#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3s n VAL 3 N 0.00 1.62 0.00 2.46 0.31 -1.23 -2.52 118.33 118.97 2w3s n VAL 3 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2w3s n VAL 3 Cb 0.00 -0.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 2w3s n VAL 3 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2w3s n GLY 4 N 1.88 2.64 3.83 2.92 0.00 0.36 -4.99 105.19 111.83 2w3s n GLY 4 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2w3s n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3s s LYS 5 N -0.16 3.63 -0.80 1.61 1.02 -1.05 -4.47 119.74 119.52 2w3s s LYS 5 Ca 0.00 1.01 -0.04 0.00 0.02 0.00 0.00 55.97 56.96 2w3s s LYS 5 Cb 0.00 -2.09 0.11 0.00 -0.52 0.00 0.00 37.83 35.33 2w3s s LYS 5 CO 0.00 -0.54 2.56 -0.35 -0.92 0.00 0.00 175.35 176.10 2w3s n PRO 6 N -1.98 3.32 -2.35 -1.68 -0.04 -1.26 -4.13 135.00 126.87 2w3s n PRO 6 Ca 0.07 -2.90 -0.34 0.00 -0.04 0.00 0.00 63.50 60.29 2w3s n PRO 6 Cb 0.54 -2.33 -0.02 0.00 -0.04 0.00 0.00 33.50 31.65 2w3s n PRO 6 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2w3s s LEU 7 N -2.38 3.73 0.81 1.53 1.43 -1.26 -4.79 118.68 117.74 2w3s s LEU 7 Ca 0.56 1.93 -0.12 0.00 -1.03 0.00 0.00 54.13 55.47 2w3s s LEU 7 Cb 0.31 -4.56 0.08 0.00 0.03 0.00 0.00 46.19 42.05 2w3s s LEU 7 CO -0.19 -0.97 1.16 -2.16 0.23 0.00 0.00 176.35 174.42 2w3s s PRO 8 N -3.49 1.96 0.36 1.29 0.04 -1.26 -4.74 135.00 129.16 2w3s s PRO 8 Ca 0.67 0.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.65 2w3s s PRO 8 Cb -0.17 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 2w3s s PRO 8 CO 0.26 -1.62 1.31 1.58 0.04 0.00 0.00 177.00 178.57 2w3s n HIS 9 N -3.35 2.34 0.06 0.56 -0.00 -1.26 -4.87 115.22 108.70 2w3s n HIS 9 Ca 0.08 0.53 0.21 0.00 -0.00 0.00 0.00 57.72 58.53 2w3s n HIS 9 Cb 0.60 -2.42 0.74 0.00 -0.00 0.00 0.00 29.99 28.90 2w3s n HIS 9 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 2w3s h ASP 10 N 2.50 0.00 -0.08 0.26 2.03 -1.92 -1.27 116.42 117.94 2w3s h ASP 10 Ca -0.47 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 55.80 2w3s h ASP 10 Cb 1.28 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.76 2w3s h ASP 10 CO 0.62 0.00 -0.20 -1.20 -1.03 0.00 0.00 179.24 177.43 2w3s n SER 11 N -3.79 2.29 -0.23 4.15 7.64 -1.26 -4.82 113.62 117.60 2w3s n SER 11 Ca 0.08 -3.49 -0.01 0.00 1.01 0.00 0.00 58.87 56.46 2w3s n SER 11 Cb 0.65 -0.51 0.19 0.00 -1.01 0.00 0.00 64.21 63.53 2w3s n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w3s h ALA 12 N 0.72 1.33 -0.21 -0.43 0.00 -1.59 0.50 119.26 119.58 2w3s h ALA 12 Ca 0.03 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 2w3s h ALA 12 Cb 1.15 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2w3s h ALA 12 CO 0.08 0.55 -0.50 -0.09 0.00 0.00 0.00 179.25 179.29 2w3s h ARG 13 N 1.03 0.71 -0.96 0.00 2.43 -1.88 -1.57 114.38 114.15 2w3s h ARG 13 Ca 0.26 -0.49 0.02 0.00 -0.81 0.00 0.00 59.98 58.96 2w3s h ARG 13 Cb 0.02 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 2w3s h ARG 13 CO -0.04 1.11 0.63 0.00 -1.51 0.00 0.00 179.97 180.16 2w3s h ALA 14 N 0.60 1.33 0.41 2.80 0.00 -1.75 -2.00 119.26 120.65 2w3s h ALA 14 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2w3s h ALA 14 Cb 1.12 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2w3s h ALA 14 CO 0.11 0.61 -0.22 0.45 0.00 0.00 0.00 179.25 180.20 2w3s h HIS 15 N 1.28 -0.58 -0.02 0.00 3.86 -0.00 0.06 115.15 119.74 2w3s h HIS 15 Ca 0.36 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.56 2w3s h HIS 15 Cb -0.11 0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2w3s h HIS 15 CO -0.00 -0.34 0.14 -0.24 0.86 0.00 0.00 177.93 178.34 2w3s h VAL 16 N -0.58 0.06 -0.27 2.45 3.04 -1.08 -0.44 116.25 119.42 2w3s h VAL 16 Ca -0.06 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 2w3s h VAL 16 Cb 0.45 0.87 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 2w3s h VAL 16 CO 0.07 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 176.98 2w3s n THR 17 N -3.10 0.61 -2.50 3.17 -2.24 -0.77 -4.99 114.28 104.47 2w3s n THR 17 Ca -0.02 -0.81 -0.15 0.00 -2.27 0.00 0.00 64.05 60.81 2w3s n THR 17 Cb 0.21 0.81 0.01 0.00 -2.10 0.00 0.00 70.33 69.25 2w3s n THR 17 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3s n GLY 18 N 0.77 -0.18 0.01 3.38 0.00 -0.17 -4.90 105.19 104.10 2w3s n GLY 18 Ca 0.12 -0.23 0.10 0.00 0.00 0.00 0.00 46.02 46.00 2w3s n GLY 18 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2w3s n GLN 19 N -2.64 0.60 -1.94 1.61 6.02 -0.15 -4.94 117.38 115.94 2w3s n GLN 19 Ca -0.13 -0.16 -0.42 0.00 -0.01 0.00 0.00 57.00 56.28 2w3s n GLN 19 Cb 0.61 -1.45 -0.03 0.00 1.02 0.00 0.00 30.24 30.39 2w3s n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2w3s s ALA 20 N -3.29 3.75 -0.17 -1.58 0.00 -0.27 -4.98 121.76 115.23 2w3s s ALA 20 Ca -0.06 1.38 -0.08 0.00 0.00 0.00 0.00 51.96 53.20 2w3s s ALA 20 Cb 0.12 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2w3s s ALA 20 CO 0.79 -0.78 0.08 1.03 0.00 0.00 0.00 175.76 176.88 2w3s s ARG 21 N 0.80 3.91 0.45 0.00 0.52 -1.26 -4.97 118.95 118.40 2w3s s ARG 21 Ca 0.68 -0.30 0.08 0.00 -0.52 0.00 0.00 55.73 55.67 2w3s s ARG 21 Cb -0.44 -3.23 0.02 0.00 0.52 0.00 0.00 34.95 31.83 2w3s s ARG 21 CO 0.34 0.36 0.60 0.71 0.02 0.00 0.00 175.30 177.32 2w3s s TYR 22 N 0.14 2.50 0.23 -0.53 1.51 -1.26 -4.81 117.35 115.13 2w3s s TYR 22 Ca 0.06 -0.48 -0.07 0.00 -1.01 0.00 0.00 57.07 55.57 2w3s s TYR 22 Cb -0.12 -2.32 0.37 0.00 -0.11 0.00 0.00 41.96 39.78 2w3s s TYR 22 CO 0.00 -0.54 1.73 1.25 -1.11 0.00 0.00 175.55 176.88 2w3s h LEU 23 N 0.58 0.21 -0.08 -1.29 6.46 -1.93 0.33 115.31 119.60 2w3s h LEU 23 Ca -0.38 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 2w3s h LEU 23 Cb 1.28 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.30 2w3s h LEU 23 CO 0.45 0.10 0.00 -0.67 -0.62 0.00 0.00 178.44 177.70 2w3s n ASP 24 N -5.02 0.06 0.09 1.25 4.64 -1.26 -2.28 116.55 114.02 2w3s n ASP 24 Ca 0.11 0.52 0.06 0.00 -1.38 0.00 0.00 54.79 54.10 2w3s n ASP 24 Cb 0.35 -0.53 -0.02 0.00 -1.04 0.00 0.00 41.12 39.88 2w3s n ASP 24 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2w3s h ASP 25 N 0.00 0.00 -2.04 1.67 3.32 -0.71 -3.47 116.42 115.19 2w3s h ASP 25 Ca 0.00 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.43 2w3s h ASP 25 Cb 0.18 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.78 2w3s h ASP 25 CO 0.00 0.30 0.81 0.18 -1.72 0.00 0.00 179.24 178.81 2w3s n LEU 26 N -2.87 2.83 -4.77 1.55 4.77 -0.97 -4.89 117.00 112.66 2w3s n LEU 26 Ca -0.03 1.06 -0.38 0.00 -0.03 0.00 0.00 56.01 56.63 2w3s n LEU 26 Cb 0.69 -1.34 -0.01 0.00 -2.33 0.00 0.00 43.42 40.43 2w3s n LEU 26 CO 0.41 -0.39 0.87 -2.16 -1.33 0.00 0.00 177.39 174.79 2w3s s PRO 27 N 1.79 3.94 0.26 3.23 0.04 -1.26 -5.02 135.00 137.98 2w3s s PRO 27 Ca 0.85 1.92 -0.07 0.00 0.04 0.00 0.00 61.00 63.74 2w3s s PRO 27 Cb -0.77 -2.63 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2w3s s PRO 27 CO 0.45 -0.44 0.38 0.00 0.04 0.00 0.00 177.00 177.44 2w3s s PRO 29 N -3.80 2.40 0.43 0.00 0.02 -1.26 -4.88 135.00 127.91 2w3s s PRO 29 Ca 0.29 1.83 0.24 0.00 0.02 0.00 0.00 61.00 63.37 2w3s s PRO 29 Cb 0.01 -1.86 0.73 0.00 0.02 0.00 0.00 34.50 33.41 2w3s s PRO 29 CO 0.13 -1.65 1.74 0.00 -0.33 0.00 0.00 177.00 176.89 2w3s h ALA 30 N 0.12 0.95 -0.08 -1.55 0.00 -2.01 -2.40 119.26 114.29 2w3s h ALA 30 Ca -0.49 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2w3s h ALA 30 Cb 1.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2w3s h ALA 30 CO 0.52 0.26 0.00 0.27 0.00 0.00 0.00 179.25 180.30 2w3s n ASN 31 N -3.27 0.91 -4.74 0.00 6.94 -1.26 -4.92 115.26 108.92 2w3s n ASN 31 Ca 0.01 -2.04 -0.41 0.00 -0.02 0.00 0.00 54.58 52.11 2w3s n ASN 31 Cb 0.48 -0.25 -0.02 0.00 -2.36 0.00 0.00 39.78 37.63 2w3s n ASN 31 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2w3s s THR 32 N -1.61 2.68 0.44 5.53 2.01 -0.91 -4.46 115.64 119.33 2w3s s THR 32 Ca 0.06 0.56 -0.00 0.00 0.31 0.00 0.00 61.69 62.62 2w3s s THR 32 Cb 0.04 -3.36 -0.01 0.00 0.01 0.00 0.00 72.50 69.18 2w3s s THR 32 CO 0.03 0.08 0.67 -0.76 -0.69 0.00 0.00 174.62 173.95 2w3s s LEU 33 N -0.11 3.68 -0.03 4.42 1.43 0.21 -4.88 118.68 123.41 2w3s s LEU 33 Ca 0.61 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 54.11 2w3s s LEU 33 Cb -0.42 -3.24 -0.00 0.00 0.03 0.00 0.00 46.19 42.56 2w3s s LEU 33 CO 0.41 -0.65 -0.15 -1.00 0.23 0.00 0.00 176.35 175.19 2w3s s HIS 34 N -2.55 1.44 0.18 0.29 3.76 -0.73 -0.83 115.29 116.85 2w3s s HIS 34 Ca 0.47 -0.38 0.09 0.00 -0.15 0.00 0.00 55.06 55.10 2w3s s HIS 34 Cb -0.10 -0.97 -0.04 0.00 1.11 0.00 0.00 32.58 32.57 2w3s s HIS 34 CO 0.38 -0.12 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.54 2w3s s LEU 35 N 0.01 2.95 0.03 0.89 1.43 -0.42 -0.91 118.68 122.67 2w3s s LEU 35 Ca -0.02 -0.59 -0.07 0.00 -1.03 0.00 0.00 54.13 52.43 2w3s s LEU 35 Cb -0.10 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 2w3s s LEU 35 CO 0.01 0.10 0.12 0.00 0.23 0.00 0.00 176.35 176.82 2w3s s ALA 36 N -1.70 -0.17 0.21 4.21 0.00 -0.39 -4.60 121.76 119.32 2w3s s ALA 36 Ca 0.25 -0.43 -0.09 0.00 0.00 0.00 0.00 51.96 51.68 2w3s s ALA 36 Cb -0.09 0.24 -0.07 0.00 0.00 0.00 0.00 23.12 23.20 2w3s s ALA 36 CO 0.15 -0.31 0.53 -0.06 0.00 0.00 0.00 175.76 176.06 2w3s s PHE 37 N -2.42 3.45 -0.19 0.00 2.99 -1.26 -0.80 117.98 119.74 2w3s s PHE 37 Ca -0.06 0.85 -0.11 0.00 0.00 0.00 0.00 56.93 57.61 2w3s s PHE 37 Cb -0.02 -2.24 -0.05 0.00 0.00 0.00 0.00 43.02 40.71 2w3s s PHE 37 CO -0.04 0.31 0.18 0.20 -0.00 0.00 0.00 175.22 175.87 2w3s s GLY 38 N -2.29 2.08 0.06 4.36 0.00 -0.50 -4.87 107.32 106.16 2w3s s GLY 38 Ca 0.45 -0.64 0.02 0.00 0.00 0.00 0.00 44.72 44.55 2w3s s GLY 38 CO 0.21 0.24 0.09 1.08 0.00 0.00 0.00 173.10 174.72 2w3s s LEU 39 N 0.45 3.87 0.19 0.66 1.43 -1.26 -0.86 118.68 123.16 2w3s s LEU 39 Ca 0.10 0.05 -0.31 0.00 -1.03 0.00 0.00 54.13 52.94 2w3s s LEU 39 Cb -0.12 -2.48 -0.10 0.00 0.03 0.00 0.00 46.19 43.53 2w3s s LEU 39 CO -0.00 0.19 1.47 -0.55 0.23 0.00 0.00 176.35 177.70 2w3s s SER 40 N -2.25 6.67 0.00 2.29 0.15 -0.31 -4.83 113.70 115.41 2w3s s SER 40 Ca 0.28 2.58 0.23 0.00 0.70 0.00 0.00 55.95 59.73 2w3s s SER 40 Cb -0.12 -2.60 0.51 0.00 -1.71 0.00 0.00 66.02 62.09 2w3s s SER 40 CO 0.21 -0.73 1.45 0.35 1.20 0.00 0.00 173.24 175.71 2w3s n THR 41 N 3.24 0.62 -4.87 6.45 -2.24 -1.26 -0.67 114.28 115.54 2w3s n THR 41 Ca 0.10 -0.78 -0.33 0.00 -2.27 0.00 0.00 64.05 60.78 2w3s n THR 41 Cb 0.40 0.78 -0.13 0.00 -2.10 0.00 0.00 70.33 69.28 2w3s n THR 41 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w3s s GLU 42 N -1.38 2.54 0.26 -0.78 0.41 -1.26 -4.90 118.70 113.59 2w3s s GLU 42 Ca 0.41 -0.69 0.06 0.00 -0.41 0.00 0.00 54.97 54.34 2w3s s GLU 42 Cb 0.23 -2.40 0.34 0.00 -1.78 0.00 0.00 34.13 30.52 2w3s s GLU 42 CO 0.31 0.61 1.62 0.00 -0.49 0.00 0.00 175.26 177.32 2w3s h ALA 43 N 5.38 0.96 -0.86 5.21 0.00 -1.83 -3.25 119.26 124.87 2w3s h ALA 43 Ca -0.46 -0.50 0.11 0.00 0.00 0.00 0.00 54.91 54.06 2w3s h ALA 43 Cb 1.16 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.65 2w3s h ALA 43 CO 0.51 0.69 -0.21 0.45 0.00 0.00 0.00 179.25 180.68 2w3s s SER 44 N -6.89 -1.24 0.10 0.00 0.15 -1.26 -2.55 113.70 102.01 2w3s s SER 44 Ca -0.04 0.62 -0.25 0.00 0.70 0.00 0.00 55.95 56.98 2w3s s SER 44 Cb 0.13 1.98 0.07 0.00 -1.71 0.00 0.00 66.02 66.49 2w3s s SER 44 CO 0.78 -0.23 0.64 0.00 1.20 0.00 0.00 173.24 175.63 2w3s s ALA 45 N 2.87 -1.66 0.11 5.45 0.00 -1.12 0.07 121.76 127.49 2w3s s ALA 45 Ca 0.16 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 2w3s s ALA 45 Cb -0.13 0.64 -0.07 0.00 0.00 0.00 0.00 23.12 23.57 2w3s s ALA 45 CO -0.20 -0.67 0.59 0.00 0.00 0.00 0.00 175.76 175.48 2w3s s ALA 46 N -3.11 3.56 -0.22 0.00 0.00 -0.57 -0.47 121.76 120.96 2w3s s ALA 46 Ca -0.01 0.03 -0.21 0.00 0.00 0.00 0.00 51.96 51.77 2w3s s ALA 46 Cb -0.01 -2.65 -0.02 0.00 0.00 0.00 0.00 23.12 20.44 2w3s s ALA 46 CO -0.07 0.40 0.64 0.42 0.00 0.00 0.00 175.76 177.15 2w3s s ILE 47 N -1.24 4.99 -0.25 0.00 1.01 0.21 0.41 121.20 126.34 2w3s s ILE 47 Ca 0.33 1.20 0.02 0.00 0.00 0.00 0.00 60.65 62.19 2w3s s ILE 47 Cb -0.18 -3.95 -0.16 0.00 0.01 0.00 0.00 42.46 38.17 2w3s s ILE 47 CO 0.20 0.07 -0.22 0.41 0.00 0.00 0.00 174.94 175.40 2w3s n THR 48 N 4.91 1.42 -3.94 2.92 -1.04 0.61 -4.84 114.28 114.32 2w3s n THR 48 Ca -0.01 -0.55 -0.10 0.00 -2.04 0.00 0.00 64.05 61.36 2w3s n THR 48 Cb 0.49 -1.38 -0.10 0.00 -1.82 0.00 0.00 70.33 67.52 2w3s n THR 48 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2w3s s GLY 49 N -6.40 0.17 -0.38 3.41 0.00 -1.12 -4.97 107.32 98.02 2w3s s GLY 49 Ca -0.33 -0.43 0.02 0.00 0.00 0.00 0.00 44.72 43.98 2w3s s GLY 49 CO 0.57 -0.54 0.33 -2.27 0.00 0.00 0.00 173.10 171.19 2w3s s LEU 50 N -1.55 0.62 -0.61 0.66 2.96 -1.26 -1.43 118.68 118.07 2w3s s LEU 50 Ca -0.14 -2.20 -0.24 0.00 -0.22 0.00 0.00 54.13 51.33 2w3s s LEU 50 Cb -0.08 0.03 0.05 0.00 0.50 0.00 0.00 46.19 46.69 2w3s s LEU 50 CO -0.01 -0.24 0.98 -0.62 -1.32 0.00 0.00 176.35 175.14 2w3s s ASP 51 N 0.91 6.26 -0.00 3.68 -1.08 0.85 -4.87 116.67 122.41 2w3s s ASP 51 Ca 0.22 -0.60 0.13 0.00 -0.52 0.00 0.00 52.55 51.78 2w3s s ASP 51 Cb -0.12 -2.44 0.37 0.00 -1.46 0.00 0.00 42.92 39.26 2w3s s ASP 51 CO -0.06 -1.36 1.30 0.18 0.52 0.00 0.00 175.17 175.76 2w3s n LEU 52 N 7.70 2.23 -0.08 -1.34 4.77 -1.26 -1.83 117.00 127.19 2w3s n LEU 52 Ca -0.00 -1.11 -0.15 0.00 -0.03 0.00 0.00 56.01 54.71 2w3s n LEU 52 Cb 0.47 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2w3s n LEU 52 CO 0.64 0.55 0.43 -0.08 -1.33 0.00 0.00 177.39 177.61 2w3s h GLU 53 N 2.42 0.89 0.00 3.23 4.57 -1.92 -1.72 114.58 122.05 2w3s h GLU 53 Ca 0.00 -0.57 -0.00 0.00 -1.18 0.00 0.00 59.36 57.61 2w3s h GLU 53 Cb 0.56 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.22 2w3s h GLU 53 CO 0.00 1.20 -0.02 -1.35 -1.18 0.00 0.00 179.01 177.66 2w3s h PRO 54 N 0.68 0.00 0.22 0.92 0.11 -1.80 -2.55 132.00 129.57 2w3s h PRO 54 Ca 0.01 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 2w3s h PRO 54 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2w3s h PRO 54 CO 0.12 0.02 -0.11 0.28 -0.21 0.00 0.00 178.00 178.11 2w3s h VAL 55 N 0.00 0.00 -1.36 3.15 2.07 -1.63 -3.02 116.25 115.46 2w3s h VAL 55 Ca -0.00 -0.30 0.40 0.00 0.82 0.00 0.00 66.70 67.61 2w3s h VAL 55 Cb 0.34 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.03 2w3s h VAL 55 CO 0.00 0.00 0.95 0.03 0.02 0.00 0.00 177.57 178.57 2w3s h ARG 56 N -0.60 0.08 0.00 1.57 3.08 -1.19 0.13 114.38 117.45 2w3s h ARG 56 Ca -0.03 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2w3s h ARG 56 Cb 0.23 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2w3s h ARG 56 CO 0.05 0.05 -0.56 0.39 -1.07 0.00 0.00 179.97 178.84 2w3s n GLU 57 N -4.31 0.27 -2.08 0.04 1.02 -0.97 -4.74 120.64 109.87 2w3s n GLU 57 Ca 0.32 0.09 -0.38 0.00 -0.02 0.00 0.00 57.16 57.18 2w3s n GLU 57 Cb 1.39 -1.68 0.01 0.00 -0.02 0.00 0.00 31.44 31.14 2w3s n GLU 57 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2w3s s SER 58 N -4.16 5.86 0.47 1.62 0.15 0.47 -4.93 113.70 113.17 2w3s s SER 58 Ca 0.07 2.49 -0.21 0.00 0.70 0.00 0.00 55.95 59.00 2w3s s SER 58 Cb 0.14 -2.62 -0.11 0.00 -1.71 0.00 0.00 66.02 61.71 2w3s s SER 58 CO 0.71 -1.14 0.52 -2.65 1.20 0.00 0.00 173.24 171.87 2w3s n PRO 59 N -0.64 0.55 -0.20 5.44 -0.02 -1.26 -2.96 135.00 135.91 2w3s n PRO 59 Ca 0.08 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2w3s n PRO 59 Cb 0.47 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 2w3s n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w3s n GLY 60 N 1.81 1.74 3.69 -1.23 0.00 -1.26 -4.87 105.19 105.06 2w3s n GLY 60 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2w3s n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w3s s VAL 61 N -2.54 4.85 -0.14 1.61 1.01 -1.16 -1.34 120.40 122.69 2w3s s VAL 61 Ca 0.00 1.84 0.17 0.00 0.00 0.00 0.00 61.98 63.99 2w3s s VAL 61 Cb 0.00 -4.22 -0.24 0.00 0.00 0.00 0.00 36.38 31.91 2w3s s VAL 61 CO 0.00 0.05 0.16 -0.38 0.00 0.00 0.00 175.10 174.93 2w3s n ILE 62 N 4.50 0.89 -3.53 2.22 2.08 0.70 -4.97 119.36 121.25 2w3s n ILE 62 Ca 0.06 -0.67 -0.09 0.00 0.56 0.00 0.00 62.75 62.60 2w3s n ILE 62 Cb 0.49 -0.36 -0.03 0.00 -0.75 0.00 0.00 39.64 38.99 2w3s n ILE 62 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2w3s s ALA 63 N -2.69 -1.86 -0.01 -1.39 0.00 -1.06 -5.03 121.76 109.72 2w3s s ALA 63 Ca -0.08 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2w3s s ALA 63 Cb 0.07 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.26 2w3s s ALA 63 CO 0.76 -0.56 0.02 0.08 0.00 0.00 0.00 175.76 176.06 2w3s s VAL 64 N -2.43 -0.03 0.10 0.00 1.01 -1.26 -1.25 120.40 116.53 2w3s s VAL 64 Ca 0.03 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.24 2w3s s VAL 64 Cb -0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.27 2w3s s VAL 64 CO -0.05 0.07 -0.22 -0.36 0.00 0.00 0.00 175.10 174.54 2w3s s PHE 65 N 0.76 1.87 0.25 5.22 0.40 0.11 -4.92 117.98 121.67 2w3s s PHE 65 Ca -0.06 -0.41 0.04 0.00 -0.60 0.00 0.00 56.93 55.90 2w3s s PHE 65 Cb -0.09 -1.04 -0.05 0.00 0.51 0.00 0.00 43.02 42.35 2w3s s PHE 65 CO -0.02 0.21 0.01 0.99 0.70 0.00 0.00 175.22 177.10 2w3s s THR 66 N -1.09 1.10 0.46 0.64 2.01 -1.26 -0.87 115.64 116.63 2w3s s THR 66 Ca 0.08 -2.04 0.14 0.00 0.31 0.00 0.00 61.69 60.18 2w3s s THR 66 Cb -0.10 -2.45 0.30 0.00 0.01 0.00 0.00 72.50 70.26 2w3s s THR 66 CO 0.04 -0.24 2.06 0.00 -0.69 0.00 0.00 174.62 175.78 2w3s h ALA 67 N 2.38 1.97 0.00 7.40 0.00 -1.80 0.25 119.26 129.46 2w3s h ALA 67 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2w3s h ALA 67 Cb 1.23 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2w3s h ALA 67 CO 0.65 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.88 2w3s n ALA 68 N -2.52 2.31 1.08 0.00 0.00 -1.26 -2.48 120.51 117.64 2w3s n ALA 68 Ca 0.04 -0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2w3s n ALA 68 Cb 0.22 -1.45 0.12 0.00 0.00 0.00 0.00 19.45 18.34 2w3s n ALA 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2w3s n ASP 69 N -1.40 1.82 -4.57 0.00 8.00 0.87 -4.88 116.55 116.39 2w3s n ASP 69 Ca 0.10 -1.38 -0.43 0.00 0.71 0.00 0.00 54.79 53.78 2w3s n ASP 69 Cb 0.28 0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 41.69 2w3s n ASP 69 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2w3s s LEU 70 N -2.44 3.89 0.29 0.64 1.43 -1.03 -4.86 118.68 116.59 2w3s s LEU 70 Ca 0.21 0.10 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2w3s s LEU 70 Cb 0.19 -3.19 0.72 0.00 0.03 0.00 0.00 46.19 43.93 2w3s s LEU 70 CO 0.54 -1.17 1.71 1.55 0.23 0.00 0.00 176.35 179.21 2w3s h PRO 71 N 9.21 0.46 0.00 1.29 0.13 -1.90 -3.44 132.00 137.75 2w3s h PRO 71 Ca -0.24 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2w3s h PRO 71 Cb 1.07 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.10 2w3s h PRO 71 CO 1.08 0.30 0.00 0.72 -0.23 0.00 0.00 178.00 179.87 2w3s n HIS 72 N -4.99 0.00 -2.15 1.56 8.25 -1.23 -5.04 115.22 111.63 2w3s n HIS 72 Ca 0.22 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.27 2w3s n HIS 72 Cb 0.63 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.71 2w3s n HIS 72 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2w3s s ASP 73 N 1.00 6.82 -0.86 0.41 1.01 -1.02 -4.99 116.67 119.04 2w3s s ASP 73 Ca 0.00 2.52 -0.05 0.00 0.71 0.00 0.00 52.55 55.74 2w3s s ASP 73 Cb 0.00 -2.62 0.21 0.00 1.01 0.00 0.00 42.92 41.52 2w3s s ASP 73 CO 0.00 -0.56 0.75 0.21 0.21 0.00 0.00 175.17 175.78 2w3s s ASN 74 N 0.13 6.10 -0.30 0.27 2.47 -1.26 -4.44 114.94 117.91 2w3s s ASN 74 Ca 0.55 -3.38 -0.03 0.00 0.42 0.00 0.00 52.86 50.42 2w3s s ASN 74 Cb -0.38 -1.98 0.19 0.00 -1.45 0.00 0.00 41.25 37.63 2w3s s ASN 74 CO 0.43 -0.29 0.75 -0.62 -3.72 0.00 0.00 177.10 173.65 2w3s s ASP 75 N 0.53 -1.13 0.00 -4.21 2.15 -1.25 -3.98 116.67 108.78 2w3s s ASP 75 Ca 0.24 0.47 0.24 0.00 0.43 0.00 0.00 52.55 53.93 2w3s s ASP 75 Cb -0.11 1.85 0.45 0.00 -0.30 0.00 0.00 42.92 44.81 2w3s s ASP 75 CO -0.09 -0.21 1.40 0.00 -0.17 0.00 0.00 175.17 176.10 2w3s n ALA 76 N 5.40 2.47 -2.24 3.66 0.00 -0.25 -4.92 120.51 124.63 2w3s n ALA 76 Ca 0.01 -0.75 -0.42 0.00 0.00 0.00 0.00 53.44 52.28 2w3s n ALA 76 Cb 0.53 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 2w3s n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3s s SER 77 N -1.77 6.85 0.00 0.00 0.15 -1.25 -4.82 113.70 112.85 2w3s s SER 77 Ca 0.34 2.06 0.18 0.00 0.70 0.00 0.00 55.95 59.22 2w3s s SER 77 Cb 0.21 -2.55 0.82 0.00 -1.71 0.00 0.00 66.02 62.79 2w3s s SER 77 CO 0.31 -0.74 1.55 -0.81 1.20 0.00 0.00 173.24 174.75 2w3s n PRO 78 N 5.71 0.13 -2.90 5.44 -0.04 -1.26 -4.79 135.00 137.29 2w3s n PRO 78 Ca 0.14 0.16 -0.19 0.00 -0.04 0.00 0.00 63.50 63.57 2w3s n PRO 78 Cb 0.44 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.42 2w3s n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3s s ALA 79 N -2.79 4.35 0.11 0.55 0.00 -1.26 -5.00 121.76 117.72 2w3s s ALA 79 Ca 0.13 -1.62 -0.19 0.00 0.00 0.00 0.00 51.96 50.28 2w3s s ALA 79 Cb 0.12 -1.75 -0.07 0.00 0.00 0.00 0.00 23.12 21.42 2w3s s ALA 79 CO 0.30 -0.49 1.68 -1.35 0.00 0.00 0.00 175.76 175.89 2w3s h PRO 80 N 0.41 0.34 -6.87 0.00 0.11 -1.92 -3.45 132.00 120.61 2w3s h PRO 80 Ca -0.40 -0.05 -0.49 0.00 0.11 0.00 0.00 66.00 65.17 2w3s h PRO 80 Cb 1.28 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.34 2w3s h PRO 80 CO 0.46 0.34 0.14 -1.54 -0.21 0.00 0.00 178.00 177.19 2w3s s SER 81 N -5.58 6.53 0.16 -2.05 1.04 -1.26 -5.03 113.70 107.51 2w3s s SER 81 Ca -0.13 1.16 -0.10 0.00 0.48 0.00 0.00 55.95 57.35 2w3s s SER 81 Cb 0.08 -2.34 -0.07 0.00 0.10 0.00 0.00 66.02 63.79 2w3s s SER 81 CO 0.71 -0.41 0.09 -2.65 0.98 0.00 0.00 173.24 171.95 2w3s n PRO 82 N -1.32 0.00 -3.15 4.02 -0.02 -1.26 -4.84 135.00 128.42 2w3s n PRO 82 Ca 0.03 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.55 2w3s n PRO 82 Cb 0.54 -0.46 -0.00 0.00 -0.02 0.00 0.00 33.50 33.56 2w3s n PRO 82 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2w3s s GLU 83 N -0.46 0.55 0.57 -0.52 2.12 -1.26 -4.88 118.70 114.82 2w3s s GLU 83 Ca 0.28 0.60 -0.19 0.00 0.36 0.00 0.00 54.97 56.02 2w3s s GLU 83 Cb -0.32 0.29 -0.05 0.00 0.26 0.00 0.00 34.13 34.31 2w3s s GLU 83 CO 0.28 -0.96 1.17 -1.25 -0.54 0.00 0.00 175.26 173.96 2w3s s PRO 84 N 2.84 3.17 -0.11 4.30 0.04 -1.26 -1.09 135.00 142.90 2w3s s PRO 84 Ca 0.12 1.