 2.45 -1.31 -1.11 3.66 0.00 -0.70 -1.36 120.51 122.13 2w3r n ALA 570 Ca -0.13 0.23 -0.04 0.00 0.00 0.00 0.00 53.44 53.50 2w3r n ALA 570 Cb 0.56 -4.64 -0.02 0.00 0.00 0.00 0.00 19.45 15.35 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 -1.76 0.66 3.24 0.00 0.00 0.74 -4.93 105.19 103.15 2w3r n GLY 571 Ca 0.03 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.75 1.36 -0.14 1.61 -1.52 -0.47 -2.27 119.66 116.49 2w3r s GLN 572 Ca 0.00 -0.90 0.00 0.00 -1.95 0.00 0.00 55.36 52.51 2w3r s GLN 572 Cb 0.00 -1.45 -0.01 0.00 -0.22 0.00 0.00 33.01 31.33 2w3r s GLN 572 CO 0.00 0.37 -0.14 0.08 -0.25 0.00 0.00 175.29 175.35 2w3r s VAL 573 N -0.77 2.90 -0.03 1.09 1.01 -0.57 -1.61 120.40 122.41 2w3r s VAL 573 Ca 0.07 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.38 2w3r s VAL 573 Cb -0.09 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 2w3r s VAL 573 CO 0.01 0.52 -0.13 -1.10 0.00 0.00 0.00 175.10 174.40 2w3r s GLN 574 N 0.54 1.40 -0.14 2.72 -0.21 0.89 -1.77 119.66 123.08 2w3r s GLN 574 Ca -0.09 -0.47 -0.29 0.00 0.02 0.00 0.00 55.36 54.53 2w3r s GLN 574 Cb -0.16 -1.25 0.10 0.00 1.00 0.00 0.00 33.01 32.70 2w3r s GLN 574 CO 0.04 0.18 0.84 0.00 -2.12 0.00 0.00 175.29 174.23 2w3r s ALA 575 N 0.11 -1.85 -1.47 6.09 0.00 -0.74 -0.36 121.76 123.53 2w3r s ALA 575 Ca -0.03 1.56 -0.08 0.00 0.00 0.00 0.00 51.96 53.41 2w3r s ALA 575 Cb -0.10 -0.56 0.06 0.00 0.00 0.00 0.00 23.12 22.52 2w3r s ALA 575 CO 0.01 -0.33 0.74 0.43 0.00 0.00 0.00 175.76 176.61 2w3r n SER 576 N 1.22 -2.49 -1.90 0.00 7.64 -1.26 -0.95 113.62 115.88 2w3r n SER 576 Ca -0.15 -0.89 -0.20 0.00 1.01 0.00 0.00 58.87 58.65 2w3r n SER 576 Cb 0.57 -3.52 -0.06 0.00 -1.01 0.00 0.00 64.21 60.19 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 -1.69 0.96 3.15 0.23 0.00 -1.26 -4.98 105.19 101.60 2w3r n GLY 577 Ca -0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 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 -4.22 1.26 0.03 1.61 1.02 -0.12 -5.15 119.74 114.17 2w3r s LYS 578 Ca 0.00 -0.63 0.08 0.00 0.02 0.00 0.00 55.97 55.45 2w3r s LYS 578 Cb 0.00 -1.24 -0.03 0.00 -0.52 0.00 0.00 37.83 36.05 2w3r s LYS 578 CO 0.00 0.33 -0.25 -1.54 -0.92 0.00 0.00 175.35 172.98 2w3r s SER 579 N -0.54 2.95 0.20 2.83 1.04 -1.26 -1.78 113.70 117.14 2w3r s SER 579 Ca 0.06 -0.54 0.02 0.00 0.48 0.00 0.00 55.95 55.97 2w3r s SER 579 Cb -0.07 -0.28 -0.05 0.00 0.10 0.00 0.00 66.02 65.73 2w3r s SER 579 CO -0.00 0.25 0.00 0.26 0.98 0.00 0.00 173.24 174.73 2w3r s TRP 580 N -0.75 1.34 0.61 5.02 0.51 -0.73 -5.00 118.94 119.93 2w3r s TRP 580 Ca 0.10 -1.00 -0.15 0.00 -2.12 0.00 0.00 56.10 52.94 2w3r s TRP 580 Cb -0.10 -0.77 -0.03 0.00 -0.81 0.00 0.00 33.47 31.77 2w3r s TRP 580 CO 0.01 -0.16 1.05 1.03 -0.51 0.00 0.00 176.95 178.37 2w3r s ARG 581 N -3.90 3.31 0.12 4.98 0.52 -1.26 -1.52 118.95 121.20 2w3r s ARG 581 Ca 0.26 1.12 -0.20 0.00 -0.52 0.00 0.00 55.73 56.39 2w3r s ARG 581 Cb 0.06 -2.04 -0.06 0.00 0.52 0.00 0.00 34.95 33.44 2w3r s ARG 581 CO 0.06 -0.81 1.73 0.35 0.02 0.00 0.00 175.30 176.66 2w3r h PHE 582 N 0.25 0.04 -0.69 -0.53 3.57 -1.78 -1.97 116.94 115.83 2w3r h PHE 582 Ca -0.46 0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.18 2w3r h PHE 582 Cb 1.21 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.92 2w3r h PHE 582 CO 0.60 0.01 0.46 0.00 -2.23 0.00 0.00 178.31 177.15 2w3r h ALA 583 N 1.12 2.08 -0.29 2.41 0.00 -1.86 -0.94 119.26 121.77 2w3r h ALA 583 Ca 0.07 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 583 Cb 0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2w3r h ALA 583 CO -0.11 -0.25 -0.43 0.93 0.00 0.00 0.00 179.25 179.40 2w3r h GLU 584 N 0.41 0.81 -0.36 0.00 5.08 -1.74 -0.59 114.58 118.18 2w3r h GLU 584 Ca 0.33 -0.48 -0.13 0.00 -1.00 0.00 0.00 59.36 58.08 2w3r h GLU 584 Cb 0.72 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2w3r h GLU 584 CO -0.10 1.11 -0.31 0.82 -1.00 0.00 0.00 179.01 179.53 2w3r h ILE 585 N 0.58 1.28 0.32 3.13 1.08 -0.83 -1.66 117.51 121.40 2w3r h ILE 585 Ca 0.03 -1.46 -0.02 0.00 -0.39 0.00 0.00 64.86 63.03 2w3r h ILE 585 Cb 1.02 1.33 0.00 0.00 -3.07 0.00 0.00 36.82 36.10 2w3r h ILE 585 CO 0.10 0.48 -0.15 0.58 -0.69 0.00 0.00 178.15 178.47 2w3r h VAL 586 N 0.67 0.71 -1.00 1.67 2.07 -1.15 -0.27 116.25 118.95 2w3r h VAL 586 Ca 0.07 -0.32 0.07 0.00 0.82 0.00 0.00 66.70 67.35 2w3r h VAL 586 Cb 0.85 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 31.43 2w3r h VAL 586 CO 0.07 0.07 0.64 0.00 0.02 0.00 0.00 177.57 178.37 2w3r h ALA 587 N 0.02 1.42 -0.56 1.67 0.00 -1.12 0.15 119.26 120.84 2w3r h ALA 587 Ca -0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2w3r h ALA 587 Cb 0.44 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2w3r h ALA 587 CO 0.07 0.42 0.18 0.00 0.00 0.00 0.00 179.25 179.91 2w3r h ALA 588 N 1.47 0.73 -0.13 0.00 0.00 -1.22 -2.78 119.26 117.32 2w3r h ALA 588 Ca 0.44 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 2w3r h ALA 588 Cb 0.20 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2w3r h ALA 588 CO -0.18 0.39 -0.36 0.00 0.00 0.00 0.00 179.25 179.10 2w3r h ALA 589 N 1.04 1.14 -0.51 0.00 0.00 0.20 -1.70 119.26 119.43 2w3r h ALA 589 Ca 0.18 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.72 2w3r h ALA 589 Cb 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2w3r h ALA 589 CO -0.01 0.56 0.33 -0.92 0.00 0.00 0.00 179.25 179.21 2w3r h TYR 590 N 0.24 0.62 -0.63 0.00 3.20 -0.63 -1.70 116.97 118.07 2w3r h TYR 590 Ca 0.03 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 2w3r h TYR 590 Cb 0.75 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 2w3r h TYR 590 CO 0.01 0.38 0.24 0.52 -1.64 0.00 0.00 178.16 177.68 2w3r h MET 591 N 0.67 0.92 0.00 1.82 2.86 -1.21 -1.53 114.93 118.46 2w3r h MET 591 Ca 0.19 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2w3r h MET 591 Cb -0.06 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.45 2w3r h MET 591 CO -0.05 0.76 0.00 0.00 1.06 0.00 0.00 176.91 178.68 2w3r h ALA 592 N 1.36 1.00 -4.31 6.32 0.00 -0.84 -3.47 119.26 119.31 2w3r h ALA 592 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2w3r h ALA 592 Cb 0.19 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.04 2w3r h ALA 592 CO -0.02 0.00 -0.25 0.54 0.00 0.00 0.00 179.25 179.52 2w3r n ARG 593 N -2.45 -0.99 -5.08 0.00 1.74 -0.57 -5.08 116.66 104.23 2w3r n ARG 593 Ca 0.01 0.74 -0.32 0.00 -0.77 0.00 0.00 57.85 57.51 2w3r n ARG 593 Cb 0.20 -3.85 -0.16 0.00 -1.02 0.00 0.00 32.46 27.64 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 -3.11 2.41 -0.01 0.55 1.01 -0.99 -5.05 121.20 116.01 2w3r s ILE 594 Ca 0.13 -0.91 -0.35 0.00 0.00 0.00 0.00 60.65 59.53 2w3r s ILE 594 Cb -0.02 -1.94 -0.13 0.00 0.01 0.00 0.00 42.46 40.38 2w3r s ILE 594 CO 0.41 0.55 1.73 -0.24 0.00 0.00 0.00 174.94 177.39 2w3r n SER 595 N 3.34 3.11 -1.45 3.58 2.88 -1.26 -4.69 113.62 119.14 2w3r n SER 595 Ca -0.18 1.03 -0.06 0.00 -1.33 0.00 0.00 58.87 58.32 2w3r n SER 595 Cb 0.53 -1.36 0.22 0.00 -0.75 0.00 0.00 64.21 