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.62 2w3s s PRO 84 Cb -0.11 -1.97 -0.26 0.00 0.04 0.00 0.00 34.50 32.20 2w3s s PRO 84 CO -0.25 -1.02 0.85 0.28 0.04 0.00 0.00 177.00 176.89 2w3s h VAL 85 N 1.06 1.69 -3.36 -0.36 2.07 -1.92 -3.43 116.25 112.00 2w3s h VAL 85 Ca -0.50 -2.28 -0.65 0.00 0.82 0.00 0.00 66.70 64.09 2w3s h VAL 85 Cb 1.28 3.22 -0.21 0.00 -1.52 0.00 0.00 31.29 34.06 2w3s h VAL 85 CO 0.56 0.61 -0.67 -0.76 0.02 0.00 0.00 177.57 177.32 2w3s s LEU 86 N -8.24 3.23 -0.05 2.57 1.43 -1.26 -4.57 118.68 111.78 2w3s s LEU 86 Ca -0.17 -0.11 -0.39 0.00 -1.03 0.00 0.00 54.13 52.43 2w3s s LEU 86 Cb -0.02 -1.76 -0.17 0.00 0.03 0.00 0.00 46.19 44.27 2w3s s LEU 86 CO 0.72 0.21 1.39 0.00 0.23 0.00 0.00 176.35 178.91 2w3s n ALA 87 N 3.24 -1.34 -3.58 4.21 0.00 -0.23 -4.67 120.51 118.14 2w3s n ALA 87 Ca -0.18 0.50 -0.40 0.00 0.00 0.00 0.00 53.44 53.37 2w3s n ALA 87 Cb 0.53 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.87 2w3s n ALA 87 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3s s THR 88 N 1.22 4.41 0.00 0.00 -4.23 -1.26 -4.54 115.64 111.25 2w3s s THR 88 Ca 0.90 -2.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2w3s s THR 88 Cb -1.08 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 68.96 2w3s s THR 88 CO 0.55 -0.94 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 2w3s n GLY 89 N 3.58 2.68 3.44 3.99 0.00 -1.26 -4.93 105.19 112.70 2w3s n GLY 89 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 2w3s n GLY 89 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2w3s s GLU 90 N -0.03 1.46 0.09 1.61 -1.05 -1.26 0.67 118.70 120.18 2w3s s GLU 90 Ca 0.00 -1.43 0.07 0.00 -0.15 0.00 0.00 54.97 53.46 2w3s s GLU 90 Cb 0.00 0.40 -0.03 0.00 -0.44 0.00 0.00 34.13 34.05 2w3s s GLU 90 CO 0.00 -0.57 -0.18 0.14 0.95 0.00 0.00 175.26 175.60 2w3s s VAL 91 N -3.99 1.49 0.00 1.83 -7.23 0.38 -4.80 120.40 108.09 2w3s s VAL 91 Ca 0.29 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 2w3s s VAL 91 Cb 0.02 -1.37 0.00 0.00 0.56 0.00 0.00 36.38 35.59 2w3s s VAL 91 CO 0.11 -0.10 0.09 1.41 -0.31 0.00 0.00 175.10 176.31 2w3s n HIS 92 N 1.23 0.00 -3.44 2.82 -0.00 -1.26 -2.80 115.22 111.77 2w3s n HIS 92 Ca -0.20 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.41 2w3s n HIS 92 Cb 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.51 2w3s n HIS 92 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 2w3s s PHE 93 N -0.57 -0.51 -0.52 4.41 -0.12 -1.06 -4.26 117.98 115.37 2w3s s PHE 93 Ca 0.00 0.30 -0.28 0.00 -0.05 0.00 0.00 56.93 56.90 2w3s s PHE 93 Cb 0.00 0.56 0.02 0.00 -0.63 0.00 0.00 43.02 42.97 2w3s s PHE 93 CO 0.00 -0.81 1.26 0.08 -0.05 0.00 0.00 175.22 175.70 2w3s s VAL 94 N -3.66 4.01 0.00 -2.49 1.01 -1.23 -2.47 120.40 115.57 2w3s s VAL 94 Ca 0.02 0.96 0.00 0.00 0.00 0.00 0.00 61.98 62.96 2w3s s VAL 94 Cb -0.01 -4.54 0.00 0.00 0.00 0.00 0.00 36.38 31.83 2w3s s VAL 94 CO -0.12 -1.10 0.00 0.61 0.00 0.00 0.00 175.10 174.49 2w3s n GLY 95 N 5.04 1.25 3.68 4.51 0.00 0.15 -4.83 105.19 114.99 2w3s n GLY 95 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2w3s n GLY 95 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3s s GLN 96 N 0.00 4.20 0.28 1.61 0.74 -1.03 -4.47 119.66 120.98 2w3s s GLN 96 Ca 0.00 2.28 -0.30 0.00 0.05 0.00 0.00 55.36 57.39 2w3s s GLN 96 Cb 0.00 -3.72 -0.11 0.00 1.10 0.00 0.00 33.01 30.29 2w3s s GLN 96 CO 0.00 -0.76 1.50 -2.14 -0.55 0.00 0.00 175.29 173.34 2w3s s PRO 97 N 3.05 4.20 -0.14 1.67 0.02 -1.26 -1.17 135.00 141.37 2w3s s PRO 97 Ca 0.74 2.43 -0.07 0.00 0.02 0.00 0.00 61.00 64.11 2w3s s PRO 97 Cb -0.38 -3.07 -0.06 0.00 0.02 0.00 0.00 34.50 31.02 2w3s s PRO 97 CO 0.32 -0.51 -0.18 -0.89 -0.33 0.00 0.00 177.00 175.41 2w3s n ILE 98 N 2.14 0.79 -4.40 2.83 5.41 -0.04 -1.07 119.36 125.02 2w3s n ILE 98 Ca 0.07 -0.19 -0.23 0.00 1.00 0.00 0.00 62.75 63.40 2w3s n ILE 98 Cb 0.39 -1.70 -0.08 0.00 -0.71 0.00 0.00 39.64 37.54 2w3s n ILE 98 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 2w3s n PHE 99 N -3.65 -0.35 -3.73 1.39 1.16 -1.23 -3.98 117.46 107.09 2w3s n PHE 99 Ca -0.28 -2.78 -0.23 0.00 -1.87 0.00 0.00 57.45 52.29 2w3s n PHE 99 Cb 0.69 0.15 -0.17 0.00 -1.61 0.00 0.00 39.48 38.54 2w3s n PHE 99 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2w3s s LEU 100 N 0.00 0.51 -0.13 5.98 2.96 -0.05 -1.41 118.68 126.55 2w3s s LEU 100 Ca 0.31 -0.17 -0.14 0.00 -0.22 0.00 0.00 54.13 53.91 2w3s s LEU 100 Cb 0.02 -0.36 -0.05 0.00 0.50 0.00 0.00 46.19 46.30 2w3s s LEU 100 CO 0.22 -0.24 0.33 -0.69 -1.32 0.00 0.00 176.35 174.65 2w3s s VAL 101 N 2.03 5.27 -0.40 1.68 1.01 0.02 0.09 120.40 130.09 2w3s s VAL 101 Ca 0.04 0.63 -0.03 0.00 0.00 0.00 0.00 61.98 62.61 2w3s s VAL 101 Cb -0.13 -3.66 0.10 0.00 0.00 0.00 0.00 36.38 32.69 2w3s s VAL 101 CO -0.05 0.41 0.19 0.00 0.00 0.00 0.00 175.10 175.65 2w3s s ALA 102 N 0.23 3.14 0.00 5.51 0.00 -0.38 -1.26 121.76 129.00 2w3s s ALA 102 Ca 0.19 -2.43 0.00 0.00 0.00 0.00 0.00 51.96 49.72 2w3s s ALA 102 Cb -0.14 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.59 2w3s s ALA 102 CO 0.06 -1.74 0.00 0.00 0.00 0.00 0.00 175.76 174.08 2w3s n ALA 103 N 4.63 0.00 0.00 0.00 0.00 -0.09 -0.21 120.51 124.84 2w3s n ALA 103 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.51 2w3s n ALA 103 Cb 0.42 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.11 2w3s n ALA 103 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2w3s n THR 104 N -0.51 0.72 -3.49 0.00 -2.24 -0.45 -1.77 114.28 106.55 2w3s n THR 104 Ca 0.00 -0.86 -0.15 0.00 -2.27 0.00 0.00 64.05 60.77 2w3s n THR 104 Cb 0.00 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 68.95 2w3s n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2w3s s SER 105 N -1.22 -0.59 0.09 3.42 1.04 -1.26 -4.83 113.70 110.35 2w3s s SER 105 Ca 0.40 0.42 -0.33 0.00 0.48 0.00 0.00 55.95 56.92 2w3s s SER 105 Cb 0.22 0.53 -0.14 0.00 0.10 0.00 0.00 66.02 66.72 2w3s s SER 105 CO 0.30 -0.70 1.59 -0.74 0.98 0.00 0.00 173.24 174.67 2w3s h HIS 106 N 2.58 -1.15 -0.64 5.02 2.76 -1.92 -1.60 115.15 120.21 2w3s h HIS 106 Ca -0.28 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.00 2w3s h HIS 106 Cb 1.20 0.45 -0.11 0.00 1.55 0.00 0.00 27.41 30.50 2w3s h HIS 106 CO 0.32 -0.57 -0.41 0.00 -1.30 0.00 0.00 177.93 175.97 2w3s h ARG 107 N -0.84 -0.17 -0.71 5.26 2.47 -1.97 -0.63 114.38 117.79 2w3s h ARG 107 Ca -0.03 0.01 0.16 0.00 -1.26 0.00 0.00 59.98 58.85 2w3s h ARG 107 Cb 0.75 0.04 -0.12 0.00 -1.65 0.00 0.00 29.97 28.99 2w3s h ARG 107 CO -0.08 -0.11 -0.00 0.00 0.56 0.00 0.00 179.97 180.33 2w3s h ALA 108 N 0.79 0.71 -0.29 0.04 0.00 -1.88 0.93 119.26 119.57 2w3s h ALA 108 Ca 0.21 0.23 -0.12 0.00 0.00 0.00 0.00 54.91 55.22 2w3s h ALA 108 Cb 0.56 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2w3s h ALA 108 CO -0.73 -0.41 -0.30 0.00 0.00 0.00 0.00 179.25 177.81 2w3s h ALA 109 N 1.66 0.43 0.53 0.00 0.00 -0.14 -0.96 119.26 120.78 2w3s h ALA 109 Ca 0.38 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2w3s h ALA 109 Cb 0.65 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2w3s h ALA 109 CO -0.62 0.46 -0.30 0.00 0.00 0.00 0.00 179.25 178.79 2w3s h ARG 110 N 0.47 -0.75 -0.38 0.00 2.47 -0.82 -1.11 114.38 114.26 2w3s h ARG 110 Ca 0.05 0.05 0.08 0.00 -1.26 0.00 0.00 59.98 58.90 2w3s h ARG 110 Cb 0.88 0.17 -0.08 0.00 -1.65 0.00 0.00 29.97 29.29 2w3s h ARG 110 CO 0.07 -0.50 -0.13 0.82 0.56 0.00 0.00 179.97 180.79 2w3s h ILE 111 N -0.78 0.54 -0.02 2.04 2.04 -0.75 -1.04 117.51 119.55 2w3s h ILE 111 Ca -0.07 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2w3s h ILE 111 Cb 0.62 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2w3s h ILE 111 CO 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 178.15 178.05 2w3s h ALA 112 N 1.29 1.67 0.00 1.87 0.00 -1.04 -2.39 119.26 120.66 2w3s h ALA 112 Ca 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2w3s h ALA 112 Cb 0.34 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2w3s h ALA 112 CO -0.42 0.25 -0.04 0.00 0.00 0.00 0.00 179.25 179.04 2w3s h ALA 113 N 1.79 1.03 -0.01 0.00 0.00 0.14 -1.84 119.26 120.38 2w3s h ALA 113 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2w3s h ALA 113 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2w3s h ALA 113 CO 0.02 0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.86 2w3s n ARG 114 N -3.18 1.15 0.00 0.00 1.74 -0.90 -4.26 116.66 111.21 2w3s n ARG 114 Ca -0.00 -0.23 0.09 0.00 -0.77 0.00 0.00 57.85 56.94 2w3s n ARG 114 Cb 0.27 -1.46 0.05 0.00 -1.02 0.00 0.00 32.46 30.30 2w3s n ARG 114 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2w3s n LYS 115 N -0.69 1.56 -2.05 5.56 5.02 -0.69 -4.98 118.16 121.89 2w3s n LYS 115 Ca 0.21 -1.38 -0.38 0.00 -2.02 0.00 0.00 58.31 54.74 2w3s n LYS 115 Cb 0.16 -1.34 0.01 0.00 -0.02 0.00 0.00 35.03 33.84 2w3s n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2w3s s ALA 116 N -1.66 3.02 -0.27 7.82 0.00 -1.26 -4.34 121.76 125.07 2w3s s ALA 116 Ca 0.19 1.15 -0.10 0.00 0.00 0.00 0.00 51.96 53.21 2w3s s ALA 116 Cb 0.15 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2w3s s ALA 116 CO 0.29 -0.93 0.16 1.03 0.00 0.00 0.00 175.76 176.31 2w3s s ARG 117 N -2.61 3.86 -0.03 0.00 0.52 -0.76 -5.02 118.95 114.91 2w3s s ARG 117 Ca 0.64 -0.37 0.03 0.00 -0.52 0.00 0.00 55.73 55.51 2w3s s ARG 117 Cb -0.35 -3.58 0.00 0.00 0.52 0.00 0.00 34.95 31.54 2w3s s ARG 117 CO 0.43 -0.19 -0.13 0.42 0.02 0.00 0.00 175.30 175.86 2w3s s ILE 118 N 1.72 1.08 -0.02 1.52 1.01 -1.26 -0.11 121.20 125.15 2w3s s ILE 118 Ca 0.07 -0.52 0.05 0.00 0.00 0.00 0.00 60.65 60.24 2w3s s ILE 118 Cb -0.16 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.34 2w3s s ILE 118 CO 0.09 0.32 -0.16 0.42 0.00 0.00 0.00 174.94 175.62 2w3s s THR 119 N 0.13 2.93 0.29 2.92 -4.23 -0.52 -4.97 115.64 112.19 2w3s s THR 119 Ca -0.04 -0.88 0.11 0.00 -1.18 0.00 0.00 61.69 59.71 2w3s s THR 119 Cb -0.10 -2.17 -0.05 0.00 1.34 0.00 0.00 72.50 71.52 2w3s s THR 119 CO 0.01 0.51 -0.17 -0.31 -0.54 0.00 0.00 174.62 174.13 2w3s s TYR 120 N -0.79 2.34 -0.60 3.99 1.51 -1.26 -0.28 117.35 122.27 2w3s s TYR 120 Ca 0.12 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 2w3s s TYR 120 Cb -0.11 -1.06 0.15 0.00 -0.11 0.00 0.00 41.96 40.84 2w3s s TYR 120 CO 0.02 0.69 0.40 0.00 -1.11 0.00 0.00 175.55 175.55 2w3s s ALA 121 N -2.50 3.52 0.50 3.71 0.00 0.17 -4.81 121.76 122.34 2w3s s ALA 121 Ca 0.30 -3.19 -0.21 0.00 0.00 0.00 0.00 51.96 48.86 2w3s s ALA 121 Cb -0.04 -2.59 -0.08 0.00 0.00 0.00 0.00 23.12 20.40 2w3s s ALA 121 CO 0.16 -2.07 0.92 -2.30 0.00 0.00 0.00 175.76 172.47 2w3s n PRO 122 N 3.55 1.08 -4.40 0.00 -0.02 -1.26 -1.50 135.00 132.45 2w3s n PRO 122 Ca 0.07 0.40 -0.20 0.00 -2.02 0.00 0.00 63.50 61.75 2w3s n PRO 122 Cb 0.38 -2.03 -0.10 0.00 -0.02 0.00 0.00 33.50 31.72 2w3s n PRO 122 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2w3s s ARG 123 N -2.27 1.51 -0.27 -0.52 0.52 0.11 -4.87 118.95 113.16 2w3s s ARG 123 Ca 0.68 -1.80 -0.29 0.00 -0.52 0.00 0.00 55.73 53.80 2w3s s ARG 123 Cb -0.49 -0.79 -0.01 0.00 0.52 0.00 0.00 34.95 34.17 2w3s s ARG 123 CO 0.53 -0.12 1.46 -2.14 0.02 0.00 0.00 175.30 175.05 2w3s s PRO 124 N -3.86 3.83 0.01 3.54 0.02 -1.26 -4.67 135.00 132.60 2w3s s PRO 124 Ca 0.33 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.47 2w3s s PRO 124 Cb 0.07 -3.97 -0.03 0.00 0.02 0.00 0.00 34.50 30.59 2w3s s PRO 124 CO 0.12 -1.24 0.97 0.00 -0.33 0.00 0.00 177.00 176.52 2w3s s ALA 125 N 4.87 3.17 -0.45 -1.55 0.00 -1.26 -4.98 121.76 121.57 2w3s s ALA 125 Ca 0.64 0.53 -0.24 0.00 0.00 0.00 0.00 51.96 52.88 2w3s s ALA 125 Cb -0.20 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.62 2w3s s ALA 125 CO 0.27 -0.21 0.87 0.42 0.00 0.00 0.00 175.76 177.10 2w3s s ILE 126 N 0.93 4.56 -0.01 0.00 1.01 -1.26 -4.92 121.20 121.52 2w3s s ILE 126 Ca 0.51 0.66 0.01 0.00 0.00 0.00 0.00 60.65 61.84 2w3s s ILE 126 Cb -0.21 -4.37 -0.02 0.00 0.01 0.00 0.00 42.46 37.86 2w3s s ILE 126 CO 0.28 -0.75 0.03 0.18 0.00 0.00 0.00 174.94 174.67 2w3s n LEU 127 N 6.93 0.00 -4.42 2.97 4.77 -1.26 0.26 117.00 126.26 2w3s n LEU 127 Ca 0.05 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.77 2w3s n LEU 127 Cb 0.48 0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.47 2w3s n LEU 127 CO 0.61 0.01 -0.51 0.42 -1.33 0.00 0.00 177.39 176.59 2w3s s THR 128 N -2.09 2.27 0.20 -5.08 -4.23 -1.26 -4.90 115.64 100.56 2w3s s THR 128 Ca -0.01 -2.09 -0.10 0.00 -1.18 0.00 0.00 61.69 58.31 2w3s s THR 128 Cb 0.01 -2.11 0.12 0.00 1.34 0.00 0.00 72.50 71.86 2w3s s THR 128 CO 0.06 -0.21 1.77 -0.07 -0.54 0.00 0.00 174.62 175.63 2w3s h LEU 129 N 3.03 0.36 -0.66 4.79 3.38 -1.97 0.36 115.31 124.60 2w3s h LEU 129 Ca -0.44 0.05 0.08 0.00 0.09 0.00 0.00 57.88 57.66 2w3s h LEU 129 Cb 1.22 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 2w3s h LEU 129 CO 0.51 0.23 0.32 0.44 0.09 0.00 0.00 178.44 180.03 2w3s h ASP 130 N 0.51 0.43 0.44 -0.43 3.32 -1.98 0.60 116.42 119.31 2w3s h ASP 130 Ca 0.28 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.36 2w3s h ASP 130 Cb 0.26 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2w3s h ASP 130 CO -0.23 0.26 -0.21 1.56 -1.72 0.00 0.00 179.24 178.90 2w3s h GLN 131 N 0.58 -0.56 -0.62 3.56 4.20 -1.63 0.28 115.11 120.90 2w3s h GLN 131 Ca 0.31 0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.18 2w3s h GLN 131 Cb 0.30 0.13 -0.09 0.00 0.30 0.00 0.00 27.48 28.11 2w3s h GLN 131 CO -0.24 -0.34 0.12 0.00 -0.67 0.00 0.00 178.83 177.70 2w3s h ALA 132 N -0.11 0.73 0.02 3.87 0.00 -0.38 0.15 119.26 123.54 2w3s h ALA 132 Ca -0.06 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2w3s h ALA 132 Cb 0.48 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2w3s h ALA 132 CO 0.10 -0.32 -0.01 1.25 0.00 0.00 0.00 179.25 180.27 2w3s h LEU 133 N 0.24 -0.02 -0.26 0.00 5.85 0.63 0.21 115.31 121.95 2w3s h LEU 133 Ca 0.33 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.97 2w3s h LEU 133 Cb 0.51 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.47 2w3s h LEU 133 CO -0.44 0.14 -0.31 0.00 -0.34 0.00 0.00 178.44 177.49 2w3s h ALA 134 N 0.80 -0.26 0.00 1.25 0.00 0.04 -2.40 119.26 118.69 2w3s h ALA 134 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2w3s h ALA 134 Cb 0.17 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2w3s h ALA 134 CO 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 179.25 178.50 2w3s h ALA 135 N 0.61 1.00 -5.89 0.00 0.00 -0.37 -3.46 119.26 111.16 2w3s h ALA 135 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.65 2w3s h ALA 135 Cb 0.53 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.43 2w3s h ALA 135 CO -0.44 0.00 -0.74 -3.47 0.00 0.00 0.00 179.25 174.60 2w3s n ASP 136 N -2.69 -3.94 -4.59 0.00 2.03 -0.05 -5.00 116.55 102.31 2w3s n ASP 136 Ca -0.00 -0.65 -0.43 0.00 0.52 0.00 0.00 54.79 54.24 2w3s n ASP 136 Cb 0.19 -4.74 -0.04 0.00 -0.72 0.00 0.00 41.12 35.81 2w3s n ASP 136 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2w3s s SER 137 N -3.82 6.59 0.21 1.67 0.15 0.53 -5.00 113.70 114.03 2w3s s SER 137 Ca 0.32 0.35 -0.23 0.00 0.70 0.00 0.00 55.95 57.09 2w3s s SER 137 Cb -0.15 -2.46 0.05 0.00 -1.71 0.00 0.00 66.02 61.75 2w3s s SER 137 CO 0.76 -0.97 0.77 0.00 1.20 0.00 0.00 173.24 175.00 2w3s s ARG 138 N 3.67 1.48 0.26 5.44 1.70 -1.26 -1.46 118.95 128.77 2w3s s ARG 138 Ca 0.38 -0.77 0.07 0.00 -0.47 0.00 0.00 55.73 54.94 2w3s s ARG 138 Cb -0.11 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 34.78 2w3s s ARG 138 CO 0.23 -0.67 0.26 -0.06 -1.08 0.00 0.00 175.30 173.98 2w3s s PHE 139 N -3.67 3.18 0.00 5.89 0.40 -0.06 -4.48 117.98 119.24 2w3s s PHE 139 Ca 0.09 -0.11 0.00 0.00 -0.60 0.00 0.00 56.93 56.31 2w3s s PHE 139 Cb -0.04 -1.50 0.00 0.00 0.51 0.00 0.00 43.02 41.99 2w3s s PHE 139 CO 0.01 0.45 0.00 0.39 0.70 0.00 0.00 175.22 176.77 2w3s n GLU 140 N -1.27 0.00 -3.43 0.44 1.02 -1.26 -4.02 120.64 112.11 2w3s n GLU 140 Ca -0.07 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.84 2w3s n GLU 140 Cb 0.58 -3.72 0.01 0.00 -0.02 0.00 0.00 31.44 28.29 2w3s n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3s n GLY 141 N -2.00 -0.84 0.00 0.62 0.00 -1.26 -4.90 105.19 96.81 2w3s n GLY 141 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.88 2w3s n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLY 142 N -1.01 2.86 3.66 -0.02 0.00 -1.26 -5.09 105.19 104.34 2w3s n GLY 142 Ca -0.13 -1.87 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2w3s n GLY 142 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w3s s PRO 143 N -3.40 0.45 -0.20 1.61 0.05 -1.26 -4.86 135.00 127.39 2w3s s PRO 143 Ca 0.00 0.63 -0.09 0.00 0.05 0.00 0.00 61.00 61.59 2w3s s PRO 143 Cb 0.00 -1.73 -0.04 0.00 0.05 0.00 0.00 34.50 32.77 2w3s s PRO 143 CO 0.00 -2.74 0.10 0.08 0.05 0.00 0.00 177.00 174.48 2w3s s VAL 144 N -2.90 5.07 -0.18 -0.36 1.01 0.16 -4.89 120.40 118.31 2w3s s VAL 144 Ca 0.65 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2w3s s VAL 144 Cb -0.19 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.89 2w3s s VAL 144 CO 0.58 0.43 -0.18 -0.63 0.00 0.00 0.00 175.10 175.31 2w3s s ILE 145 N 0.49 2.29 -0.04 2.22 1.01 -1.26 0.23 121.20 126.14 2w3s s ILE 145 Ca 0.05 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.88 2w3s s ILE 145 Cb -0.12 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 2w3s s ILE 145 CO 0.00 0.52 -0.15 0.26 0.00 0.00 0.00 174.94 175.58 2w3s s TRP 146 N 1.26 2.69 -0.12 3.97 0.51 0.08 -4.93 118.94 122.41 2w3s s TRP 146 Ca 0.04 -0.17 -0.05 0.00 -2.12 0.00 0.00 56.10 53.80 2w3s s TRP 146 Cb -0.13 -1.61 0.06 0.00 -0.81 0.00 0.00 33.47 30.98 2w3s s TRP 146 CO -0.10 0.20 0.24 0.00 -0.51 0.00 0.00 176.95 176.78 2w3s s ALA 147 N -0.77 -0.47 -0.10 0.98 0.00 -1.26 -0.70 121.76 119.44 2w3s s ALA 147 Ca 0.12 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.96 2w3s s ALA 147 Cb -0.11 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 2w3s s ALA 147 CO 0.01 -0.54 -0.15 0.50 0.00 0.00 0.00 175.76 175.59 2w3s s ARG 148 N 2.17 3.01 2.94 0.00 3.52 -0.53 -5.01 118.95 125.05 2w3s s ARG 148 Ca -0.00 -0.71 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 2w3s s ARG 148 Cb -0.12 -2.50 0.00 0.00 -1.56 0.00 0.00 34.95 30.77 2w3s s ARG 148 CO -0.08 0.37 0.00 0.41 -0.81 0.00 0.00 175.30 175.19 2w3s n GLY 149 N 3.06 0.20 2.92 8.12 0.00 -1.26 -1.64 105.19 116.57 2w3s n GLY 149 Ca -0.18 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 2w3s n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w3s s ASP 150 N -4.00 4.21 0.10 1.61 2.15 -1.26 -4.91 116.67 114.57 2w3s s ASP 150 Ca 0.00 -1.62 -0.15 0.00 0.43 0.00 0.00 52.55 51.21 2w3s s ASP 150 Cb 0.00 -1.26 -0.06 0.00 -0.30 0.00 0.00 42.92 41.30 2w3s s ASP 150 CO 0.00 -0.33 1.47 0.58 -0.17 0.00 0.00 175.17 176.73 2w3s h VAL 151 N 6.61 1.29 -0.08 1.11 2.07 -1.90 -1.58 116.25 123.77 2w3s h VAL 151 Ca -0.12 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.17 2w3s h VAL 151 Cb 1.04 1.43 -0.06 0.00 -1.52 0.00 0.00 31.29 32.17 2w3s h VAL 151 CO 0.46 0.41 -0.46 -0.08 0.02 0.00 0.00 177.57 177.92 2w3s h GLU 152 N 0.44 -0.54 0.10 1.57 4.57 -1.98 0.18 114.58 118.92 2w3s h GLU 152 Ca 0.07 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2w3s h GLU 152 Cb 0.69 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 2w3s h GLU 152 CO 0.05 -0.36 -0.25 1.15 -1.18 0.00 0.00 179.01 178.42 2w3s h THR 153 N -0.56 0.00 -0.82 0.32 2.02 -1.98 -0.29 112.91 111.60 2w3s h THR 153 Ca 0.05 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.39 2w3s h THR 153 Cb 0.66 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.97 2w3s h THR 153 CO -0.38 0.00 0.38 0.00 0.37 0.00 0.00 175.52 175.89 2w3s h ALA 154 N -1.14 1.22 0.00 6.16 0.00 -1.05 0.81 119.26 125.25 2w3s h ALA 154 Ca -0.01 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2w3s h ALA 154 Cb 0.37 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2w3s h ALA 154 CO -0.11 -0.16 -0.48 -0.07 0.00 0.00 0.00 179.25 178.43 2w3s h LEU 155 N 0.54 0.00 -0.88 0.00 3.38 -0.55 -3.01 115.31 114.79 2w3s h LEU 155 Ca 0.46 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.32 2w3s h LEU 155 Cb 0.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2w3s h LEU 155 CO -0.39 0.48 -0.26 0.00 0.09 0.00 0.00 178.44 178.36 2w3s h ALA 156 N 1.52 1.04 -0.55 1.53 0.00 1.00 -2.78 119.26 121.02 2w3s h ALA 156 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2w3s h ALA 156 Cb 0.87 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2w3s h ALA 156 CO 0.06 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.30 2w3s n GLY 157 N -0.32 2.89 3.68 0.00 0.00 -1.01 -4.99 105.19 105.43 2w3s n GLY 157 Ca -0.00 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 2w3s n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s ALA 158 N -2.64 3.57 0.65 4.61 0.00 -1.05 -4.88 121.76 122.02 2w3s s ALA 158 Ca 0.51 0.53 0.39 0.00 0.00 0.00 0.00 51.96 53.39 2w3s s ALA 158 Cb 0.39 -3.56 2.16 0.00 0.00 0.00 0.00 23.12 22.11 2w3s s ALA 158 CO 0.15 -0.94 2.28 0.00 0.00 0.00 0.00 175.76 177.25 2w3s h ALA 159 N 7.75 1.22 -2.73 0.00 0.00 -1.82 -3.43 119.26 120.25 2w3s h ALA 159 Ca -0.30 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 2w3s h ALA 159 Cb 1.13 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 2w3s h ALA 159 CO 0.92 -0.06 -0.34 -1.01 0.00 0.00 0.00 179.25 178.75 2w3s s HIS 160 N -4.29 -0.20 -0.22 0.00 3.76 -0.90 -4.90 115.29 108.55 2w3s s HIS 160 Ca -0.05 0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 55.13 2w3s s HIS 160 Cb 0.13 0.08 0.07 0.00 1.11 0.00 0.00 32.58 33.97 2w3s s HIS 160 CO 0.44 -0.29 0.54 -1.17 -0.85 0.00 0.00 174.74 173.41 2w3s s LEU 161 N -0.80 -0.51 -0.07 0.89 0.20 -1.26 -1.68 118.68 115.46 2w3s s LEU 161 Ca -0.09 1.19 0.04 0.00 0.69 0.00 0.00 54.13 55.96 2w3s s LEU 161 Cb -0.04 1.83 0.00 0.00 -0.43 0.00 0.00 46.19 47.55 2w3s s LEU 161 CO 0.02 -0.22 -0.19 0.00 -0.29 0.00 0.00 176.35 175.68 2w3s s ALA 162 N 1.56 1.72 0.13 5.97 0.00 0.12 -4.98 121.76 126.27 2w3s s ALA 162 Ca -0.10 -0.74 0.10 0.00 0.00 0.00 0.00 51.96 51.22 2w3s s ALA 162 Cb -0.07 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2w3s s ALA 162 CO -0.16 0.26 -0.24 -1.21 0.00 0.00 0.00 175.76 174.41 2w3s s GLU 163 N 0.25 1.54 0.00 0.00 2.02 -1.26 -0.77 118.70 120.48 2w3s s GLU 163 Ca -0.11 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.59 2w3s s GLU 163 Cb -0.15 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.11 2w3s s GLU 163 CO 0.05 0.46 0.00 0.41 0.02 0.00 0.00 175.26 176.19 2w3s n GLY 164 N 0.84 -0.09 3.50 -1.39 0.00 -1.01 -5.02 105.19 102.02 2w3s n GLY 164 Ca -0.17 -0.97 -0.18 0.00 0.00 0.00 0.00 46.02 44.71 2w3s n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s PHE 166 N -1.22 -0.07 0.16 0.00 -0.00 -0.38 -4.99 117.98 111.48 2w3s s PHE 166 Ca -0.11 -0.15 -0.23 0.00 -0.00 0.00 0.00 56.93 56.44 2w3s s PHE 166 Cb -0.00 0.09 -0.08 0.00 -0.00 0.00 0.00 43.02 43.03 2w3s s PHE 166 CO 0.09 -0.54 0.73 -1.21 -0.00 0.00 0.00 175.22 174.29 2w3s s GLU 167 N -2.99 4.43 -0.11 1.99 0.41 -1.26 -2.23 118.70 118.93 2w3s s GLU 167 Ca -0.02 1.01 0.01 0.00 -0.41 0.00 0.00 54.97 55.57 2w3s s GLU 167 Cb 0.01 -3.17 0.02 0.00 -1.78 0.00 0.00 34.13 29.21 2w3s s GLU 167 CO -0.06 0.54 -0.14 0.42 -0.49 0.00 0.00 175.26 175.53 2w3s s ILE 168 N -1.23 1.43 0.54 -1.63 1.01 0.76 -1.73 121.20 120.36 2w3s s ILE 168 Ca 0.36 -0.60 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 2w3s s ILE 168 Cb -0.21 -1.32 -0.06 0.00 0.01 0.00 0.00 42.46 40.88 2w3s s ILE 168 CO 0.24 0.43 1.03 -0.83 0.00 0.00 0.00 174.94 175.81 2w3s s GLY 169 N 1.05 2.23 0.00 6.18 0.00 -1.16 -0.94 107.32 114.68 2w3s s GLY 169 Ca -0.06 0.41 0.00 0.00 0.00 0.00 0.00 44.72 45.07 2w3s s GLY 169 CO -0.02 0.72 0.00 0.61 0.00 0.00 0.00 173.10 174.40 2w3s n GLY 170 N -0.89 -1.63 3.64 0.20 0.00 -1.26 -4.61 105.19 100.64 2w3s n GLY 170 Ca 0.08 -1.50 -0.06 0.00 0.00 0.00 0.00 46.02 44.55 2w3s n GLY 170 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3s s GLN 171 N -0.37 0.59 0.00 1.61 0.74 -1.22 -4.79 119.66 116.22 2w3s s GLN 171 Ca 0.00 0.99 -0.24 0.00 0.05 0.00 0.00 55.36 56.15 2w3s s GLN 171 Cb 0.00 0.14 -0.05 0.00 1.10 0.00 0.00 33.01 34.20 2w3s s GLN 171 CO 0.00 -0.12 0.74 -2.00 -0.55 0.00 0.00 175.29 173.36 2w3s s GLU 172 N 1.40 4.46 0.09 1.67 2.56 -1.26 -1.59 118.70 126.03 2w3s s GLU 172 Ca -0.08 0.99 -0.26 0.00 0.00 0.00 0.00 54.97 55.62 2w3s s GLU 172 Cb -0.05 -3.40 -0.13 0.00 2.00 0.00 0.00 34.13 32.56 2w3s s GLU 172 CO -0.16 0.20 1.69 0.45 -0.56 0.00 0.00 175.26 176.88 2w3s h HIS 173 N 6.10 -0.32 -5.86 5.30 3.86 -1.95 -3.47 115.15 118.81 2w3s h HIS 173 Ca -0.43 -0.00 -0.40 0.00 -1.16 0.00 0.00 60.37 58.38 2w3s h HIS 173 Cb 1.20 0.12 0.13 0.00 1.06 0.00 0.00 27.41 29.93 2w3s h HIS 173 CO 0.65 -0.19 -0.69 0.34 0.86 0.00 0.00 177.93 178.90 2w3s n PHE 174 N -5.24 -2.80 -1.58 2.45 7.35 -1.26 -4.97 117.46 111.40 2w3s n PHE 174 Ca -0.08 1.01 -0.43 0.00 -0.76 0.00 0.00 57.45 57.18 2w3s n PHE 174 Cb 0.16 -4.99 -0.00 0.00 0.35 0.00 0.00 39.48 35.00 2w3s n PHE 174 CO 0.00 0.00 0.00 2.48 -0.76 0.00 0.00 176.76 178.48 2w3s n TYR 175 N -4.93 1.05 0.09 -5.13 0.18 -1.26 -4.92 117.16 102.24 2w3s n TYR 175 Ca -0.01 0.65 -0.16 0.00 1.88 0.00 0.00 57.90 60.26 2w3s n TYR 175 Cb 0.57 -2.22 -0.10 0.00 -0.38 0.00 0.00 39.34 37.22 2w3s n TYR 175 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 2w3s h LEU 176 N 1.72 0.53 -9.03 -3.48 -0.00 -1.84 -3.38 115.31 99.83 2w3s h LEU 176 Ca -0.41 -0.50 -0.60 0.00 -0.00 0.00 0.00 57.88 56.37 2w3s h LEU 176 Cb 1.35 -0.17 -0.09 0.00 -0.00 0.00 0.00 40.66 41.74 2w3s h LEU 176 CO 0.58 1.34 0.38 -0.70 -0.00 0.00 0.00 178.44 180.04 2w3s s GLU 177 N -2.96 4.17 0.00 1.13 2.12 -1.07 -5.06 118.70 117.03 2w3s s GLU 177 Ca -0.05 0.83 0.00 0.00 0.36 0.00 0.00 54.97 56.11 2w3s s GLU 177 Cb 0.08 -3.64 0.00 0.00 0.26 0.00 0.00 34.13 30.82 2w3s s GLU 177 CO 0.88 -0.48 0.00 0.41 -0.54 0.00 0.00 175.26 175.53 2w3s n GLY 178 N 3.86 -1.57 3.77 -1.50 0.00 -1.26 -4.71 105.19 103.77 2w3s n GLY 178 Ca 0.04 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 2w3s n GLY 178 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3s s GLN 179 N -2.39 3.97 -0.21 1.61 -1.52 -1.26 -4.91 119.66 114.94 2w3s s GLN 179 Ca 0.00 1.99 -0.28 0.00 -1.95 0.00 0.00 55.36 55.12 2w3s s GLN 179 Cb 0.00 -2.69 0.12 0.00 -0.22 0.00 0.00 33.01 30.23 2w3s s GLN 179 CO 0.00 -0.43 1.00 0.00 -0.25 0.00 0.00 175.29 175.61 2w3s s ALA 180 N -1.35 -1.95 0.15 6.09 0.00 -1.26 -1.89 121.76 121.56 2w3s s ALA 180 Ca 0.58 1.72 -0.14 0.00 0.00 0.00 0.00 51.96 54.12 2w3s s ALA 180 Cb -0.34 -1.04 0.02 0.00 0.00 0.00 0.00 23.12 21.76 2w3s s ALA 180 CO 0.43 -0.28 0.38 0.00 0.00 0.00 0.00 175.76 176.30 2w3s s ALA 181 N -0.46 -0.62 -0.18 0.00 0.00 0.30 -0.40 121.76 120.40 2w3s s ALA 181 Ca 0.00 -0.38 -0.08 0.00 0.00 0.00 0.00 51.96 51.51 2w3s s ALA 181 Cb -0.03 0.76 0.07 0.00 0.00 0.00 0.00 23.12 23.92 2w3s s ALA 181 CO -0.02 -0.68 0.40 -1.17 0.00 0.00 0.00 175.76 174.30 2w3s s LEU 182 N -2.87 -0.35 -0.13 0.00 2.96 0.74 -1.50 118.68 117.53 2w3s s LEU 182 Ca 0.09 0.91 -0.03 0.00 -0.22 0.00 0.00 54.13 54.87 2w3s s LEU 182 Cb 0.02 1.29 -0.03 0.00 0.50 0.00 0.00 46.19 47.97 2w3s s LEU 182 CO -0.06 -0.21 -0.00 0.00 -1.32 0.00 0.00 176.35 174.75 2w3s s ALA 183 N 2.01 3.20 -0.34 5.97 0.00 0.56 -1.92 121.76 131.24 2w3s s ALA 183 Ca -0.05 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.15 2w3s s ALA 183 Cb -0.10 -1.58 0.10 0.00 0.00 0.00 0.00 23.12 21.53 2w3s s ALA 183 CO -0.12 0.38 0.05 -0.51 0.00 0.00 0.00 175.76 175.55 2w3s s LEU 184 N -0.20 4.69 0.25 0.00 1.43 -0.21 -1.77 118.68 122.88 2w3s s LEU 184 Ca 0.05 -2.13 -0.31 0.00 -1.03 0.00 0.00 54.13 50.72 2w3s s LEU 184 Cb -0.13 -1.62 -0.14 0.00 0.03 0.00 0.00 46.19 44.34 2w3s s LEU 184 CO 0.02 -0.37 1.29 -0.81 0.23 0.00 0.00 176.35 176.70 2w3s n PRO 185 N 4.26 1.79 -3.38 1.29 -0.04 -1.26 -1.86 135.00 135.80 2w3s n PRO 185 Ca 0.03 0.63 -0.16 0.00 -0.04 0.00 0.00 63.50 63.96 2w3s n PRO 185 Cb 0.42 -2.21 -0.08 0.00 -0.04 0.00 0.00 33.50 31.59 2w3s n PRO 185 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3s s ALA 186 N -0.38 -0.49 -0.01 0.55 0.00 0.05 -4.90 121.76 116.57 2w3s s ALA 186 Ca 0.66 -0.58 -0.01 0.00 0.00 0.00 0.00 51.96 52.03 2w3s s ALA 186 Cb -0.68 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 20.51 2w3s s ALA 186 CO 0.53 -1.91 0.02 -0.85 0.00 0.00 0.00 175.76 173.55 2w3s n GLU 187 N 4.83 -0.08 0.00 0.00 0.28 -1.26 -1.89 120.64 122.52 2w3s n GLU 187 Ca 0.04 0.13 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 2w3s n GLU 187 Cb 0.46 -0.17 0.00 0.00 1.43 0.00 0.00 31.44 33.16 2w3s n GLU 187 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2w3s n GLY 188 N 0.53 2.99 3.28 -1.84 0.00 -1.26 -4.96 105.19 103.93 2w3s n GLY 188 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2w3s n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLY 189 N -1.53 3.40 3.40 -0.02 0.00 -0.79 -5.06 105.19 104.59 2w3s n GLY 189 Ca 0.00 -2.20 -0.25 0.00 0.00 0.00 0.00 46.02 43.56 2w3s n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w3s s VAL 190 N -2.91 2.22 -0.14 1.61 -7.23 -0.78 -0.77 120.40 112.39 2w3s s VAL 190 Ca 0.12 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.26 2w3s s VAL 190 Cb 0.01 -2.06 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 2w3s s VAL 190 CO 0.09 -0.18 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.91 2w3s s VAL 191 N -1.80 3.33 -0.19 1.32 1.01 -0.78 -1.64 120.40 121.65 2w3s s VAL 191 Ca 0.20 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 2w3s s VAL 191 Cb -0.07 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2w3s s VAL 191 CO 0.09 0.51 0.02 -0.63 0.00 0.00 0.00 175.10 175.09 2w3s s ILE 192 N 0.43 4.24 -0.11 2.22 -1.09 0.56 -1.04 121.20 126.42 2w3s s ILE 192 Ca -0.08 -0.22 -0.02 0.00 -2.23 0.00 0.00 60.65 58.10 2w3s s ILE 192 Cb -0.15 -2.91 -0.03 0.00 -1.58 0.00 0.00 42.46 37.78 2w3s s ILE 192 CO 0.04 0.43 -0.02 -1.00 -1.23 0.00 0.00 174.94 173.16 2w3s s HIS 193 N 0.80 3.08 0.15 3.97 3.76 -0.81 0.08 115.29 126.32 2w3s s HIS 193 Ca 0.01 0.01 -0.19 0.00 -0.15 0.00 0.00 55.06 54.75 2w3s s HIS 193 Cb -0.14 -1.83 0.05 0.00 1.11 0.00 0.00 32.58 31.76 2w3s s HIS 193 CO 0.02 0.28 0.51 0.00 -0.85 0.00 0.00 174.74 174.70 2w3s s SER 195 N -2.80 6.57 -0.11 0.00 0.15 0.46 -4.79 113.70 113.19 2w3s s SER 195 Ca 0.04 -1.80 -0.11 0.00 0.70 0.00 0.00 55.95 54.78 2w3s s SER 195 Cb 0.00 -2.46 0.03 0.00 -1.71 0.00 0.00 66.02 61.88 2w3s s SER 195 CO -0.10 -1.23 0.30 -0.55 1.20 0.00 0.00 173.24 172.86 2w3s s SER 196 N 4.08 -0.30 0.00 5.45 0.15 -1.26 -4.49 113.70 117.32 2w3s s SER 196 Ca 0.37 0.57 0.25 0.00 0.70 0.00 0.00 55.95 57.84 2w3s s SER 196 Cb -0.04 0.59 1.18 0.00 -1.71 0.00 0.00 66.02 66.05 2w3s s SER 196 CO -0.09 -0.12 1.82 0.00 1.20 0.00 0.00 173.24 176.04 2w3s n GLN 197 N 2.83 0.22 -3.18 5.44 6.02 -0.81 -4.50 117.38 123.40 2w3s n GLN 197 Ca -0.13 0.06 -0.19 0.00 -0.01 0.00 0.00 57.00 56.73 2w3s n GLN 197 Cb 0.58 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.31 2w3s n GLN 197 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2w3s n HIS 198 N -1.37 0.01 -0.31 1.08 -0.00 -1.26 -1.97 115.22 111.41 2w3s n HIS 198 Ca 0.10 -3.73 0.18 0.00 0.46 0.00 0.00 57.72 54.72 2w3s n HIS 198 Cb 0.23 -0.35 0.44 0.00 -0.12 0.00 0.00 29.99 30.19 2w3s n HIS 198 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2w3s h PRO 199 N 3.15 0.53 0.00 1.57 0.11 -1.91 0.84 132.00 136.29 2w3s h PRO 199 Ca 0.09 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.12 2w3s h PRO 199 Cb 0.96 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 2w3s h PRO 199 CO 0.48 0.35 -0.25 0.77 -0.21 0.00 0.00 178.00 179.14 2w3s h SER 200 N 0.54 0.00 -0.07 -2.05 0.02 -1.92 0.88 113.55 110.95 2w3s h SER 200 Ca 0.55 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.45 2w3s h SER 200 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2w3s h SER 200 CO -0.29 0.25 -0.15 -0.08 -1.14 0.00 0.00 176.83 175.42 2w3s h GLU 201 N 0.00 0.21 -0.74 3.45 4.81 -1.12 -2.13 114.58 119.06 2w3s h GLU 201 Ca -0.00 -0.14 0.14 0.00 -0.13 0.00 0.00 59.36 59.23 2w3s h GLU 201 Cb 0.52 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 29.78 2w3s h GLU 201 CO 0.03 0.74 -0.23 0.82 -0.73 0.00 0.00 179.01 179.64 2w3s h ILE 202 N -0.28 0.21 -0.80 2.32 1.08 -1.10 0.15 117.51 119.09 2w3s h ILE 202 Ca 0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.61 2w3s h ILE 202 Cb 0.74 0.21 -0.09 0.00 -3.07 0.00 0.00 36.82 34.61 2w3s h ILE 202 CO 0.03 0.00 0.38 -0.61 -0.69 0.00 0.00 178.15 177.26 2w3s h GLN 203 N -0.03 0.54 -0.07 2.37 4.15 -0.62 -0.23 115.11 121.22 2w3s h GLN 203 Ca 0.34 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.71 2w3s h GLN 203 Cb 0.56 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 2w3s h GLN 203 CO -0.78 0.36 -0.04 1.25 -1.93 0.00 0.00 178.83 177.69 2w3s h HIS 204 N 0.56 0.17 -0.10 3.99 2.76 -0.15 -1.75 115.15 120.62 2w3s h HIS 204 Ca 0.43 -0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.48 2w3s h HIS 204 Cb 0.60 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.52 2w3s h HIS 204 CO -0.12 0.53 -0.22 0.87 -1.30 0.00 0.00 177.93 177.69 2w3s h LYS 205 N -0.25 0.33 -0.21 5.26 1.79 -0.57 -1.75 116.57 121.17 2w3s h LYS 205 Ca 0.01 -0.22 0.04 0.00 -2.18 0.00 0.00 60.65 58.30 2w3s h LYS 205 Cb 0.49 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.14 2w3s h LYS 205 CO 0.01 0.82 -0.03 0.28 -1.08 0.00 0.00 179.45 179.45 2w3s h VAL 206 N -0.11 0.82 -0.92 0.50 2.07 -1.11 -1.05 116.25 116.44 2w3s h VAL 206 Ca 0.00 -0.01 0.12 0.00 0.82 0.00 0.00 66.70 67.63 2w3s h VAL 206 Cb 0.82 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 31.29 2w3s h VAL 206 CO 0.05 0.01 0.55 0.00 0.02 0.00 0.00 177.57 178.19 2w3s h ALA 207 N 1.19 1.38 0.00 1.67 0.00 -1.09 -1.66 119.26 120.76 2w3s h ALA 207 Ca 0.10 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 2w3s h ALA 207 Cb 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2w3s h ALA 207 CO -0.19 0.12 -0.63 0.45 0.00 0.00 0.00 179.25 179.00 2w3s h HIS 208 N 0.86 0.00 -0.05 0.00 -0.00 -0.88 0.87 115.15 115.95 2w3s h HIS 208 Ca 0.47 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.71 2w3s h HIS 208 Cb 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.89 2w3s h HIS 208 CO -0.04 0.63 -0.52 0.00 -0.00 0.00 0.00 177.93 178.00 2w3s h ALA 209 N 1.37 1.03 -0.01 2.45 0.00 -0.31 -2.70 119.26 121.09 2w3s h ALA 209 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2w3s h ALA 209 Cb 1.