62.85 2w3r n SER 595 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2w3r n LEU 596 N 5.18 4.89 -4.07 2.46 4.77 -1.26 -4.92 117.00 124.06 2w3r n LEU 596 Ca 0.21 -3.53 -0.26 0.00 -0.03 0.00 0.00 56.01 52.40 2w3r n LEU 596 Cb 0.27 -0.68 -0.17 0.00 -2.33 0.00 0.00 43.42 40.52 2w3r n LEU 596 CO 0.70 1.05 -0.49 -0.55 -1.33 0.00 0.00 177.39 176.77 2w3r s SER 597 N -1.97 2.03 -0.07 -1.43 0.15 -1.26 -1.94 113.70 109.21 2w3r s SER 597 Ca 0.48 -0.35 -0.18 0.00 0.70 0.00 0.00 55.95 56.61 2w3r s SER 597 Cb 0.41 -0.89 0.04 0.00 -1.71 0.00 0.00 66.02 63.87 2w3r s SER 597 CO 0.06 0.07 0.41 0.00 1.20 0.00 0.00 173.24 174.98 2w3r s ALA 598 N 0.53 -1.04 0.26 5.45 0.00 -1.03 -5.03 121.76 120.90 2w3r s ALA 598 Ca -0.14 0.78 0.06 0.00 0.00 0.00 0.00 51.96 52.65 2w3r s ALA 598 Cb -0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 2w3r s ALA 598 CO 0.04 -0.26 0.34 0.95 0.00 0.00 0.00 175.76 176.83 2w3r s THR 599 N -0.82 4.93 0.02 0.00 -4.23 -1.26 -0.67 115.64 113.61 2w3r s THR 599 Ca -0.09 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 2w3r s THR 599 Cb -0.04 -3.71 -0.01 0.00 1.34 0.00 0.00 72.50 70.08 2w3r s THR 599 CO 0.04 -0.31 -0.03 -0.83 -0.54 0.00 0.00 174.62 172.95 2w3r s GLY 600 N -3.98 0.19 -0.02 3.99 0.00 0.10 -4.07 107.32 103.54 2w3r s GLY 600 Ca 0.35 -0.42 -0.04 0.00 0.00 0.00 0.00 44.72 44.62 2w3r s GLY 600 CO 0.28 -0.46 0.09 -0.12 0.00 0.00 0.00 173.10 172.89 2w3r s PHE 601 N -0.97 -0.01 0.05 1.90 5.36 -1.25 -0.10 117.98 122.95 2w3r s PHE 601 Ca -0.10 0.03 0.03 0.00 -0.96 0.00 0.00 56.93 55.93 2w3r s PHE 601 Cb -0.07 -0.02 -0.03 0.00 -0.34 0.00 0.00 43.02 42.56 2w3r s PHE 601 CO -0.01 -0.14 -0.09 -0.47 -1.46 0.00 0.00 175.22 173.06 2w3r s TYR 602 N -0.58 0.76 -0.04 10.12 5.04 0.46 -4.67 117.35 128.43 2w3r s TYR 602 Ca -0.07 -0.51 -0.02 0.00 -2.44 0.00 0.00 57.07 54.03 2w3r s TYR 602 Cb -0.04 -0.45 0.03 0.00 0.35 0.00 0.00 41.96 41.85 2w3r s TYR 602 CO 0.00 -0.07 0.10 0.00 -1.34 0.00 0.00 175.55 174.25 2w3r s ALA 603 N -1.45 -0.17 -0.28 3.97 0.00 -1.26 -1.56 121.76 121.01 2w3r s ALA 603 Ca -0.08 0.45 -0.29 0.00 0.00 0.00 0.00 51.96 52.04 2w3r s ALA 603 Cb -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.73 2w3r s ALA 603 CO 0.00 -0.11 1.22 0.99 0.00 0.00 0.00 175.76 177.87 2w3r s THR 604 N 0.77 4.29 0.85 0.00 2.01 -0.85 -5.02 115.64 117.69 2w3r s THR 604 Ca -0.06 1.49 -0.12 0.00 0.31 0.00 0.00 61.69 63.31 2w3r s THR 604 Cb -0.08 -4.21 0.10 0.00 0.01 0.00 0.00 72.50 68.32 2w3r s THR 604 CO -0.03 -0.41 1.14 -2.16 -0.69 0.00 0.00 174.62 172.46 2w3r s PRO 605 N 3.87 1.61 0.00 4.92 0.04 -1.26 -4.31 135.00 139.88 2w3r s PRO 605 Ca 0.52 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.87 2w3r s PRO 605 Cb -0.16 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.49 2w3r s PRO 605 CO 0.19 -1.88 0.00 1.63 0.04 0.00 0.00 177.00 176.98 2w3r n LYS 606 N -3.55 0.00 -2.99 4.56 5.02 -1.26 -4.88 118.16 115.06 2w3r n LYS 606 Ca 0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 2w3r n LYS 606 Cb 0.59 -2.66 -0.05 0.00 -0.02 0.00 0.00 35.03 32.89 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 4.09 -0.29 -0.35 1.43 -1.26 -4.80 118.68 117.49 2w3r s LEU 607 Ca 0.00 0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 53.70 2w3r s LEU 607 Cb 0.00 -3.02 0.10 0.00 0.03 0.00 0.00 46.19 43.31 2w3r s LEU 607 CO 0.00 -0.51 0.69 -0.55 0.23 0.00 0.00 176.35 176.20 2w3r s SER 608 N 1.52 -1.01 -0.16 2.29 0.15 -0.17 -5.03 113.70 111.28 2w3r s SER 608 Ca 0.31 1.51 -0.29 0.00 0.70 0.00 0.00 55.95 58.18 2w3r s SER 608 Cb -0.15 1.77 0.09 0.00 -1.71 0.00 0.00 66.02 66.02 2w3r s SER 608 CO 0.10 -0.23 0.83 -1.66 1.20 0.00 0.00 173.24 173.48 2w3r s TRP 609 N 2.17 -0.58 -0.30 3.44 1.48 -1.26 0.52 118.94 124.41 2w3r s TRP 609 Ca -0.08 1.16 -0.19 0.00 -1.06 0.00 0.00 56.10 55.93 2w3r s TRP 609 Cb -0.08 0.39 -0.01 0.00 -1.16 0.00 0.00 33.47 32.60 2w3r s TRP 609 CO -0.19 -0.43 0.56 0.34 -4.06 0.00 0.00 176.95 173.17 2w3r s ASP 610 N -0.64 6.43 0.02 -2.66 3.68 0.23 -4.97 116.67 118.76 2w3r s ASP 610 Ca -0.04 0.33 -0.25 0.00 2.13 0.00 0.00 52.55 54.72 2w3r s ASP 610 Cb -0.02 -2.30 -0.18 0.00 -1.45 0.00 0.00 42.92 38.97 2w3r s ASP 610 CO 0.04 -0.42 1.44 -0.09 0.13 0.00 0.00 175.17 176.26 2w3r h ARG 611 N 8.22 -0.07 0.10 4.34 2.43 -1.97 -1.07 114.38 126.35 2w3r h ARG 611 Ca -0.28 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 2w3r h ARG 611 Cb 1.13 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2w3r h ARG 611 CO 0.77 0.21 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.32 2w3r h LEU 612 N -0.36 -0.12 -0.58 3.80 3.38 -1.98 -3.10 115.31 116.35 2w3r h LEU 612 Ca -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2w3r h LEU 612 Cb 0.32 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2w3r h LEU 612 CO 0.01 0.14 -0.10 0.03 0.09 0.00 0.00 178.44 178.61 2w3r h ARG 613 N -0.38 0.00 -3.72 1.13 3.08 -1.94 -3.46 114.38 109.09 2w3r h ARG 613 Ca -0.01 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 2w3r h ARG 613 Cb 0.32 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.44 2w3r h ARG 613 CO 0.02 0.10 -0.32 0.41 -1.07 0.00 0.00 179.97 179.12 2w3r n GLY 614 N 0.67 0.12 2.91 0.04 0.00 -0.45 -4.84 105.19 103.65 2w3r n GLY 614 Ca 0.02 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.95 0.08 0.00 1.61 -1.52 -0.96 -4.51 119.66 110.41 2w3r s GLN 615 Ca 0.10 0.30 0.00 0.00 -1.95 0.00 0.00 55.36 53.81 2w3r s GLN 615 Cb -0.01 -0.15 0.00 0.00 -0.22 0.00 0.00 33.01 32.63 2w3r s GLN 615 CO 0.28 -0.14 0.00 0.41 -0.25 0.00 0.00 175.29 175.59 2w3r n GLY 616 N 3.99 0.76 3.14 3.09 0.00 -1.06 0.74 105.19 115.85 2w3r n GLY 616 Ca -0.24 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 2w3r n GLY 616 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3r s ARG 617 N -1.17 2.19 0.23 1.61 3.52 0.19 -4.05 118.95 121.46 2w3r s ARG 617 Ca 0.00 -1.52 0.23 0.00 -0.13 0.00 0.00 55.73 54.31 2w3r s ARG 617 Cb 0.00 -3.33 0.14 0.00 -1.56 0.00 0.00 34.95 30.20 2w3r s ARG 617 CO 0.00 -0.81 1.20 -1.00 -0.81 0.00 0.00 175.30 173.88 2w3r h PRO 618 N 7.98 0.00 -6.25 5.12 0.13 -1.92 -0.44 132.00 136.62 2w3r h PRO 618 Ca -0.17 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.31 2w3r h PRO 618 Cb 1.05 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.88 2w3r h PRO 618 CO 0.59 0.00 -0.87 -0.06 -0.23 0.00 0.00 178.00 177.43 2w3r s PHE 619 N -3.29 2.10 0.13 1.56 0.40 -1.26 -4.69 117.98 112.93 2w3r s PHE 619 Ca 0.02 -0.42 -0.15 0.00 -0.60 0.00 0.00 56.93 55.77 2w3r s PHE 619 Cb 0.10 -1.36 -0.01 0.00 0.51 0.00 0.00 43.02 42.26 2w3r s PHE 619 CO 0.75 -0.06 1.64 1.25 0.70 0.00 0.00 175.22 179.51 2w3r h LEU 620 N 5.62 0.60 -8.31 -0.37 5.85 -1.77 -3.47 115.31 113.46 2w3r h LEU 620 Ca -0.40 -0.22 -0.18 0.00 0.84 0.00 0.00 57.88 57.92 2w3r h LEU 620 Cb 1.13 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 2w3r h LEU 620 CO 0.47 0.66 0.02 -0.72 -0.34 0.00 0.00 178.44 178.54 2w3r s TYR 621 N -5.35 0.69 0.01 1.25 -0.85 -1.26 -4.96 117.35 106.88 2w3r s TYR 621 Ca -0.13 -1.13 0.08 0.00 -0.52 0.00 0.00 57.07 55.37 2w3r s TYR 621 Cb 0.10 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.75 2w3r s TYR 621 CO 0.77 -1.36 -0.25 -0.06 -1.52 0.00 0.00 175.55 173.12 2w3r s PHE 622 N -2.58 2.20 0.15 -3.49 0.40 -1.26 -1.69 117.98 111.72 2w3r s PHE 622 Ca 0.24 -0.41 -0.04 0.00 -0.60 0.00 0.00 56.93 56.12 2w3r s PHE 622 Cb -0.03 -1.38 -0.05 0.00 0.51 0.00 0.00 43.02 42.07 2w3r s PHE 622 CO 0.17 0.02 0.38 0.00 0.70 0.00 0.00 175.22 176.49 2w3r s ALA 623 N -0.66 3.80 0.23 5.36 0.00 0.93 -4.92 121.76 126.50 2w3r s ALA 623 Ca 0.10 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.47 2w3r s ALA 623 Cb -0.10 -2.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.87 2w3r s ALA 623 CO 0.00 0.63 0.03 0.71 0.00 0.00 0.00 175.76 177.13 2w3r s TYR 624 N -1.70 1.47 0.00 0.00 1.51 -1.26 -1.51 117.35 115.85 2w3r s TYR 624 Ca 0.41 -1.03 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 2w3r s TYR 624 Cb -0.12 -0.85 0.00 0.00 -0.11 0.00 0.00 41.96 40.88 2w3r s TYR 624 CO 0.26 -0.18 0.00 0.41 -1.11 0.00 0.00 175.55 174.93 2w3r n GLY 625 N -0.39 1.21 3.22 0.71 0.00 -1.19 -0.92 105.19 107.83 2w3r n GLY 625 Ca -0.04 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.59 -0.02 4.61 0.00 -0.78 -0.50 121.76 122.47 2w3r s ALA 626 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 2w3r s ALA 626 Cb 0.00 0.27 0.01 0.00 0.00 0.00 0.00 23.12 23.40 2w3r s ALA 626 CO 0.00 -0.37 0.05 0.00 0.00 0.00 0.00 175.76 175.44 2w3r s ALA 627 N -2.34 -0.07 -0.19 0.00 0.00 -0.59 -2.37 121.76 116.20 2w3r s ALA 627 Ca -0.07 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.07 2w3r s ALA 627 Cb -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 2w3r s ALA 627 CO -0.02 -0.06 0.00 0.42 0.00 0.00 0.00 175.76 176.10 2w3r s ILE 628 N 0.42 4.03 0.01 0.00 1.01 -0.59 -1.44 121.20 124.64 2w3r s ILE 628 Ca -0.03 -0.29 0.08 0.00 0.00 0.00 0.00 60.65 60.40 2w3r s ILE 628 Cb -0.05 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 2w3r s ILE 628 CO -0.01 0.44 -0.23 -0.89 0.00 0.00 0.00 174.94 174.24 2w3r s THR 629 N 0.84 1.84 -0.05 2.92 2.01 -0.60 -1.47 115.64 121.13 2w3r s THR 629 Ca 0.01 -1.10 0.06 0.00 0.31 0.00 0.00 61.69 60.97 2w3r s THR 629 Cb -0.14 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.81 2w3r s THR 629 CO 0.02 0.42 -0.24 -0.70 -0.69 0.00 0.00 174.62 173.44 2w3r s GLU 630 N -0.79 2.32 0.16 4.92 2.12 -0.00 -2.14 118.70 125.28 2w3r s GLU 630 Ca 0.09 -0.85 0.03 0.00 0.36 0.00 0.00 54.97 54.61 2w3r s GLU 630 Cb -0.09 -2.01 -0.05 0.00 0.26 0.00 0.00 34.13 32.24 2w3r s GLU 630 CO 0.00 0.38 -0.06 0.14 -0.54 0.00 0.00 175.26 175.18 2w3r s VAL 631 N -0.20 0.98 -0.01 3.70 -7.23 -0.40 0.54 120.40 117.79 2w3r s VAL 631 Ca -0.01 -2.02 0.08 0.00 -1.81 0.00 0.00 61.98 58.21 2w3r s VAL 631 Cb -0.13 -1.95 -0.02 0.00 0.56 0.00 0.00 36.38 34.84 2w3r s VAL 631 CO 0.03 -0.65 -0.24 0.68 -0.31 0.00 0.00 175.10 174.60 2w3r s VAL 632 N -3.45 1.92 0.03 1.32 -7.23 -0.46 -1.83 120.40 110.69 2w3r s VAL 632 Ca 0.19 -1.08 0.05 0.00 -1.81 0.00 0.00 61.98 59.33 2w3r s VAL 632 Cb 0.04 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.36 2w3r s VAL 632 CO 0.02 0.50 -0.16 0.27 -0.31 0.00 0.00 175.10 175.42 2w3r s ILE 633 N -0.61 1.28 -0.22 -0.62 -4.36 -0.35 -1.69 121.20 114.63 2w3r s ILE 633 Ca 0.10 -0.95 -0.27 0.00 -0.26 0.00 0.00 60.65 59.27 2w3r s ILE 633 Cb -0.09 -1.12 -0.00 0.00 1.25 0.00 0.00 42.46 42.50 2w3r s ILE 633 CO -0.00 0.15 0.92 -0.62 0.24 0.00 0.00 174.94 175.62 2w3r s ASP 634 N -0.93 6.98 0.00 4.36 2.15 0.75 -2.23 116.67 127.74 2w3r s ASP 634 Ca 0.04 1.22 0.18 0.00 0.43 0.00 0.00 52.55 54.41 2w3r s ASP 634 Cb -0.08 -2.48 1.05 0.00 -0.30 0.00 0.00 42.92 41.11 2w3r s ASP 634 CO 0.01 -0.55 1.45 0.54 -0.17 0.00 0.00 175.17 176.45 2w3r n ARG 635 N 5.92 0.56 -0.05 4.34 1.74 0.98 -2.16 116.66 127.99 2w3r n ARG 635 Ca 0.08 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.07 2w3r n ARG 635 Cb 0.47 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.39 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 -0.99 1.76 -0.05 0.55 4.77 -1.26 -4.88 117.00 116.90 2w3r n LEU 636 Ca 0.13 0.05 -0.05 0.00 -0.03 0.00 0.00 56.01 56.10 2w3r n LEU 636 Cb 0.06 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 40.75 2w3r n LEU 636 CO 0.10 0.42 -0.83 0.35 -1.33 0.00 0.00 177.39 176.10 2w3r n THR 637 N -3.16 0.67 0.00 -5.08 -2.24 -1.24 -5.03 114.28 98.19 2w3r n THR 637 Ca -0.19 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 2w3r n THR 637 Cb 0.66 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 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 2.49 0.58 3.65 3.38 0.00 -0.92 -4.43 105.19 109.94 2w3r n GLY 638 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.39 1.40 -3.65 1.61 1.02 -1.26 -4.25 120.64 114.12 2w3r n GLU 639 Ca 0.00 0.51 -0.14 0.00 -0.02 0.00 0.00 57.16 57.51 2w3r n GLU 639 Cb 0.00 -2.22 -0.07 0.00 -0.02 0.00 0.00 31.44 29.14 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 -0.85 -0.34 -0.02 1.62 2.20 -1.26 -0.18 114.94 116.12 2w3r s ASN 640 Ca 0.67 0.14 0.00 0.00 -0.94 0.00 0.00 52.86 52.73 2w3r s ASN 640 Cb -0.49 0.43 0.02 0.00 -2.00 0.00 0.00 41.25 39.21 2w3r s ASN 640 CO 0.54 -0.62 0.01 -0.60 -2.94 0.00 0.00 177.10 173.48 2w3r s ARG 641 N -2.08 0.07 -0.15 3.55 3.52 -0.68 -4.99 118.95 118.19 2w3r s ARG 641 Ca -0.08 0.09 -0.29 0.00 -0.13 0.00 0.00 55.73 55.32 2w3r s ARG 641 Cb -0.02 -0.23 -0.02 0.00 -1.56 0.00 0.00 34.95 33.12 2w3r s ARG 641 CO 0.01 -0.10 1.31 0.42 -0.81 0.00 0.00 175.30 176.13 2w3r s ILE 642 N 0.68 4.19 -0.18 4.11 1.01 -1.26 -1.35 121.20 128.39 2w3r s ILE 642 Ca -0.06 1.44 -0.18 0.00 0.00 0.00 0.00 60.65 61.85 2w3r s ILE 642 Cb -0.09 -3.93 -0.15 0.00 0.01 0.00 0.00 42.46 38.30 2w3r s ILE 642 CO -0.02 -0.13 0.15 -0.07 0.00 0.00 0.00 174.94 174.88 2w3r h LEU 643 N 9.77 0.00 -7.59 2.97 3.38 -0.25 -3.28 115.31 120.31 2w3r h LEU 643 Ca -0.28 -0.40 -0.18 0.00 0.09 0.00 0.00 57.88 57.11 2w3r h LEU 643 Cb 1.11 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.61 2w3r h LEU 643 CO 0.97 1.24 -0.51 -0.60 0.09 0.00 0.00 178.44 179.63 2w3r s ARG 644 N -2.29 0.25 -0.04 1.13 3.52 -1.15 -1.16 118.95 119.20 2w3r s ARG 644 Ca -0.24 0.14 0.02 0.00 -0.13 0.00 0.00 55.73 55.52 2w3r s ARG 644 Cb 0.04 0.11 0.01 0.00 -1.56 0.00 0.00 34.95 33.55 2w3r s ARG 644 CO 0.49 -0.04 -0.09 0.99 -0.81 0.00 0.00 175.30 175.84 2w3r s THR 645 N -0.14 0.85 -0.15 4.11 2.01 0.10 -0.82 115.64 121.60 2w3r s THR 645 Ca -0.02 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 61.63 2w3r s THR 645 Cb -0.02 -0.78 0.02 0.00 0.01 0.00 0.00 72.50 71.73 2w3r s THR 645 CO 0.00 0.28 -0.17 -1.81 -0.69 0.00 0.00 174.62 172.23 2w3r s ASP 646 N 0.45 2.82 -0.06 3.53 1.01 -0.54 -0.88 116.67 122.99 2w3r s ASP 646 Ca -0.08 -0.53 0.05 0.00 0.71 0.00 0.00 52.55 52.70 2w3r s ASP 646 Cb -0.12 -1.28 -0.00 0.00 1.01 0.00 0.00 42.92 42.53 2w3r s ASP 646 CO 0.01 -0.01 -0.21 -0.63 0.21 0.00 0.00 175.17 