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2w3s h ALA 209 CO 0.08 0.67 -0.71 1.28 0.00 0.00 0.00 179.25 180.57 2w3s n LEU 210 N -3.92 1.52 -2.21 0.00 4.77 -0.80 -3.49 117.00 112.87 2w3s n LEU 210 Ca -0.02 -0.61 -0.13 0.00 -0.03 0.00 0.00 56.01 55.22 2w3s n LEU 210 Cb 0.55 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.68 2w3s n LEU 210 CO 0.42 0.31 0.13 0.61 -1.33 0.00 0.00 177.39 177.54 2w3s n GLY 211 N 1.46 0.13 3.56 -0.72 0.00 -0.74 -4.93 105.19 103.94 2w3s n GLY 211 Ca 0.07 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 2w3s n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w3s s LEU 212 N -4.47 2.91 0.44 0.99 1.43 0.22 -5.04 118.68 115.16 2w3s s LEU 212 Ca 0.31 -0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 52.53 2w3s s LEU 212 Cb -0.14 -1.53 -0.10 0.00 0.03 0.00 0.00 46.19 44.46 2w3s s LEU 212 CO 0.40 0.07 0.92 0.00 0.23 0.00 0.00 176.35 177.97 2w3s s ALA 213 N -2.00 3.11 0.36 4.21 0.00 -1.26 -4.48 121.76 121.70 2w3s s ALA 213 Ca 0.27 0.25 0.15 0.00 0.00 0.00 0.00 51.96 52.63 2w3s s ALA 213 Cb -0.07 -3.06 1.02 0.00 0.00 0.00 0.00 23.12 21.00 2w3s s ALA 213 CO 0.16 0.05 1.74 0.74 0.00 0.00 0.00 175.76 178.45 2w3s h PHE 214 N 1.65 0.84 0.00 0.00 -1.00 -1.93 -0.87 116.94 115.62 2w3s h PHE 214 Ca -0.48 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.33 2w3s h PHE 214 Cb 1.18 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 40.50 2w3s h PHE 214 CO 0.62 0.04 0.00 -2.39 -1.61 0.00 0.00 178.31 174.97 2w3s n HIS 215 N -4.78 0.00 0.44 -0.55 1.44 -1.26 -2.13 115.22 108.39 2w3s n HIS 215 Ca 0.27 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 56.03 2w3s n HIS 215 Cb 0.85 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.95 2w3s n HIS 215 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2w3s n ASP 216 N -0.93 1.12 -4.24 4.39 8.00 -0.33 -4.94 116.55 119.62 2w3s n ASP 216 Ca 0.10 -1.06 -0.34 0.00 0.71 0.00 0.00 54.79 54.20 2w3s n ASP 216 Cb 0.04 0.53 -0.15 0.00 -0.02 0.00 0.00 41.12 41.53 2w3s n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w3s s VAL 217 N -1.42 2.84 -0.21 2.53 1.01 -0.91 -1.87 120.40 122.36 2w3s s VAL 217 Ca 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2w3s s VAL 217 Cb 0.08 -2.25 0.05 0.00 0.00 0.00 0.00 36.38 34.26 2w3s s VAL 217 CO 0.27 0.48 -0.09 -0.60 0.00 0.00 0.00 175.10 175.15 2w3s s ARG 218 N 1.32 1.93 -0.22 2.72 3.00 -0.65 -4.94 118.95 122.12 2w3s s ARG 218 Ca 0.04 -0.93 -0.08 0.00 -1.00 0.00 0.00 55.73 53.76 2w3s s ARG 218 Cb -0.14 -2.51 -0.04 0.00 0.00 0.00 0.00 34.95 32.26 2w3s s ARG 218 CO -0.06 -0.49 0.10 0.08 0.00 0.00 0.00 175.30 174.93 2w3s s VAL 219 N 1.37 4.89 -0.06 7.11 1.01 -1.26 -0.32 120.40 133.14 2w3s s VAL 219 Ca -0.03 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.02 2w3s s VAL 219 Cb -0.17 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.95 2w3s s VAL 219 CO -0.07 0.39 -0.25 -1.61 0.00 0.00 0.00 175.10 173.56 2w3s s GLU 220 N 0.87 2.55 -0.31 2.72 2.02 0.11 -1.40 118.70 125.26 2w3s s GLU 220 Ca 0.05 -0.90 -0.00 0.00 0.02 0.00 0.00 54.97 54.13 2w3s s GLU 220 Cb -0.13 -2.16 0.13 0.00 0.10 0.00 0.00 34.13 32.07 2w3s s GLU 220 CO 0.03 0.38 0.28 1.41 0.02 0.00 0.00 175.26 177.38 2w3s s MET 221 N -0.16 0.37 0.06 1.61 -2.45 0.49 -3.63 119.30 115.59 2w3s s MET 221 Ca -0.04 -0.37 0.05 0.00 -1.25 0.00 0.00 55.69 54.08 2w3s s MET 221 Cb -0.14 -0.76 -0.24 0.00 1.25 0.00 0.00 34.83 34.94 2w3s s MET 221 CO 0.04 -1.07 1.07 -0.09 1.05 0.00 0.00 175.02 176.02 2w3s h ARG 222 N 8.02 0.08 -1.12 4.11 9.65 -1.87 -1.72 114.38 131.53 2w3s h ARG 222 Ca -0.10 -0.14 0.26 0.00 -1.10 0.00 0.00 59.98 58.90 2w3s h ARG 222 Cb 1.06 0.05 -0.24 0.00 -1.39 0.00 0.00 29.97 29.45 2w3s h ARG 222 CO 0.32 0.95 0.93 -0.98 2.80 0.00 0.00 179.97 184.00 2w3s s ARG 223 N -2.66 0.10 0.02 0.20 1.70 -1.26 -4.64 118.95 112.40 2w3s s ARG 223 Ca -0.03 -0.00 0.07 0.00 -0.47 0.00 0.00 55.73 55.31 2w3s s ARG 223 Cb 0.09 0.05 -0.03 0.00 -0.57 0.00 0.00 34.95 34.48 2w3s s ARG 223 CO 0.84 -0.04 -0.21 -1.64 -1.08 0.00 0.00 175.30 173.17 2w3s s MET 224 N -1.47 2.04 -0.77 3.89 -1.94 -0.08 -4.77 119.30 116.21 2w3s s MET 224 Ca 0.09 -0.98 -0.08 0.00 -1.71 0.00 0.00 55.69 53.02 2w3s s MET 224 Cb -0.01 -2.13 -0.17 0.00 2.01 0.00 0.00 34.83 34.53 2w3s s MET 224 CO -0.06 0.54 3.16 0.41 -0.01 0.00 0.00 175.02 179.07 2w3s n GLY 225 N 1.82 3.50 0.00 -0.03 0.00 -1.26 -4.36 105.19 104.86 2w3s n GLY 225 Ca -0.16 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.57 2w3s n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLY 226 N 3.06 2.35 1.79 -0.02 0.00 -1.20 -2.59 105.19 108.58 2w3s n GLY 226 Ca 0.58 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2w3s n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLY 227 N 1.63 -0.22 2.39 -0.02 0.00 -1.26 -4.87 105.19 102.83 2w3s n GLY 227 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2w3s n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2w3s n PHE 228 N -3.11 -0.42 0.00 1.61 3.01 -1.26 -1.02 117.46 116.26 2w3s n PHE 228 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2w3s n PHE 228 Cb 0.00 -3.26 0.00 0.00 -0.01 0.00 0.00 39.48 36.21 2w3s n PHE 228 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2w3s n GLY 229 N -0.50 3.35 0.02 1.37 0.00 -1.26 -1.87 105.19 106.29 2w3s n GLY 229 Ca -0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.84 2w3s n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLY 230 N -1.73 -0.55 0.06 -0.02 0.00 -0.19 -1.70 105.19 101.07 2w3s n GLY 230 Ca 0.00 0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2w3s n GLY 230 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w3s n LYS 231 N -1.57 1.75 0.26 1.61 5.02 -1.24 -4.38 118.16 119.61 2w3s n LYS 231 Ca -0.00 -1.54 0.15 0.00 -2.02 0.00 0.00 58.31 54.90 2w3s n LYS 231 Cb 0.01 -0.99 0.62 0.00 -0.02 0.00 0.00 35.03 34.65 2w3s n LYS 231 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2w3s h GLU 232 N 0.00 0.00 0.00 1.97 4.81 -1.67 -2.15 114.58 117.54 2w3s h GLU 232 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2w3s h GLU 232 Cb 0.80 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 2w3s h GLU 232 CO 0.00 0.08 0.00 -1.13 -0.73 0.00 0.00 179.01 177.23 2w3s n SER 233 N -3.21 0.00 -0.25 1.04 3.41 -1.26 -4.64 113.62 108.71 2w3s n SER 233 Ca 0.00 0.00 0.27 0.00 -0.26 0.00 0.00 58.87 58.88 2w3s n SER 233 Cb 0.34 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 64.93 2w3s n SER 233 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2w3s h GLN 234 N 0.00 0.16 -0.09 4.33 1.08 -1.81 0.12 115.11 118.89 2w3s h GLN 234 Ca 0.00 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.22 2w3s h GLN 234 Cb 0.00 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2w3s h GLN 234 CO 0.00 0.10 0.18 0.78 -0.95 0.00 0.00 178.83 178.95 2w3s h GLY 235 N 0.16 0.00 0.43 3.46 0.00 -1.83 -3.15 103.07 102.15 2w3s h GLY 235 Ca 0.50 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.90 2w3s h GLY 235 CO -0.10 0.00 0.07 3.43 0.00 0.00 0.00 176.54 179.94 2w3s h ASN 236 N 0.00 -0.02 -0.61 0.19 -0.26 -1.08 -2.50 115.58 111.30 2w3s h ASN 236 Ca 0.04 0.08 0.07 0.00 -0.56 0.00 0.00 56.30 55.94 2w3s h ASN 236 Cb 0.41 0.11 -0.06 0.00 -1.06 0.00 0.00 38.32 37.72 2w3s h ASN 236 CO -0.00 0.02 0.28 0.45 -1.06 0.00 0.00 177.43 177.13 2w3s h HIS 237 N 0.20 0.51 -0.23 1.19 3.86 -1.75 -0.66 115.15 118.27 2w3s h HIS 237 Ca 0.21 0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.34 2w3s h HIS 237 Cb 0.27 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 2w3s h HIS 237 CO -0.22 0.20 -0.29 -0.07 0.86 0.00 0.00 177.93 178.41 2w3s h LEU 238 N 0.52 0.64 -0.30 2.43 4.07 -1.70 -1.74 115.31 119.23 2w3s h LEU 238 Ca 0.29 -0.50 0.00 0.00 0.08 0.00 0.00 57.88 57.75 2w3s h LEU 238 Cb 0.28 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 2w3s h LEU 238 CO -0.24 1.02 0.19 0.00 -1.08 0.00 0.00 178.44 178.34 2w3s h ALA 239 N 0.65 0.38 0.15 1.53 0.00 -1.33 -0.42 119.26 120.22 2w3s h ALA 239 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2w3s h ALA 239 Cb 0.86 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2w3s h ALA 239 CO 0.07 -0.15 -0.07 0.82 0.00 0.00 0.00 179.25 179.92 2w3s h ILE 240 N 0.40 0.87 0.00 0.00 2.04 -1.08 -1.92 117.51 117.83 2w3s h ILE 240 Ca 0.11 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2w3s h ILE 240 Cb -0.03 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2w3s h ILE 240 CO -0.02 0.02 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2w3s n ALA 241 N -2.20 -0.18 -0.36 1.87 0.00 -0.66 -0.75 120.51 118.23 2w3s n ALA 241 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2w3s n ALA 241 Cb 0.12 0.32 0.06 0.00 0.00 0.00 0.00 19.45 19.95 2w3s n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3s h ALA 243 N 1.52 -0.45 -0.69 0.00 0.00 -0.87 0.17 119.26 118.92 2w3s h ALA 243 Ca 0.37 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2w3s h ALA 243 Cb 0.62 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 2w3s h ALA 243 CO -0.97 -0.81 0.39 0.28 0.00 0.00 0.00 179.25 178.15 2w3s h VAL 244 N -0.48 1.21 -0.72 0.00 2.07 0.73 0.22 116.25 119.28 2w3s h VAL 244 Ca 0.04 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 66.99 2w3s h VAL 244 Cb 0.51 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2w3s h VAL 244 CO -0.17 0.23 0.22 0.00 0.02 0.00 0.00 177.57 177.87 2w3s h ALA 245 N 1.20 1.03 -0.36 1.67 0.00 -0.89 -0.63 119.26 121.27 2w3s h ALA 245 Ca 0.25 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2w3s