174.54 2w3r s ILE 647 N 1.25 1.76 -0.24 0.77 1.01 0.11 -1.54 121.20 124.32 2w3r s ILE 647 Ca 0.01 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.79 2w3r s ILE 647 Cb -0.14 -1.51 0.06 0.00 0.01 0.00 0.00 42.46 40.88 2w3r s ILE 647 CO -0.08 0.49 -0.08 -0.22 0.00 0.00 0.00 174.94 175.05 2w3r s LEU 648 N 0.08 2.88 0.04 2.97 2.96 -1.00 -0.19 118.68 126.43 2w3r s LEU 648 Ca -0.08 -1.24 0.09 0.00 -0.22 0.00 0.00 54.13 52.68 2w3r s LEU 648 Cb -0.14 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.20 2w3r s LEU 648 CO 0.04 -0.21 -0.25 -2.28 -1.32 0.00 0.00 176.35 172.33 2w3r s HIS 649 N 1.28 2.21 -0.60 5.38 5.65 -0.34 -1.86 115.29 127.01 2w3r s HIS 649 Ca -0.07 -0.41 -0.19 0.00 0.25 0.00 0.00 55.06 54.64 2w3r s HIS 649 Cb -0.19 -1.33 0.10 0.00 -1.18 0.00 0.00 32.58 29.98 2w3r s HIS 649 CO -0.06 0.11 0.74 0.34 -0.65 0.00 0.00 174.74 175.22 2w3r s ASP 650 N -1.20 6.18 0.00 9.88 2.15 -0.10 0.36 116.67 133.95 2w3r s ASP 650 Ca 0.11 -1.36 0.21 0.00 0.43 0.00 0.00 52.55 51.94 2w3r s ASP 650 Cb -0.10 -2.32 0.54 0.00 -0.30 0.00 0.00 42.92 40.75 2w3r s ASP 650 CO 0.02 -1.16 1.45 0.00 -0.17 0.00 0.00 175.17 175.31 2w3r n ALA 651 N 6.53 2.45 -0.54 3.66 0.00 -1.26 -4.32 120.51 127.03 2w3r n ALA 651 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.53 2w3r n ALA 651 Cb 0.43 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 1.35 1.92 3.44 0.00 0.00 -1.26 -0.35 105.19 110.29 2w3r n GLY 652 Ca 0.18 -0.52 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 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 3.43 0.28 4.61 0.00 -0.01 -2.69 121.76 125.38 2w3r s ALA 653 Ca 0.00 -2.81 -0.28 0.00 0.00 0.00 0.00 51.96 48.88 2w3r s ALA 653 Cb 0.00 -3.99 -0.14 0.00 0.00 0.00 0.00 23.12 18.98 2w3r s ALA 653 CO 0.00 -2.91 0.93 0.45 0.00 0.00 0.00 175.76 174.23 2w3r n SER 654 N 6.32 0.88 0.05 0.00 2.88 -1.25 -3.42 113.62 119.08 2w3r n SER 654 Ca 0.22 1.16 -0.08 0.00 -1.33 0.00 0.00 58.87 58.84 2w3r n SER 654 Cb 0.49 -1.24 -0.13 0.00 -0.75 0.00 0.00 64.21 62.58 2w3r n SER 654 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2w3r h LEU 655 N 1.80 0.05 -6.05 2.46 3.38 -1.91 -3.36 115.31 111.68 2w3r h LEU 655 Ca -0.38 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 2w3r h LEU 655 Cb 1.36 -0.02 -0.21 0.00 0.09 0.00 0.00 40.66 41.87 2w3r h LEU 655 CO 0.60 1.05 -0.45 0.21 0.09 0.00 0.00 178.44 179.93 2w3r s ASN 656 N -6.68 -1.19 0.41 -0.43 3.84 -1.26 0.24 114.94 109.86 2w3r s ASN 656 Ca -0.01 -0.50 0.14 0.00 0.21 0.00 0.00 52.86 52.71 2w3r s ASN 656 Cb 0.09 1.80 1.00 0.00 -0.55 0.00 0.00 41.25 43.60 2w3r s ASN 656 CO 0.83 -0.23 1.89 -0.65 -2.79 0.00 0.00 177.10 176.14 2w3r h PRO 657 N 7.43 0.47 -0.39 0.43 0.11 -1.79 -1.88 132.00 136.38 2w3r h PRO 657 Ca 0.02 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.05 2w3r h PRO 657 Cb 1.17 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2w3r h PRO 657 CO 0.14 0.31 0.03 0.00 -0.21 0.00 0.00 178.00 178.27 2w3r h ALA 658 N 1.62 0.52 -0.03 -0.75 0.00 -1.86 -2.17 119.26 116.59 2w3r h ALA 658 Ca 0.41 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 2w3r h ALA 658 Cb 0.90 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2w3r h ALA 658 CO -0.16 0.26 -0.72 -0.07 0.00 0.00 0.00 179.25 178.57 2w3r h LEU 659 N 0.50 0.23 -0.26 0.00 3.38 -1.64 -2.62 115.31 114.89 2w3r h LEU 659 Ca 0.11 -0.15 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 2w3r h LEU 659 Cb 0.42 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2w3r h LEU 659 CO 0.01 0.86 -0.86 0.44 0.09 0.00 0.00 178.44 178.99 2w3r h ASP 660 N 0.13 0.50 -0.68 -0.43 5.19 -1.39 -0.33 116.42 119.41 2w3r h ASP 660 Ca -0.02 -0.37 -0.06 0.00 -0.62 0.00 0.00 57.03 55.96 2w3r h ASP 660 Cb 1.27 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 40.60 2w3r h ASP 660 CO 0.11 1.15 0.21 0.40 -3.12 0.00 0.00 179.24 177.98 2w3r h ILE 661 N 0.24 1.25 -0.54 0.35 1.08 -1.40 -1.09 117.51 117.40 2w3r h ILE 661 Ca -0.06 -0.88 -0.00 0.00 -0.39 0.00 0.00 64.86 63.53 2w3r h ILE 661 Cb 1.47 0.55 -0.03 0.00 -3.07 0.00 0.00 36.82 35.74 2w3r h ILE 661 CO 0.15 0.34 0.33 1.23 -0.69 0.00 0.00 178.15 179.51 2w3r h GLY 662 N 0.99 0.77 0.66 5.37 0.00 -1.29 0.74 103.07 110.32 2w3r h GLY 662 Ca 0.22 -0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.28 2w3r h GLY 662 CO -0.01 0.31 0.24 1.46 0.00 0.00 0.00 176.54 178.55 2w3r h GLN 663 N 0.72 0.46 -0.15 4.80 1.08 -0.85 -0.72 115.11 120.44 2w3r h GLN 663 Ca 0.19 -0.03 -0.06 0.00 -1.45 0.00 0.00 58.65 57.30 2w3r h GLN 663 Cb -0.03 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.30 2w3r h GLN 663 CO -0.04 0.30 -0.14 0.82 -0.95 0.00 0.00 178.83 178.83 2w3r h ILE 664 N 0.47 1.34 -0.72 2.54 2.04 -0.91 0.48 117.51 122.76 2w3r h ILE 664 Ca 0.24 -1.28 0.12 0.00 1.00 0.00 0.00 64.86 64.93 2w3r h ILE 664 Cb 0.18 1.84 -0.08 0.00 -0.74 0.00 0.00 36.82 38.01 2w3r h ILE 664 CO -0.18 0.38 0.30 -0.33 0.00 0.00 0.00 178.15 178.32 2w3r h GLU 665 N 0.01 0.46 -0.08 2.37 5.08 -0.77 -0.71 114.58 120.94 2w3r h GLU 665 Ca 0.03 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2w3r h GLU 665 Cb 0.66 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2w3r h GLU 665 CO 0.04 0.31 -0.11 0.78 -1.00 0.00 0.00 179.01 179.03 2w3r h GLY 666 N 0.48 0.23 1.60 -3.84 0.00 -1.01 -3.07 103.07 97.45 2w3r h GLY 666 Ca 0.38 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.40 2w3r h GLY 666 CO -0.35 0.23 -0.07 0.00 0.00 0.00 0.00 176.54 176.35 2w3r h ALA 667 N 0.53 1.31 -0.36 3.60 0.00 -0.70 -0.47 119.26 123.18 2w3r h ALA 667 Ca 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2w3r h ALA 667 Cb 0.65 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2w3r h ALA 667 CO 0.02 0.46 0.09 -0.92 0.00 0.00 0.00 179.25 178.91 2w3r h TYR 668 N 0.47 0.60 -0.37 0.00 3.20 -1.20 0.48 116.97 120.16 2w3r h TYR 668 Ca 0.09 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2w3r h TYR 668 Cb 0.42 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2w3r h TYR 668 CO 0.01 0.60 0.14 0.28 -1.64 0.00 0.00 178.16 177.56 2w3r h VAL 669 N 0.43 1.19 -0.04 1.81 2.07 -1.37 0.84 116.25 121.19 2w3r h VAL 669 Ca 0.11 -0.60 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 2w3r h VAL 669 Cb 0.30 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2w3r h VAL 669 CO 0.00 0.21 -0.35 -0.61 0.02 0.00 0.00 177.57 176.85 2w3r h GLN 670 N 0.45 0.08 -0.07 1.57 4.15 -1.01 0.10 115.11 120.37 2w3r h GLN 670 Ca 0.12 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.49 2w3r h GLN 670 Cb 0.20 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.88 2w3r h GLN 670 CO -0.01 0.42 -0.05 0.78 -1.93 0.00 0.00 178.83 178.04 2w3r h GLY 671 N 1.09 0.17 1.20 2.39 0.00 0.36 -2.79 103.07 105.50 2w3r h GLY 671 Ca 0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 2w3r h GLY 671 CO 0.05 0.15 -0.26 0.00 0.00 0.00 0.00 176.54 176.48 2w3r h ALA 672 N 0.58 0.73 -0.53 3.60 0.00 -0.79 -3.08 119.26 119.77 2w3r h ALA 672 Ca 0.01 -0.40 0.11 0.00 0.00 0.00 0.00 54.91 