h ALA 245 Cb 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2w3s h ALA 245 CO -0.04 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.83 2w3s h ALA 246 N 1.17 0.50 -0.04 0.00 0.00 -0.10 0.38 119.26 121.17 2w3s h ALA 246 Ca 0.23 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2w3s h ALA 246 Cb 0.30 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2w3s h ALA 246 CO -0.01 0.30 -0.19 -0.09 0.00 0.00 0.00 179.25 179.26 2w3s h ARG 247 N 0.47 -0.28 -0.42 0.00 2.43 -0.27 -0.22 114.38 116.09 2w3s h ARG 247 Ca 0.10 0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 2w3s h ARG 247 Cb 0.51 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2w3s h ARG 247 CO 0.02 -0.18 -0.09 0.00 -1.51 0.00 0.00 179.97 178.21 2w3s h ALA 248 N 0.65 0.58 -0.01 2.80 0.00 -0.89 -3.21 119.26 119.19 2w3s h ALA 248 Ca 0.07 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2w3s h ALA 248 Cb 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2w3s h ALA 248 CO -0.20 0.46 -0.13 0.25 0.00 0.00 0.00 179.25 179.62 2w3s n THR 249 N -4.31 0.00 -0.87 0.00 -2.24 0.13 -4.92 114.28 102.07 2w3s n THR 249 Ca -0.01 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2w3s n THR 249 Cb 0.36 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 2w3s n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3s n GLY 250 N 1.27 0.00 3.35 3.38 0.00 -0.10 -4.94 105.19 108.15 2w3s n GLY 250 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2w3s n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3s s ARG 251 N -1.74 1.58 0.21 1.61 0.52 -1.21 -4.94 118.95 114.98 2w3s s ARG 251 Ca 0.00 -1.18 -0.32 0.00 -0.52 0.00 0.00 55.73 53.71 2w3s s ARG 251 Cb 0.00 -1.87 -0.14 0.00 0.52 0.00 0.00 34.95 33.46 2w3s s ARG 251 CO 0.00 0.47 1.39 -2.30 0.02 0.00 0.00 175.30 174.87 2w3s n PRO 252 N 1.44 1.85 -3.85 3.54 -0.02 -1.26 -4.25 135.00 132.45 2w3s n PRO 252 Ca -0.17 0.66 -0.28 0.00 -2.02 0.00 0.00 63.50 61.69 2w3s n PRO 252 Cb 0.53 -2.30 -0.17 0.00 -0.02 0.00 0.00 33.50 31.54 2w3s n PRO 252 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s s LYS 254 N 1.70 2.82 -0.02 0.00 2.20 -0.01 -0.32 119.74 126.11 2w3s s LYS 254 Ca 0.01 -0.56 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 2w3s s LYS 254 Cb -0.15 -2.69 0.03 0.00 -1.51 0.00 0.00 37.83 33.50 2w3s s LYS 254 CO -0.07 0.64 0.02 1.41 -0.36 0.00 0.00 175.35 176.99 2w3s s MET 255 N -1.36 0.10 -0.01 4.03 1.75 -0.56 -1.30 119.30 121.95 2w3s s MET 255 Ca 0.18 0.13 0.02 0.00 -1.25 0.00 0.00 55.69 54.77 2w3s s MET 255 Cb -0.11 -0.34 -0.00 0.00 2.84 0.00 0.00 34.83 37.22 2w3s s MET 255 CO 0.08 -0.15 -0.06 -0.98 -0.65 0.00 0.00 175.02 173.26 2w3s s ARG 256 N 1.00 0.54 0.02 4.11 1.70 -1.26 -0.54 118.95 124.51 2w3s s ARG 256 Ca -0.09 -0.20 -0.30 0.00 -0.47 0.00 0.00 55.73 54.66 2w3s s ARG 256 Cb -0.13 -0.53 -0.05 0.00 -0.57 0.00 0.00 34.95 33.68 2w3s s ARG 256 CO -0.02 0.11 1.22 0.71 -1.08 0.00 0.00 175.30 176.23 2w3s s TYR 257 N -0.01 3.30 0.72 5.89 4.12 -0.79 -5.00 117.35 125.58 2w3s s TYR 257 Ca 0.01 1.23 -0.15 0.00 0.02 0.00 0.00 57.07 58.17 2w3s s TYR 257 Cb -0.04 -3.44 0.03 0.00 -1.52 0.00 0.00 41.96 36.99 2w3s s TYR 257 CO -0.00 -1.39 1.21 0.34 0.02 0.00 0.00 175.55 175.73 2w3s s ASP 258 N 1.28 4.28 0.22 2.29 -1.08 -1.26 -4.61 116.67 117.79 2w3s s ASP 258 Ca 0.58 2.36 -0.10 0.00 -0.52 0.00 0.00 52.55 54.87 2w3s s ASP 258 Cb -0.28 -2.59 0.31 0.00 -1.46 0.00 0.00 42.92 38.91 2w3s s ASP 258 CO 0.26 -2.20 1.68 -0.09 0.52 0.00 0.00 175.17 175.35 2w3s h ARG 259 N -0.20 0.19 -0.81 4.34 9.65 -1.95 -0.53 114.38 125.08 2w3s h ARG 259 Ca -0.48 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.36 2w3s h ARG 259 Cb 1.30 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.80 2w3s h ARG 259 CO 0.50 0.13 0.38 -0.44 2.80 0.00 0.00 179.97 183.33 2w3s h ASP 260 N 0.19 1.07 -0.57 -3.80 3.45 -1.91 -1.04 116.42 113.82 2w3s h ASP 260 Ca 0.33 -0.14 -0.09 0.00 0.43 0.00 0.00 57.03 57.55 2w3s h ASP 260 Cb 0.52 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.00 2w3s h ASP 260 CO -0.47 0.91 -0.00 0.44 -1.57 0.00 0.00 179.24 178.56 2w3s h ASP 261 N 1.15 1.00 0.02 6.45 3.32 -1.74 -2.26 116.42 124.35 2w3s h ASP 261 Ca 0.28 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 57.06 2w3s h ASP 261 Cb 0.14 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2w3s h ASP 261 CO -0.03 1.05 -0.08 -0.78 -1.72 0.00 0.00 179.24 177.68 2w3s h ASP 262 N 0.94 -0.23 0.73 6.45 3.58 -0.30 0.56 116.42 128.15 2w3s h ASP 262 Ca 0.17 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 2w3s h ASP 262 Cb 0.54 0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.69 2w3s h ASP 262 CO 0.03 -0.12 -0.04 0.24 -2.88 0.00 0.00 179.24 176.47 2w3s h MET 263 N -0.15 0.00 0.08 0.28 2.86 -1.16 -1.90 114.93 114.95 2w3s h MET 263 Ca 0.03 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.35 2w3s h MET 263 Cb 0.18 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 2w3s h MET 263 CO -0.07 0.04 -1.75 0.28 1.06 0.00 0.00 176.91 176.47 2w3s n VAL 264 N -3.19 1.70 -0.02 -2.22 0.31 -0.76 -4.56 118.33 109.58 2w3s n VAL 264 Ca -0.00 -0.44 -0.16 0.00 -0.01 0.00 0.00 64.34 63.73 2w3s n VAL 264 Cb 0.27 -1.84 -0.11 0.00 -0.91 0.00 0.00 33.84 31.24 2w3s n VAL 264 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2w3s h ILE 265 N -0.30 1.49 -3.92 2.52 2.04 0.12 -3.44 117.51 116.01 2w3s h ILE 265 Ca -0.40 -1.94 -0.50 0.00 1.00 0.00 0.00 64.86 63.02 2w3s h ILE 265 Cb 1.79 2.64 0.05 0.00 -0.74 0.00 0.00 36.82 40.56 2w3s h ILE 265 CO -0.02 0.54 0.25 0.42 0.00 0.00 0.00 178.15 179.35 2w3s s THR 266 N -3.24 4.70 0.94 -0.27 -4.23 -0.72 -4.78 115.64 108.04 2w3s s THR 266 Ca -0.15 0.47 -0.12 0.00 -1.18 0.00 0.00 61.69 60.71 2w3s s THR 266 Cb 0.02 -3.83 0.15 0.00 1.34 0.00 0.00 72.50 70.18 2w3s s THR 266 CO 0.77 -0.94 1.10 -0.83 -0.54 0.00 0.00 174.62 174.17 2w3s s GLY 267 N -4.16 1.59 0.23 3.99 0.00 -1.22 -4.81 107.32 102.95 2w3s s GLY 267 Ca 0.51 -0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.00 2w3s s GLY 267 CO 0.49 0.31 0.12 0.54 0.00 0.00 0.00 173.10 174.56 2w3s s LYS 268 N -4.99 1.33 0.33 2.90 1.02 -1.26 -4.79 119.74 114.28 2w3s s LYS 268 Ca 0.64 -1.71 -0.29 0.00 0.02 0.00 0.00 55.97 54.63 2w3s s LYS 268 Cb -0.18 0.02 -0.11 0.00 -0.52 0.00 0.00 37.83 37.04 2w3s s LYS 268 CO 0.57 -0.36 1.54 -2.13 -0.92 0.00 0.00 175.35 174.05 2w3s n ARG 269 N -0.38 2.68 -1.68 1.68 0.63 -0.62 -2.09 116.66 116.88 2w3s n ARG 269 Ca 0.01 0.95 -0.42 0.00 -0.92 0.00 0.00 57.85 57.47 2w3s n ARG 269 Cb 0.66 -2.70 -0.03 0.00 0.45 0.00 0.00 32.46 30.84 2w3s n ARG 269 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2w3s s HIS 270 N -0.53 1.28 0.43 -0.14 3.76 -1.26 -3.44 115.29 115.39 2w3s s HIS 270 Ca 0.59 -0.39 -0.14 0.00 -0.15 0.00 0.00 55.06 54.97 2w3s s HIS 270 Cb -0.49 -4.22 -0.08 0.00 1.11 0.00 0.00 32.58 28.90 2w3s s HIS 270 CO 0.56 -5.45 0.85 0.16 -0.85 0.00 0.00 174.74 170.01 2w3s s ASP 271 N 4.67 6.63 0.02 1.40 -4.77 -1.26 -4.62 116.67 118.74 2w3s s ASP 271 Ca 0.89 1.35 0.02 0.00 -3.30 0.00 0.00 52.55 51.51 2w3s s ASP 271 Cb -0.42 -2.41 -0.01 0.00 -1.09 0.00 0.00 42.92 38.99 2w3s s ASP 271 CO 0.41 -0.43 -0.06 -0.36 0.70 0.00 0.00 175.17 175.43 2w3s s PHE 272 N -2.38 0.53 -0.13 2.11 0.08 -0.11 -1.74 117.98 116.33 2w3s s PHE 272 Ca 0.55 -0.28 -0.02 0.00 0.12 0.00 0.00 56.93 57.30 2w3s s PHE 272 Cb -0.10 -0.33 -0.03 0.00 -0.57 0.00 0.00 43.02 42.00 2w3s s PHE 272 CO 0.28 -0.05 -0.06 0.50 -0.10 0.00 0.00 175.22 175.79 2w3s s ARG 273 N -0.81 3.45 -0.11 0.44 3.52 0.54 -0.17 118.95 125.81 2w3s s ARG 273 Ca -0.04 -0.55 -0.00 0.00 -0.13 0.00 0.00 55.73 55.00 2w3s s ARG 273 Cb -0.06 -2.80 0.02 0.00 -1.56 0.00 0.00 34.95 30.55 2w3s s ARG 273 CO 0.00 0.32 -0.08 0.42 -0.81 0.00 0.00 175.30 175.15 2w3s s ILE 274 N 0.13 1.04 -0.13 4.11 1.01 -0.95 -0.09 121.20 126.33 2w3s s ILE 274 Ca -0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 2w3s s ILE 274 Cb -0.14 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 2w3s s ILE 274 CO 0.03 0.37 -0.03 -0.60 0.00 0.00 0.00 174.94 174.71 2w3s s ARG 275 N 1.59 3.41 0.03 2.79 3.52 -0.17 -1.26 118.95 128.86 2w3s s ARG 275 Ca 0.03 -0.49 0.01 0.00 -0.13 0.00 0.00 55.73 55.15 2w3s s ARG 275 Cb -0.13 -2.86 -0.02 0.00 -1.56 0.00 0.00 34.95 30.38 2w3s s ARG 275 CO -0.07 0.41 -0.06 1.52 -0.81 0.00 0.00 175.30 176.29 2w3s s TYR 276 N -0.08 0.49 -0.05 5.12 -0.85 -0.15 0.50 117.35 122.31 2w3s s TYR 276 Ca 0.03 -0.50 -0.01 0.00 -0.52 0.00 0.00 57.07 56.07 2w3s s TYR 276 Cb -0.13 -0.31 0.03 0.00 0.38 0.00 0.00 41.96 41.93 2w3s s TYR 276 CO 0.02 -0.12 0.00 1.03 -1.52 0.00 0.00 175.55 174.96 2w3s s ARG 277 N -1.47 0.48 0.01 -3.49 0.52 0.94 -2.41 118.95 113.52 2w3s s ARG 277 Ca -0.12 0.10 0.04 0.00 -0.52 0.00 0.00 55.73 55.23 2w3s s ARG 277 Cb -0.10 -0.77 -0.01 0.00 0.52 0.00 0.00 34.95 34.59 2w3s s ARG 277 CO -0.00 -0.23 -0.12 -1.50 0.02 0.00 0.00 175.30 173.47 2w3s s ILE 278 N 1.60 0.92 0.03 1.52 2.07 0.05 0.30 121.20 127.69 2w3s s ILE 278 Ca -0.01 -0.71 0.02 0.00 -1.41 0.00 0.00 60.65 58.53 2w3s s ILE 278 Cb -0.13 -0.81 -0.02 0.00 0.13 0.00 0.00 42.46 41.63 2w3s s ILE 278 CO -0.03 0.10 -0.07 -0.83 -1.91 0.00 0.00 174.94 172.20 2w3s s GLY 279 N -0.70 0.44 0.15 1.50 0.00 -0.56 -0.70 107.32 107.45 2w3s s GLY 279 Ca 0.02 -0.67 -0.02 0.00 0.00 0.00 0.00 44.72 44.04 2w3s s GLY 279 CO 0.00 -0.72 0.11 0.00 0.00 0.00 0.00 173.10 172.49 2w3s s ALA 280 N -1.24 0.82 1.22 3.20 0.00 -0.67 -0.37 121.76 124.71 2w3s s ALA 280 Ca -0.09 -1.45 -0.17 0.00 0.00 0.00 0.00 51.96 50.25 2w3s s ALA 280 Cb -0.09 0.99 0.25 0.00 0.00 0.00 0.00 23.12 24.28 2w3s s ALA 280 CO 0.00 -0.54 0.63 -0.25 0.00 0.00 0.00 175.76 175.61 2w3s n ASP 281 N -0.15 -2.55 -0.05 0.00 10.43 -0.34 -2.12 116.55 121.77 2w3s n ASP 281 Ca -0.04 -0.33 0.01 0.00 2.57 0.00 0.00 54.79 57.00 2w3s n ASP 281 Cb 0.64 -1.08 0.31 0.00 1.84 0.00 0.00 41.12 42.83 2w3s n ASP 281 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2w3s h ALA 282 N -2.73 1.45 0.00 2.24 0.00 -1.92 -3.02 119.26 115.27 2w3s h ALA 282 Ca -0.54 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.21 2w3s h ALA 282 Cb 1.