54.63 2w3r h ALA 672 Cb 0.54 -0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.09 2w3r h ALA 672 CO 0.01 0.66 -0.01 0.78 0.00 0.00 0.00 179.25 180.70 2w3r h GLY 673 N 0.89 0.54 -0.12 0.00 0.00 -1.03 -1.06 103.07 102.30 2w3r h GLY 673 Ca 0.09 0.08 0.25 0.00 0.00 0.00 0.00 47.33 47.75 2w3r h GLY 673 CO 0.07 -0.16 0.62 -0.25 0.00 0.00 0.00 176.54 176.82 2w3r h TRP 674 N 0.11 0.91 -0.35 5.60 7.01 -1.40 -2.37 115.95 125.46 2w3r h TRP 674 Ca 0.27 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.30 2w3r h TRP 674 Cb 0.42 -0.26 0.00 0.00 -2.10 0.00 0.00 29.16 27.22 2w3r h TRP 674 CO -0.34 0.08 0.00 1.28 -2.79 0.00 0.00 178.44 176.67 2w3r n LEU 675 N -4.79 4.15 0.00 0.65 4.77 -0.48 -4.60 117.00 116.70 2w3r n LEU 675 Ca 0.26 -2.85 0.00 0.00 -0.03 0.00 0.00 56.01 53.39 2w3r n LEU 675 Cb 0.77 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2w3r n LEU 675 CO 0.20 0.68 0.00 0.35 -1.33 0.00 0.00 177.39 177.29 2w3r n THR 676 N -0.09 0.00 0.08 -5.08 -2.24 -0.74 -1.10 114.28 105.12 2w3r n THR 676 Ca 0.22 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.07 2w3r n THR 676 Cb 0.89 -0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 69.10 2w3r n THR 676 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2w3r h THR 677 N 0.00 0.17 -3.17 4.28 1.35 -1.80 -2.70 112.91 111.03 2w3r h THR 677 Ca 0.00 -1.33 -0.57 0.00 -0.55 0.00 0.00 66.41 63.97 2w3r h THR 677 Cb 0.00 1.68 -0.05 0.00 -1.73 0.00 0.00 68.15 68.05 2w3r h THR 677 CO 0.00 0.09 0.99 -1.61 -0.25 0.00 0.00 175.52 174.75 2w3r s GLU 678 N -3.22 3.84 -0.06 4.72 2.02 -1.07 -4.39 118.70 120.55 2w3r s GLU 678 Ca -0.01 1.18 -0.02 0.00 0.02 0.00 0.00 54.97 56.14 2w3r s GLU 678 Cb 0.09 -3.91 0.04 0.00 0.10 0.00 0.00 34.13 30.45 2w3r s GLU 678 CO 0.80 -1.21 0.12 -2.00 0.02 0.00 0.00 175.26 172.98 2w3r s GLU 679 N 4.33 0.04 -0.16 1.61 2.12 -1.26 -4.68 118.70 120.70 2w3r s GLU 679 Ca 0.57 0.39 -0.13 0.00 0.36 0.00 0.00 54.97 56.16 2w3r s GLU 679 Cb -0.16 -0.24 -0.05 0.00 0.26 0.00 0.00 34.13 33.94 2w3r s GLU 679 CO 0.25 -0.22 0.27 -0.51 -0.54 0.00 0.00 175.26 174.51 2w3r s LEU 680 N 1.52 4.26 -0.09 2.70 1.43 -1.26 -4.84 118.68 122.40 2w3r s LEU 680 Ca -0.05 0.49 0.03 0.00 -1.03 0.00 0.00 54.13 53.56 2w3r s LEU 680 Cb -0.12 -2.33 0.01 0.00 0.03 0.00 0.00 46.19 43.78 2w3r s LEU 680 CO -0.05 0.13 -0.17 -0.69 0.23 0.00 0.00 176.35 175.81 2w3r s VAL 681 N 0.31 1.53 0.07 -1.59 1.01 -1.26 -4.99 120.40 115.48 2w3r s VAL 681 Ca 0.16 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.50 2w3r s VAL 681 Cb -0.13 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2w3r s VAL 681 CO 0.03 0.44 -0.09 0.26 0.00 0.00 0.00 175.10 175.75 2w3r s TRP 682 N 0.65 2.78 0.00 5.22 0.51 -1.26 0.47 118.94 127.31 2w3r s TRP 682 Ca -0.14 -0.12 0.00 0.00 -2.12 0.00 0.00 56.10 53.72 2w3r s TRP 682 Cb -0.16 -1.49 0.00 0.00 -0.81 0.00 0.00 33.47 31.01 2w3r s TRP 682 CO 0.04 0.40 0.00 -0.40 -0.51 0.00 0.00 176.95 176.48 2w3r n ASP 683 N 0.97 0.00 0.28 2.95 5.68 -0.90 -4.91 116.55 120.63 2w3r n ASP 683 Ca -0.14 -0.96 0.14 0.00 -0.50 0.00 0.00 54.79 53.33 2w3r n ASP 683 Cb 0.52 0.00 0.83 0.00 -1.14 0.00 0.00 41.12 41.33 2w3r n ASP 683 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2w3r h HIS 684 N -0.34 0.00 0.00 2.11 2.07 -2.01 -1.05 115.15 115.92 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 0.06 0.00 0.00 -3.07 0.00 0.00 177.93 174.92 2w3r n GLY 686 N 1.09 0.52 3.73 0.00 0.00 -0.40 -4.42 105.19 105.71 2w3r n GLY 686 Ca 0.04 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.28 4.56 -0.08 1.61 0.52 -1.26 -4.46 118.95 118.56 2w3r s ARG 687 Ca 0.00 1.23 -0.30 0.00 -0.52 0.00 0.00 55.73 56.15 2w3r s ARG 687 Cb 0.00 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 32.02 2w3r s ARG 687 CO 0.00 0.15 1.53 -1.17 0.02 0.00 0.00 175.30 175.83 2w3r s LEU 688 N 0.34 4.28 -0.03 2.53 2.96 -1.26 -2.11 118.68 125.38 2w3r s LEU 688 Ca 0.44 2.08 0.09 0.00 -0.22 0.00 0.00 54.13 56.52 2w3r s LEU 688 Cb -0.21 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.71 2w3r s LEU 688 CO 0.25 -0.87 0.70 -0.03 -1.32 0.00 0.00 176.35 175.08 2w3r h MET 689 N 9.07 0.04 -4.06 1.98 4.05 -0.34 -3.40 114.93 122.27 2w3r h MET 689 Ca -0.35 -0.07 -0.77 0.00 -0.28 0.00 0.00 59.70 58.23 2w3r h MET 689 Cb 1.16 0.03 -0.24 0.00 -0.80 0.00 0.00 31.60 31.74 2w3r h MET 689 CO 0.96 0.65 0.01 0.95 0.23 0.00 0.00 176.91 179.70 2w3r s THR 690 N -2.61 5.34 -0.03 -0.77 -4.23 -1.20 -4.83 115.64 107.32 2w3r s THR 690 Ca -0.06 -1.92 0.05 0.00 -1.18 0.00 0.00 61.69 58.58 2w3r s THR 690 Cb 0.08 -4.43 0.08 0.00 1.34 0.00 0.00 72.50 69.56 2w3r s THR 690 CO 0.82 -1.00 0.96 0.00 -0.54 0.00 0.00 174.62 174.87 2w3r n HIS 691 N 4.80 0.00 -3.91 3.99 1.44 -1.26 -4.79 115.22 115.49 2w3r n HIS 691 Ca 0.01 -0.30 -0.10 0.00 -2.01 0.00 0.00 57.72 55.32 2w3r n HIS 691 Cb 0.44 -0.07 -0.06 0.00 0.12 0.00 0.00 29.99 30.42 2w3r n HIS 691 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w3r s ALA 692 N -0.84 -0.22 -0.99 1.59 0.00 -1.26 -4.17 121.76 115.86 2w3r s ALA 692 Ca 0.08 -0.74 0.16 0.00 0.00 0.00 0.00 51.96 51.46 2w3r s ALA 692 Cb 0.07 0.87 0.67 0.00 0.00 0.00 0.00 23.12 24.74 2w3r s ALA 692 CO 0.01 -0.70 1.51 -2.30 0.00 0.00 0.00 175.76 174.28 2w3r n PRO 693 N -0.25 0.00 0.00 0.00 -0.02 -1.26 -1.13 135.00 132.33 2w3r n PRO 693 Ca -0.08 0.23 0.13 0.00 -2.02 0.00 0.00 63.50 61.77 2w3r n PRO 693 Cb 0.63 -1.51 0.46 0.00 -0.02 0.00 0.00 33.50 33.07 2w3r n PRO 693 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2w3r n SER 694 N -1.51 0.36 0.00 2.55 3.41 -1.26 -4.14 113.62 113.03 2w3r n SER 694 Ca 0.04 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2w3r n SER 694 Cb 0.18 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2w3r n SER 694 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2w3r n THR 695 N -1.32 0.00 -3.69 6.66 -2.24 -0.89 -4.96 114.28 107.84 2w3r n THR 695 Ca 0.09 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.50 2w3r n THR 695 Cb 0.32 -0.09 -0.12 0.00 -2.10 0.00 0.00 70.33 68.34 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 -1.76 3.16 -0.66 4.78 5.04 -0.29 -4.88 117.35 122.73 2w3r s TYR 696 Ca 0.00 -0.14 -0.04 0.00 -2.44 0.00 0.00 57.07 54.45 2w3r s TYR 696 Cb 0.00 -2.29 0.17 0.00 0.35 0.00 0.00 41.96 40.19 2w3r s TYR 696 CO 0.00 -0.23 0.49 0.15 -1.34 0.00 0.00 175.55 174.62 2w3r s LYS 697 N 1.60 2.73 0.79 4.97 3.01 -1.26 -4.49 119.74 127.10 2w3r s LYS 697 Ca 0.07 -2.55 -0.11 0.00 -1.01 0.00 0.00 55.97 52.36 2w3r s LYS 697 Cb -0.15 -3.83 0.07 0.00 -1.01 0.00 0.00 37.83 32.90 2w3r s LYS 697 CO 0.07 -1.19 1.09 0.96 0.51 0.00 0.00 175.35 176.78 2w3r s ILE 698 N -0.09 3.23 0.12 2.17 -4.36 -1.26 -3.41 121.20 117.60 2w3r s ILE 698 Ca 0.17 0.40 -0.31 0.00 -0.26 0.00 0.00 60.65 60.65 2w3r s ILE 698 Cb -0.19 -3.02 -0.10 0.00 1.25 0.00 0.00 42.46 40.40 2w3r s ILE 698 CO -0.04 -0.52 1.81 -2.84 0.24 0.00 0.00 174.94 173.59 2w3r s PRO 699 N -5.02 4.14 0.41 0.37 0.02 -1.26 -5.00 135.00 128.66 2w3r s PRO 699 Ca 0.61 2.57 0.00 0.00 0.02 0.00 0.00 61.00 64.20 2w3r s PRO 699 Cb -0.16 -3.59 -0.02 0.00 0.02 0.00 0.00 34.50 30.76 2w3r s PRO 699 CO 0.55 -0.83 0.63 0.00 -0.33 0.00 0.00 177.00 177.02 2w3r s ALA 700 N 2.72 3.74 0.09 -1.55 0.00 -1.26 -4.96 121.76 120.53 2w3r s ALA 700 Ca 0.80 -1.00 -0.17 0.00 0.00 0.00 0.00 51.96 51.59 2w3r s ALA 700 Cb -0.45 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 2w3r s ALA 700 CO 0.36 -0.24 0.99 0.34 0.00 0.00 0.00 175.76 177.21 2w3r n PHE 701 N -1.97 -0.24 0.32 0.00 7.35 -1.26 -0.21 117.46 121.46 2w3r n PHE 701 Ca -0.01 0.69 0.20 0.00 -0.76 0.00 0.00 57.45 57.57 2w3r n PHE 701 Cb 0.57 -0.51 1.10 0.00 0.35 0.00 0.00 39.48 40.99 2w3r n PHE 701 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2w3r h SER 702 N 0.00 0.00 0.48 -2.13 4.64 -2.03 -2.43 113.55 112.09 2w3r h SER 702 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2w3r h SER 702 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2w3r h SER 702 CO -0.52 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 175.89 2w3r h ASP 703 N 0.00 0.00 -3.65 4.97 3.32 -0.96 -3.45 116.42 116.65 2w3r h ASP 703 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2w3r h ASP 703 Cb 0.02 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.70 2w3r h ASP 703 CO 0.00 0.00 0.45 -2.11 -1.72 0.00 0.00 179.24 175.86 2w3r n ARG 704 N -2.46 1.68 -1.66 3.56 1.85 -0.92 -4.72 116.66 114.00 2w3r n ARG 704 Ca 0.00 0.61 -0.47 0.00 -1.00 0.00 0.00 57.85 56.99 2w3r n ARG 704 Cb 0.17 -2.38 -0.05 0.00 -1.05 0.00 0.00 32.46 29.15 2w3r n ARG 704 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2w3r n PRO 705 N -0.39 1.95 -0.30 2.89 -0.02 -1.26 -4.87 135.00 133.01 2w3r n PRO 705 Ca 0.09 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2w3r n PRO 705 Cb 0.42 -2.45 0.13 0.00 -0.02 0.00 0.00 33.50 31.58 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 5.91 0.89 -5.01 -0.52 2.47 -1.20 -3.34 114.38 113.58 2w3r h ARG 706 Ca -0.46 -0.05 -0.66 0.00 -1.26 0.00 0.00 59.98 57.55 2w3r h ARG 706 Cb 1.27 -0.20 -0.27 0.00 -1.65 0.00 0.00 29.97 29.12 2w3r h ARG 706 CO 0.87 0.59 -0.71 0.42 0.56 0.00 0.00 179.97 181.71 2w3r s ILE 707 N -6.07 3.53 -0.35 2.04 1.01 -0.34 -5.02 121.20 116.00 2w3r s ILE 707 Ca -0.13 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.09 2w3r s ILE 707 Cb 0.18 -2.61 0.11 0.00 0.01 0.00 0.00 42.46 40.15 2w3r s ILE 707 CO 0.78 0.42 0.11 0.12 0.00 0.00 0.00 174.94 176.37 2w3r s PHE 708 N 1.43 2.43 -0.29 3.97 5.99 -1.26 -0.72 117.98 129.53 2w3r s PHE 708 Ca 0.05 -2.28 -0.04 0.00 0.00 0.00 0.00 56.93 54.67 2w3r s PHE 708 Cb -0.14 -2.15 0.03 0.00 0.00 0.00 0.00 43.02 40.76 2w3r s PHE 708 CO -0.02 -0.88 0.02 -0.80 -0.00 0.00 0.00 175.22 173.54 2w3r s ASN 709 N 1.14 4.87 -0.12 6.13 0.01 -0.06 -5.02 114.94 121.90 2w3r s ASN 709 Ca 0.12 -1.02 0.02 0.00 -0.71 0.00 0.00 52.86 51.26 2w3r s ASN 709 Cb -0.19 -1.77 -0.01 0.00 0.41 0.00 0.00 41.25 39.69 2w3r s ASN 709 CO -0.15 -0.22 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.35 2w3r s VAL 710 N 1.35 2.66 -0.01 1.60 1.01 -1.26 0.03 120.40 125.79 2w3r s VAL 710 Ca -0.02 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2w3r s VAL 710 Cb -0.18 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.12 2w3r s VAL 710 CO -0.00 0.54 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 2w3r s ALA 711 N 0.31 0.44 0.11 5.51 0.00 0.74 -4.96 121.76 123.90 2w3r s ALA 711 Ca -0.13 -0.17 -0.20 0.00 0.00 0.00 0.00 51.96 51.45 2w3r s ALA 711 Cb -0.17 -0.16 -0.07 0.00 0.00 0.00 0.00 23.12 22.73 2w3r s ALA 711 CO 0.07 0.08 0.63 -0.51 0.00 0.00 0.00 175.76 176.02 2w3r s LEU 712 N 0.08 4.52 -0.86 0.00 1.43 -1.26 -1.20 118.68 121.38 2w3r s LEU 712 Ca -0.00 1.35 -0.19 0.00 -1.03 0.00 0.00 54.13 54.25 2w3r s LEU 712 Cb -0.04 -3.07 0.12 0.00 0.03 0.00 0.00 46.19 43.23 2w3r s LEU 712 CO -0.00 0.23 1.07 0.86 0.23 0.00 0.00 176.35 178.74 2w3r s TRP 713 N -1.18 3.04 -0.71 0.29 -0.11 0.16 -4.84 118.94 115.59 2w3r s TRP 713 Ca 0.32 -1.22 -0.26 0.00 1.22 0.00 0.00 56.10 56.15 2w3r s TRP 713 Cb -0.20 -4.27 0.04 0.00 -1.50 0.00 0.00 33.47 27.54 2w3r s TRP 713 CO 0.21 -1.50 1.22 0.34 -4.62 0.00 0.00 176.95 172.59 2w3r s ASP 714 N 3.63 6.20 -0.30 5.86 2.15 -1.26 -4.11 116.67 128.84 2w3r s ASP 714 Ca 0.30 -0.47 -0.12 0.00 0.43 0.00 0.00 52.55 52.69 2w3r s ASP 714 Cb -0.08 -2.54 0.13 0.00 -0.30 0.00 0.00 42.92 40.13 2w3r s ASP 714 CO -0.05 -1.73 0.74 -1.58 -0.17 0.00 0.00 175.17 172.37 2w3r s GLN 715 N 5.38 0.54 0.46 4.34 0.74 -1.09 -5.01 119.66 125.02 2w3r s GLN 715 Ca 0.34 1.24 -0.22 0.00 0.05 0.00 0.00 55.36 56.77 2w3r s GLN 715 Cb -0.09 0.62 -0.10 0.00 1.10 0.00 0.00 33.01 34.54 2w3r s GLN 715 CO 0.15 -0.17 0.87 -2.30 -0.55 0.00 0.00 175.29 173.30 2w3r n PRO 716 N 5.06 1.05 -2.14 1.67 -0.02 -1.26 -3.31 135.00 136.05 2w3r n PRO 716 Ca -0.13 0.38 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 2w3r n PRO 716 Cb 0.52 -1.93 -0.02 0.00 -0.02 0.00 0.00 33.50 32.05 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 -0.90 6.81 0.24 2.55 3.84 -0.66 -4.78 114.94 122.04 2w3r s ASN 717 Ca 0.66 2.61 -0.04 0.00 0.21 0.00 0.00 52.86 56.30 2w3r s ASN 717 Cb -0.53 -2.64 0.28 0.00 -0.55 0.00 0.00 41.25 37.81 2w3r s ASN 717 CO 0.55 -0.54 1.76 0.03 -2.79 0.00 0.00 177.10 176.12 2w3r h ARG 718 N 4.04 0.92 -6.80 0.43 3.08 -1.92 -3.44 114.38 110.70 2w3r h ARG 718 Ca -0.48 -0.22 -0.48 0.00 0.07 0.00 0.00 59.98 58.87 2w3r h ARG 718 Cb 1.22 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 2w3r h ARG 718 CO 0.70 0.86 0.17 -1.21 -1.07 0.00 0.00 179.97 179.41 2w3r s GLU 719 N -5.16 4.11 -1.34 0.04 0.41 -1.26 -4.96 118.70 110.54 2w3r s GLU 719 Ca -0.10 0.83 -0.16 0.00 -0.41 0.00 0.00 54.97 55.13 2w3r s GLU 719 Cb 0.15 -2.43 0.01 0.00 -1.78 0.00 0.00 34.13 30.08 2w3r s GLU 719 CO 0.82 0.14 2.15 0.39 -0.49 0.00 0.00 175.26 178.26 2w3r n GLU 720 N -0.29 2.65 -2.36 1.61 1.02 -1.26 -4.76 120.64 117.24 2w3r n GLU 720 Ca 0.04 -2.52 -0.25 0.00 -0.02 0.00 0.00 57.16 54.40 2w3r n GLU 720 Cb 0.53 -3.25 0.05 0.00 -0.02 0.00 0.00 31.44 28.75 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 3.65 2.87 -0.26 2.62 -4.23 -1.26 -4.96 115.64 114.07 2w3r s THR 721 Ca 0.49 -0.24 -0.38 0.00 -1.18 0.00 0.00 61.69 60.39 2w3r s THR 721 Cb 0.13 -3.18 -0.14 0.00 1.34 0.00 0.00 72.50 70.66 2w3r s THR 721 CO -0.04 -0.17 1.91 0.00 -0.54 0.00 0.00 174.62 175.77 2w3r n ILE 722 N -2.69 0.33 -4.34 2.99 0.13 -1.26 -1.43 119.36 113.09 2w3r n ILE 722 Ca 0.07 -0.12 -0.39 0.00 -1.10 0.00 0.00 62.75 61.21 2w3r n ILE 722 Cb 0.59 -1.48 -0.05 0.00 -0.84 0.00 0.00 39.64 37.87 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 6.98 -1.52 -2.58 9.51 3.01 -1.26 -1.31 117.46 130.28 2w3r n PHE 723 Ca 0.30 0.76 -0.11 0.00 1.01 0.00 0.00 57.45 59.41 2w3r n PHE 723 Cb 0.19 -2.55 -0.00 0.00 -0.01 0.00 0.00 39.48 37.11 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 -4.27 -2.52 -2.17 -1.08 5.12 -0.51 -4.64 116.66 106.59 2w3r n ARG 724 Ca 0.09 0.47 -0.28 0.00 -1.93 0.00 0.00 57.85 56.20 2w3r n ARG 724 Cb 0.48 -5.06 0.04 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 -2.12 5.38 0.15 0.55 1.04 -0.43 -0.83 113.70 117.44 2w3r s SER 725 Ca 0.05 0.83 0.11 0.00 0.48 0.00 0.00 55.95 57.42 2w3r s SER 725 Cb -0.03 -1.68 -0.04 0.00 0.10 0.00 0.00 66.02 64.37 2w3r s SER 725 CO 0.07 -1.28 -0.25 -0.54 0.98 0.00 0.00 173.24 172.22 2w3r s LYS 726 N -5.19 1.41 0.30 4.02 1.02 0.52 -4.74 119.74 117.08 2w3r s LYS 726 Ca 0.57 -1.40 -0.29 0.00 0.02 0.00 0.00 55.97 54.86 2w3r s LYS 726 Cb -0.11 -1.80 -0.10 0.00 -0.52 0.00 0.00 37.83 35.30 2w3r s LYS 726 CO 0.48 0.41 1.34 0.00 -0.92 0.00 0.00 175.35 176.66 2w3r s ALA 727 N -1.35 3.53 -0.00 5.17 0.00 -1.26 -4.74 121.76 123.11 2w3r s ALA 727 Ca 0.16 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.39 2w3r s ALA 727 Cb -0.09 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.53 2w3r s ALA 727 CO 0.07 -0.66 0.69 1.55 0.00 0.00 0.00 175.76 177.41 2w3r n VAL 728 N 1.37 0.38 -0.01 0.00 3.14 -1.26 -4.79 118.33 117.15 2w3r n VAL 728 Ca 0.02 -0.38 -0.13 0.00 -2.96 0.00 0.00 64.34 60.89 2w3r n VAL 728 Cb 0.41 0.81 -0.10 0.00 -1.06 0.00 0.00 33.84 33.90 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 0.02 0.00 7.55 0.00 -1.92 -3.41 103.07 105.31 2w3r h GLY 729 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 47.33 46.95 2w3r h GLY 729 CO 0.00 0.02 -2.23 1.18 0.00 0.00 0.00 176.54 175.50 2w3r n GLU 730 N -4.85 0.49 -0.31 4.80 1.02 -1.26 -4.74 120.64 115.79 2w3r n GLU 730 Ca -0.08 0.18 0.17 0.00 -0.02 0.00 0.00 57.16 57.41 2w3r n GLU 730 Cb 0.25 -1.34 0.35 0.00 -0.02 0.00 0.00 31.44 30.68 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 -0.53 0.14 0.00 3.49 0.11 -1.87 0.15 132.00 133.50 2w3r h PRO 731 Ca -0.54 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.56 2w3r h PRO 731 Cb 1.58 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.65 2w3r h PRO 731 CO -0.25 0.09 -0.01 -1.35 -0.21 0.00 0.00 178.00 176.27 2w3r h PRO 732 N 0.15 0.00 -0.97 1.05 0.11 -1.85 -2.52 132.00 127.96 2w3r h PRO 732 Ca 0.62 0.00 0.17 0.00 0.11 0.00 0.00 66.00 66.90 2w3r h PRO 732 Cb 1.35 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.37 2w3r h PRO 732 CO -0.73 0.01 0.61 0.35 -0.21 0.00 0.00 178.00 178.04 2w3r h PHE 733 N 0.00 0.98 0.00 0.65 3.57 -0.85 -1.21 116.94 120.08 2w3r h PHE 733 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2w3r h PHE 733 Cb 0.23 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2w3r h PHE 733 CO 0.00 0.29 0.00 -0.07 -2.23 0.00 0.00 178.31 176.30 2w3r h LEU 734 N 0.77 0.00 -1.40 0.59 4.07 -1.61 -1.81 115.31 115.92 2w3r h LEU 734 Ca 0.52 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.48 2w3r h LEU 734 Cb 0.80 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.54 2w3r h LEU 734 CO -0.29 0.00 0.00 -0.07 -1.08 0.00 0.00 178.44 177.00 2w3r h LEU 735 N 0.00 0.00 -1.02 1.67 3.38 -1.38 -2.46 115.31 115.50 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 0.00 0.00 1.23 0.09 0.00 0.00 178.44 179.76 2w3r h GLY 736 N 1.34 0.00 2.00 0.83 0.00 -1.49 -2.97 103.07 102.78 2w3r h GLY 736 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2w3r h GLY 736 CO 0.00 0.00 -0.25 -2.22 0.00 0.00 0.00 176.54 174.07 2w3r h ILE 737 N 0.00 1.13 0.00 2.60 2.04 -1.67 -2.38 117.51 119.24 2w3r h ILE 737 Ca 0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2w3r h ILE 737 Cb 0.24 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2w3r h ILE 737 CO 0.00 0.25 0.00 0.77 0.00 0.00 0.00 178.15 179.17 2w3r h SER 738 N 0.00 0.00 0.06 1.72 4.64 -1.76 -1.58 113.55 116.62 2w3r h SER 738 Ca -0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2w3r h SER 738 Cb 0.46 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.57 2w3r h SER 738 CO 0.03 0.00 -1.05 0.00 -0.87 0.00 0.00 176.83 174.94 2w3r h ALA 739 N 2.08 0.15 -0.29 5.18 0.00 -1.63 -1.77 119.26 122.98 2w3r h ALA 739 Ca 0.00 -0.71 -0.14 0.00 0.00 0.00 0.00 54.91 54.07 2w3r h ALA 739 Cb 0.37 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2w3r h ALA 739 CO 0.00 0.70 -0.38 0.35 0.00 0.00 0.00 179.25 179.93 2w3r h PHE 740 N 0.37 0.80 -0.02 0.00 3.57 -1.54 -1.57 116.94 118.55 2w3r h PHE 740 Ca -0.13 -0.23 -0.18 0.00 3.53 0.00 0.00 57.97 60.97 2w3r h PHE 740 Cb 1.70 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.26 2w3r h PHE 740 CO 0.10 0.95 -0.79 -0.07 -2.23 0.00 0.00 178.31 176.27 2w3r h LEU 741 N 0.56 0.25 -0.02 0.59 4.07 -1.35 -0.77 115.31 118.63 2w3r h LEU 741 Ca 0.05 -0.19 -0.00 0.00 0.08 0.00 0.00 57.88 57.82 2w3r h LEU 741 Cb 0.90 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.56 2w3r h LEU 741 CO 0.08 0.94 0.00 0.00 -1.08 0.00 0.00 178.44 178.38 2w3r h ALA 742 N 1.05 0.03 -0.66 1.53 0.00 -1.30 -0.61 119.26 119.31 2w3r h ALA 742 Ca -0.03 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.86 2w3r h ALA 742 Cb 1.38 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.07 2w3r h ALA 742 CO 0.12 -0.33 0.22 -0.07 0.00 0.00 0.00 179.25 179.19 2w3r h LEU 743 N -0.21 0.18 -0.39 0.00 4.07 -1.20 -0.13 115.31 117.62 2w3r h LEU 743 Ca 0.01 0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.06 2w3r h LEU 743 Cb 0.26 0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.08 2w3r h LEU 743 CO 0.00 0.09 0.22 -0.74 -1.08 0.00 0.00 178.44 176.93 2w3r h HIS 744 N 0.38 0.53 -0.74 1.13 -0.00 -1.07 -2.57 115.15 112.82 2w3r h HIS 744 Ca 0.35 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.75 2w3r h HIS 744 Cb 0.49 -0.17 -0.04 0.00 -0.00 0.00 0.00 27.41 27.68 2w3r h HIS 744 CO -0.19 0.40 0.49 0.22 -0.00 0.00 0.00 177.93 178.85 2w3r h ASP 745 N 0.50 0.76 -0.40 3.26 3.58 -0.10 -0.90 116.42 123.12 2w3r h ASP 745 Ca 0.14 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.52 2w3r h ASP 745 Cb 0.04 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 2w3r h ASP 745 CO -0.02 0.52 0.03 0.00 -2.88 0.00 0.00 179.24 176.88 2w3r h ALA 746 N 1.57 1.16 -0.03 -0.78 0.00 -0.80 -2.92 119.26 117.46 2w3r h ALA 746 Ca 0.30 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2w3r h ALA 746 Cb 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2w3r h ALA 746 CO -0.09 0.55 0.01 0.00 0.00 0.00 0.00 179.25 179.72 2w3r n ALA 748 N -2.22 1.21 1.34 0.00 0.00 -0.63 -1.00 120.51 119.21 2w3r n ALA 748 Ca -0.07 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.48 2w3r n ALA 748 Cb 0.14 -1.05 0.44 0.00 0.00 0.00 0.00 19.45 18.98 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 -1.42 2.54 0.49 0.00 0.00 -1.13 -4.06 120.51 116.94 2w3r n ALA 749 Ca 0.01 -0.49 0.08 0.00 0.00 0.00 0.00 53.44 53.04 2w3r n ALA 749 Cb 0.03 -1.12 -0.11 0.00 0.00 0.00 0.00 19.45 18.25 2w3r n ALA 749 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3r n GLY 751 N 1.44 0.22 0.01 0.00 0.00 -1.25 -4.45 105.19 101.16 2w3r n GLY 751 Ca 0.01 -0.88 0.15 0.00 0.00 0.00 0.00 46.02 45.30 2w3r n GLY 751 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2w3r n PRO 752 N -0.08 0.69 -3.49 1.61 -0.04 -1.23 -4.80 135.00 127.66 2w3r n PRO 752 Ca 0.00 -0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 2w3r n PRO 752 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 2w3r n PRO 752 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2w3r s HIS 753 N -2.32 3.67 -0.15 0.54 3.76 -1.16 -5.02 115.29 114.60 2w3r s HIS 753 Ca 0.37 0.96 -0.33 0.00 -0.15 0.00 0.00 55.06 55.91 2w3r s HIS 753 Cb 0.21 -2.28 -0.10 0.00 1.11 0.00 0.00 32.58 31.53 2w3r s HIS 753 CO 0.42 0.57 2.02 1.87 -0.85 0.00 0.00 174.74 178.77 2w3r n TRP 754 N 1.38 2.14 0.21 1.40 -0.00 -1.26 -4.04 117.44 117.27 2w3r n TRP 754 Ca -0.11 -0.02 0.07 0.00 -0.00 0.00 0.00 57.50 57.44 2w3r n TRP 754 Cb 0.52 -2.67 0.44 0.00 -0.00 0.00 0.00 31.31 29.60 2w3r n TRP 754 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 2w3r h PRO 755 N 11.20 0.00 -6.87 5.87 0.11 -1.88 -3.39 132.00 137.04 2w3r h PRO 755 Ca -0.43 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.14 2w3r h PRO 755 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2w3r h PRO 755 CO 0.96 0.30 -1.03 -3.47 -0.21 0.00 0.00 178.00 174.56 2w3r n ASP 756 N -3.64 -4.24 -4.76 -2.05 -0.08 -1.26 -4.34 116.55 96.18 2w3r n ASP 756 Ca -0.01 -1.12 -0.40 0.00 -1.51 0.00 0.00 54.79 51.75 2w3r n ASP 756 Cb 0.42 -1.52 -0.04 0.00 2.34 0.00 0.00 41.12 42.32 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 -6.25 4.51 0.33 -2.67 2.96 -1.26 -4.79 118.68 111.51 2w3r s LEU 757 Ca 0.26 2.35 0.07 0.00 -0.22 0.00 0.00 54.13 56.59 2w3r s LEU 757 Cb -0.14 -3.66 -0.03 0.00 0.50 0.00 0.00 46.19 42.86 2w3r s LEU 757 CO 0.91 -0.24 0.30 -1.10 -1.32 0.00 0.00 176.35 174.90 2w3r s GLN 758 N -1.57 2.77 -0.13 1.98 -1.52 -1.26 -4.93 119.66 115.00 2w3r s GLN 758 Ca 0.46 -1.26 -0.04 0.00 -1.95 0.00 0.00 55.36 52.57 2w3r s GLN 758 Cb -0.33 -2.51 -0.03 0.00 -0.22 0.00 0.00 33.01 29.91 2w3r s GLN 758 CO 0.43 0.11 0.02 0.00 -0.25 0.00 0.00 175.29 175.60 2w3r s ALA 759 N -2.28 3.28 0.45 6.09 0.00 -0.59 -2.95 121.76 125.75 2w3r s ALA 759 Ca 0.41 -0.78 -0.21 0.00 0.00 0.00 0.00 51.96 51.37 2w3r s ALA 759 Cb -0.06 -1.66 -0.09 0.00 0.00 0.00 0.00 23.12 21.31 2w3r s ALA 759 CO 0.27 0.38 1.01 -1.25 0.00 0.00 0.00 175.76 176.16 2w3r s PRO 760 N -0.21 4.03 -1.39 0.00 0.04 -1.26 -2.24 135.00 133.97 2w3r s PRO 760 Ca 0.06 1.30 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 2w3r s PRO 760 Cb -0.12 -2.22 0.08 0.00 0.04 0.00 0.00 34.50 32.27 2w3r s PRO 760 CO 0.02 -0.23 2.07 0.00 0.04 0.00 0.00 177.00 178.90 2w3r n ALA 761 N -0.66 5.22 -1.48 8.56 0.00 -0.26 -4.76 120.51 127.14 2w3r n ALA 761 Ca 0.08 -3.99 -0.31 0.00 0.00 0.00 0.00 53.44 49.22 2w3r n ALA 761 Cb 0.52 -3.40 0.07 0.00 0.00 0.00 0.00 19.45 16.64 2w3r n ALA 761 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3r s THR 762 N 2.61 3.69 0.32 0.00 -4.23 -1.02 -4.52 115.64 112.49 2w3r s THR 762 Ca 0.46 0.55 0.06 0.00 -1.18 0.00 0.00 61.69 61.58 2w3r s THR 762 Cb 0.11 -3.22 0.37 0.00 1.34 0.00 0.00 72.50 71.11 2w3r s THR 762 CO -0.05 -0.72 1.60 -0.65 -0.54 0.00 0.00 174.62 174.26 2w3r h PRO 763 N -0.90 0.07 0.24 3.99 0.11 -1.86 0.23 132.00 133.88 2w3r h PRO 763 Ca -0.44 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2w3r h PRO 763 Cb 1.23 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2w3r h PRO 763 CO 0.56 0.04 -0.12 1.49 -0.21 0.00 0.00 178.00 179.76 2w3r h GLU 764 N 0.07 -0.31 -0.47 1.05 4.81 -1.85 -1.32 114.58 116.55 2w3r h GLU 764 Ca 0.64 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.90 2w3r h GLU 764 Cb 1.41 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.84 2w3r h GLU 764 CO -0.81 -0.20 0.31 0.00 -0.73 0.00 0.00 179.01 177.58 2w3r h ALA 765 N 0.42 1.68 0.08 2.92 0.00 -1.01 -0.44 119.26 122.90 2w3r h ALA 765 Ca -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2w3r h ALA 765 Cb 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2w3r h ALA 765 CO 0.05 0.29 -0.04 0.28 0.00 0.00 0.00 179.25 179.84 2w3r h VAL 766 N 0.62 1.15 -0.61 0.00 2.07 -0.54 -2.40 116.25 116.54 2w3r h VAL 766 Ca 0.18 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2w3r h VAL 766 Cb -0.05 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2w3r h VAL 766 CO -0.04 0.21 0.40 0.25 0.02 0.00 0.00 177.57 178.41 2w3r h LEU 767 N -0.48 0.71 -0.28 2.57 5.85 -0.89 0.36 115.31 123.14 2w3r h LEU 767 Ca -0.01 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2w3r h LEU 767 Cb 0.41 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2w3r h LEU 767 CO 0.02 0.52 0.18 0.00 -0.34 0.00 0.00 178.44 178.81 2w3r h ALA 768 N 1.61 0.36 -0.14 1.25 0.00 -1.03 -0.92 119.26 120.38 2w3r h ALA 768 Ca 0.22 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2w3r h ALA 768 Cb -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2w3r h ALA 768 CO -0.05 -0.19 -0.45 0.00 0.00 0.00 0.00 179.25 178.56 2w3r h ALA 769 N 1.11 0.96 -0.32 0.00 0.00 -0.89 -1.95 119.26 118.17 2w3r h ALA 769 Ca 0.11 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.57 2w3r h ALA 769 Cb -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2w3r h ALA 769 CO -0.04 0.64 0.20 0.28 0.00 0.00 0.00 179.25 180.33 2w3r h VAL 770 N 0.28 1.06 -0.02 0.00 2.07 -0.70 -1.54 116.25 117.42 2w3r h VAL 770 Ca 0.02 -0.14 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 2w3r h VAL 770 Cb 0.91 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2w3r h VAL 770 CO 0.08 0.08 -0.50 0.03 0.02 0.00 0.00 177.57 177.27 2w3r h ARG 771 N 0.42 0.05 -0.19 1.57 3.08 -1.01 0.13 114.38 118.43 2w3r h ARG 771 Ca 0.12 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 2w3r h ARG 771 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2w3r h ARG 771 CO -0.04 0.54 -0.00 0.00 -1.07 0.00 0.00 179.97 179.40 2w3r h ARG 772 N 0.04 0.34 -0.68 0.04 3.08 -1.20 0.50 114.38 116.50 2w3r h ARG 772 Ca -0.00 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 2w3r h ARG 772 Cb 0.90 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 2w3r h ARG 772 CO 0.07 0.55 0.33 0.00 -1.07 0.00 0.00 179.97 179.85 2w3r h ALA 773 N 0.78 0.88 0.00 0.04 0.00 -1.04 -1.38 119.26 118.54 2w3r h ALA 773 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2w3r h ALA 773 Cb 0.40 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2w3r h ALA 773 CO 0.01 0.44 0.00 0.39 0.00 0.00 0.00 179.25 180.09 2w3r n GLU 774 N -4.45 0.05 -1.46 0.00 1.02 0.45 -3.01 120.64 113.24 2w3r n GLU 774 Ca 0.05 0.18 -0.09 0.00 -0.02 0.00 0.00 57.16 57.29 2w3r n GLU 774 Cb 0.13 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.02 2w3r n GLU 774 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3r n GLY 775 N 0.27 0.85 3.36 0.62 0.00 -0.26 -4.99 105.19 105.03 2w3r n GLY 775 Ca 0.05 -0.60 -0.45 0.00 0.00 0.00 0.00 46.02 45.02 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 -3.14 3.07 0.00 1.61 0.52 0.16 -5.00 118.95 116.18 2w3r s ARG 776 Ca 0.00 -1.48 0.00 0.00 -0.52 0.00 0.00 55.73 53.73 2w3r s ARG 776 Cb 0.00 -4.30 0.00 0.00 0.52 0.00 0.00 34.95 31.17 2w3r s ARG 776 CO 0.00 -1.49 0.00 0.00 0.02 0.00 0.00 175.30 173.83