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2w3s h ALA 282 CO 0.39 0.42 -0.14 0.66 0.00 0.00 0.00 179.25 180.58 2w3s h SER 283 N 0.62 0.00 0.00 0.00 4.64 -2.02 -3.47 113.55 113.32 2w3s h SER 283 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2w3s h SER 283 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2w3s h SER 283 CO -0.01 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 2w3s n GLY 284 N 0.51 1.53 3.66 -0.77 0.00 -1.14 -5.09 105.19 103.89 2w3s n GLY 284 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2w3s n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3s s LYS 285 N -0.49 4.11 0.07 1.61 -0.14 -1.26 -4.77 119.74 118.87 2w3s s LYS 285 Ca 0.00 -0.09 -0.34 0.00 -1.36 0.00 0.00 55.97 54.18 2w3s s LYS 285 Cb 0.00 -3.54 -0.13 0.00 -1.68 0.00 0.00 37.83 32.48 2w3s s LYS 285 CO 0.00 0.02 1.67 1.28 -0.76 0.00 0.00 175.35 177.56 2w3s n LEU 286 N 4.36 3.15 -0.08 3.17 4.77 -1.26 -1.19 117.00 129.92 2w3s n LEU 286 Ca -0.12 1.05 -0.11 0.00 -0.03 0.00 0.00 56.01 56.79 2w3s n LEU 286 Cb 0.52 -1.40 -0.15 0.00 -2.33 0.00 0.00 43.42 40.06 2w3s n LEU 286 CO 0.37 -0.24 -1.00 0.18 -1.33 0.00 0.00 177.39 175.36 2w3s n LEU 287 N 4.43 0.80 -3.65 2.23 4.77 0.50 -4.31 117.00 121.77 2w3s n LEU 287 Ca 0.19 0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 56.25 2w3s n LEU 287 Cb 0.28 0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 2w3s n LEU 287 CO 0.67 0.56 1.21 -0.83 -1.33 0.00 0.00 177.39 177.66 2w3s s GLY 288 N -5.54 0.33 -0.00 -0.72 0.00 -1.19 -2.81 107.32 97.38 2w3s s GLY 288 Ca -0.13 3.41 0.05 0.00 0.00 0.00 0.00 44.72 48.05 2w3s s GLY 288 CO 0.79 1.70 -0.15 0.00 0.00 0.00 0.00 173.10 175.43 2w3s s ALA 289 N -0.31 1.29 -0.13 3.20 0.00 0.76 -1.49 121.76 125.08 2w3s s ALA 289 Ca 0.09 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.34 2w3s s ALA 289 Cb -0.04 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.80 2w3s s ALA 289 CO -0.14 0.31 -0.11 0.34 0.00 0.00 0.00 175.76 176.15 2w3s s ASP 290 N -0.50 2.42 -0.04 0.00 2.15 0.15 -1.17 116.67 119.67 2w3s s ASP 290 Ca 0.05 -0.40 0.07 0.00 0.43 0.00 0.00 52.55 52.71 2w3s s ASP 290 Cb -0.06 -1.01 -0.01 0.00 -0.30 0.00 0.00 42.92 41.53 2w3s s ASP 290 CO -0.00 -0.08 -0.25 -0.36 -0.17 0.00 0.00 175.17 174.31 2w3s s PHE 291 N 1.54 2.36 -0.17 -5.34 0.40 0.49 -0.04 117.98 117.22 2w3s s PHE 291 Ca 0.04 -0.61 0.01 0.00 -0.60 0.00 0.00 56.93 55.77 2w3s s PHE 291 Cb -0.13 -1.54 0.02 0.00 0.51 0.00 0.00 43.02 41.88 2w3s s PHE 291 CO -0.09 -0.15 -0.17 0.08 0.70 0.00 0.00 175.22 175.59 2w3s s VAL 292 N -0.32 1.85 -0.23 -0.44 1.01 0.18 -1.32 120.40 121.12 2w3s s VAL 292 Ca 0.01 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 61.06 2w3s s VAL 292 Cb -0.12 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2w3s s VAL 292 CO 0.02 0.47 0.10 -1.00 0.00 0.00 0.00 175.10 174.69 2w3s s HIS 293 N 1.37 3.22 -0.33 5.22 3.76 0.27 -1.00 115.29 127.80 2w3s s HIS 293 Ca 0.04 -0.01 0.00 0.00 -0.15 0.00 0.00 55.06 54.94 2w3s s HIS 293 Cb -0.13 -2.21 0.08 0.00 1.11 0.00 0.00 32.58 31.43 2w3s s HIS 293 CO -0.12 -0.04 0.04 -0.51 -0.85 0.00 0.00 174.74 173.26 2w3s s LEU 294 N 1.04 4.35 -0.07 0.89 1.43 0.87 -0.97 118.68 126.21 2w3s s LEU 294 Ca 0.05 -1.70 -0.04 0.00 -1.03 0.00 0.00 54.13 51.42 2w3s s LEU 294 Cb -0.14 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 2w3s s LEU 294 CO 0.04 -0.34 0.11 0.00 0.23 0.00 0.00 176.35 176.38 2w3s s ALA 295 N 1.11 3.72 -0.50 4.21 0.00 -0.34 -0.34 121.76 129.62 2w3s s ALA 295 Ca 0.01 -0.74 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 2w3s s ALA 295 Cb -0.20 -1.79 0.06 0.00 0.00 0.00 0.00 23.12 21.19 2w3s s ALA 295 CO -0.04 0.65 0.58 0.50 0.00 0.00 0.00 175.76 177.44 2w3s s ARG 296 N -1.28 3.09 0.13 0.00 3.52 -0.71 -1.40 118.95 122.29 2w3s s ARG 296 Ca 0.18 -1.01 0.22 0.00 -0.13 0.00 0.00 55.73 54.99 2w3s s ARG 296 Cb -0.12 -4.11 -0.10 0.00 -1.56 0.00 0.00 34.95 29.05 2w3s s ARG 296 CO 0.08 -1.19 0.87 0.00 -0.81 0.00 0.00 175.30 174.25 2w3s n GLY 298 N 1.21 -1.87 0.18 0.00 0.00 -1.25 -0.91 105.19 102.56 2w3s n GLY 298 Ca -0.01 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.70 2w3s n GLY 298 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2w3s h TRP 299 N 0.00 0.00 -3.70 1.61 5.08 -0.54 -2.85 115.95 115.55 2w3s h TRP 299 Ca 0.00 0.00 -0.30 0.00 1.08 0.00 0.00 58.89 59.67 2w3s h TRP 299 Cb 0.00 0.00 -0.17 0.00 -3.00 0.00 0.00 29.16 25.99 2w3s h TRP 299 CO 0.00 0.00 -0.72 -1.54 -1.28 0.00 0.00 178.44 174.90 2w3s s SER 300 N -5.77 1.42 0.08 0.11 1.04 -1.26 -4.93 113.70 104.39 2w3s s SER 300 Ca 0.07 -0.87 -0.20 0.00 0.48 0.00 0.00 55.95 55.43 2w3s s SER 300 Cb 0.07 0.02 -0.07 0.00 0.10 0.00 0.00 66.02 66.14 2w3s s SER 300 CO 0.67 -0.31 1.33 0.00 0.98 0.00 0.00 173.24 175.92 2w3s h ALA 301 N 3.37 -0.62 -0.67 5.32 0.00 -1.88 -3.42 119.26 121.35 2w3s h ALA 301 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2w3s h ALA 301 Cb 1.19 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.91 2w3s h ALA 301 CO 0.56 -0.78 0.00 -3.47 0.00 0.00 0.00 179.25 175.57 2w3s n ASP 302 N -4.33 0.00 -1.15 0.00 -0.08 -1.26 -1.86 116.55 107.87 2w3s n ASP 302 Ca -0.03 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.34 2w3s n ASP 302 Cb 0.21 0.00 0.30 0.00 2.34 0.00 0.00 41.12 43.97 2w3s n ASP 302 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2w3s n LEU 303 N 0.00 4.37 0.12 -2.67 4.77 -1.26 -4.06 117.00 118.27 2w3s n LEU 303 Ca 0.00 -3.01 0.09 0.00 -0.03 0.00 0.00 56.01 53.06 2w3s n LEU 303 Cb 0.00 -0.58 0.58 0.00 -2.33 0.00 0.00 43.42 41.09 2w3s n LEU 303 CO 0.00 0.67 1.12 0.28 -1.33 0.00 0.00 177.39 178.13 2w3s h SER 304 N 2.34 0.15 0.48 -1.43 0.02 -1.57 -0.74 113.55 112.80 2w3s h SER 304 Ca 0.00 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2w3s h SER 304 Cb 1.59 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 64.10 2w3s h SER 304 CO 0.30 0.10 -0.23 0.25 -1.14 0.00 0.00 176.83 176.11 2w3s h LEU 305 N 0.17 -0.55 -0.56 5.07 6.46 -1.83 -1.99 115.31 122.08 2w3s h LEU 305 Ca 0.10 -0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.91 2w3s h LEU 305 Cb 0.19 0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 40.21 2w3s h LEU 305 CO -0.02 -0.13 0.23 -0.65 -0.62 0.00 0.00 178.44 177.26 2w3s h PRO 306 N -1.12 0.43 -0.73 5.25 0.11 -1.89 -1.30 132.00 132.75 2w3s h PRO 306 Ca -0.07 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.13 2w3s h PRO 306 Cb 0.54 -0.10 -0.08 0.00 0.11 0.00 0.00 31.00 31.47 2w3s h PRO 306 CO 0.11 0.28 0.34 0.28 -0.21 0.00 0.00 178.00 178.80 2w3s h VAL 307 N 0.44 0.78 0.00 3.15 2.07 -1.16 -1.50 116.25 120.03 2w3s h VAL 307 Ca 0.27 -0.19 -0.15 0.00 0.82 0.00 0.00 66.70 67.45 2w3s h VAL 307 Cb 0.28 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 2w3s h VAL 307 CO -0.25 0.10 -0.73 0.00 0.02 0.00 0.00 177.57 176.71 2w3s h ASP 309 N 0.00 0.18 -0.90 0.00 3.32 -0.67 -2.64 116.42 115.72 2w3s h ASP 309 Ca -0.01 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2w3s h ASP 309 Cb 1.35 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.85 2w3s h ASP 309 CO 0.10 0.14 0.57 -0.09 -1.72 0.00 0.00 179.24 178.24 2w3s h ARG 310 N 0.30 1.20 -0.99 3.56 2.43 -0.50 0.54 114.38 120.92 2w3s h ARG 310 Ca 0.15 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.29 2w3s h ARG 310 Cb 0.09 -0.26 -0.06 0.00 -0.42 0.00 0.00 29.97 29.31 2w3s h ARG 310 CO -0.13 0.81 0.64 0.00 -1.51 0.00 0.00 179.97 179.79 2w3s h ALA 311 N 1.31 1.41 -0.11 2.80 0.00 -1.27 -1.63 119.26 121.78 2w3s h ALA 311 Ca 0.33 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2w3s h ALA 311 Cb -0.10 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.37 2w3s h ALA 311 CO -0.07 0.45 -0.06 0.52 0.00 0.00 0.00 179.25 180.09 2w3s h MET 312 N 1.17 0.23 -0.82 0.00 2.86 -0.87 -2.19 114.93 115.30 2w3s h MET 312 Ca 0.42 -0.10 0.18 0.00 -2.06 0.00 0.00 59.70 58.14 2w3s h MET 312 Cb 0.14 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.74 2w3s h MET 312 CO -0.16 0.59 0.55 -0.07 1.06 0.00 0.00 176.91 178.89 2w3s h LEU 313 N -0.14 0.36 -3.04 1.22 4.07 -0.62 -1.42 115.31 115.74 2w3s h LEU 313 Ca 0.02 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2w3s h LEU 313 Cb 0.53 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.23 2w3s h LEU 313 CO 0.02 0.16 0.00 1.41 -1.08 0.00 0.00 178.44 178.95 2w3s n HIS 314 N -4.47 1.06 0.26 1.13 8.25 -0.64 -4.44 115.22 116.36 2w3s n HIS 314 Ca 0.17 -0.61 0.11 0.00 -0.26 0.00 0.00 57.72 57.14 2w3s n HIS 314 Cb 0.64 -0.16 0.55 0.00 1.12 0.00 0.00 29.99 32.14 2w3s n HIS 314 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2w3s n ALA 315 N 0.80 1.31 1.55 -1.41 0.00 -0.54 -1.69 120.51 120.53 2w3s n ALA 315 Ca 0.21 0.15 0.15 0.00 0.00 0.00 0.00 53.44 53.95 2w3s n ALA 315 Cb 0.73 -1.35 0.76 0.00 0.00 0.00 0.00 19.45 19.59 2w3s n ALA 315 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3s n ASP 316 N -2.26 0.17 0.00 0.00 5.75 -1.26 -4.46 116.55 114.48 2w3s n ASP 316 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 2w3s n ASP 316 Cb 0.12 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 2w3s n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w3s n GLY 317 N 1.22 2.36 0.69 6.12 0.00 -0.68 -1.03 105.19 113.87 2w3s n GLY 317 Ca 0.17 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2w3s n GLY 317 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2w3s n SER 318 N 0.68 2.03 -4.46 1.61 7.64 -1.26 -4.64 113.62 115.21 2w3s n SER 318 Ca 0.00 -1.85 -0.32 0.00 1.01 0.00 0.00 58.87 57.71 2w3s n SER 318 Cb 0.00 -0.18 -0.13 0.00 -1.01 0.00 0.00 64.21 62.89 2w3s n SER 318 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2w3s s TYR 319 N -1.64 2.63 0.05 1.43 1.51 -0.19 -3.27 117.35 117.88 2w3s s TYR 319 Ca 0.31 -0.21 -0.31 0.00 -1.01 0.00 0.00 57.07 55.86 2w3s s TYR 319 Cb 0.17 -1.56 -0.06 0.00 -0.11 0.00 0.00 41.96 40.40 2w3s s TYR 319 CO 0.24 0.20 1.22 0.12 -1.11 0.00 0.00 175.55 176.22 2w3s s PHE 320 N -0.81 3.38 -0.19 2.71 5.36 -0.77 -4.83 117.98 122.82 2w3s s PHE 320 Ca 0.13 1.25 -0.02 0.00 -0.96 0.00 0.00 56.93 57.33 2w3s s PHE 320 Cb -0.11 -3.45 0.06 0.00 -0.34 0.00 0.00 43.02 39.18 2w3s s PHE 320 CO 0.03 -1.42 -0.00 0.08 -1.46 0.00 0.00 175.22 172.45 2w3s s VAL 321 N 1.22 0.85 0.17 3.12 1.01 -1.26 -4.72 120.40 120.79 2w3s s VAL 321 Ca 0.59 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 61.62 2w3s s VAL 321 Cb -0.30 -1.24 0.06 0.00 0.00 0.00 0.00 36.38 34.91 2w3s s VAL 321 CO 0.29 -0.12 1.57 -0.65 0.00 0.00 0.00 175.10 176.19 2w3s h PRO 322 N 8.16 -0.20 -5.37 2.72 0.11 -1.75 -3.40 132.00 132.28 2w3s h PRO 322 Ca -0.18 0.01 -0.59 0.00 0.11 0.00 0.00 66.00 65.36 2w3s h PRO 322 Cb 1.11 0.05 -0.32 0.00 0.11 0.00 0.00 31.00 31.95 2w3s h PRO 322 CO 0.36 -0.13 -0.85 0.00 -0.21 0.00 0.00 178.00 177.17 2w3s s ALA 323 N -5.88 1.67 -0.15 -0.75 0.00 -1.12 -4.48 121.76 111.04 2w3s s ALA 323 Ca -0.14 -0.75 -0.07 0.00 0.00 0.00 0.00 51.96 50.99 2w3s s ALA 323 Cb 0.14 -0.56 0.06 0.00 0.00 0.00 0.00 23.12 22.76 2w3s s ALA 323 CO 0.67 0.29 0.36 -1.17 0.00 0.00 0.00 175.76 175.90 2w3s s LEU 324 N 0.08 -0.09 -0.02 0.00 0.20 -0.65 -0.17 118.68 118.02 2w3s s LEU 324 Ca -0.06 0.79 0.07 0.00 0.69 0.00 0.00 54.13 55.61 2w3s s LEU 324 Cb -0.13 1.13 -0.02 0.00 -0.43 0.00 0.00 46.19 46.74 2w3s s LEU 324 CO 0.03 -0.20 -0.22 -0.60 -0.29 0.00 0.00 176.35 175.07 2w3s s ARG 325 N 1.70 1.85 -0.05 1.98 3.52 -0.32 -1.46 118.95 126.16 2w3s s ARG 325 Ca -0.07 -0.79 0.04 0.00 -0.13 0.00 0.00 55.73 54.78 2w3s s ARG 325 Cb -0.10 -1.75 0.00 0.00 -1.56 0.00 0.00 34.95 31.54 2w3s s ARG 325 CO -0.11 0.45 -0.17 0.42 -0.81 0.00 0.00 175.30 175.09 2w3s s ILE 326 N -0.46 1.42 -0.23 4.11 1.01 0.12 -0.38 121.20 126.78 2w3s s ILE 326 Ca 0.07 -0.69 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 2w3s s ILE 326 Cb -0.09 -1.23 0.03 0.00 0.01 0.00 0.00 42.46 41.17 2w3s s ILE 326 CO -0.00 0.41 -0.10 -0.70 0.00 0.00 0.00 174.94 174.55 2w3s s GLU 327 N 0.22 2.80 -0.30 2.79 2.12 -0.44 -0.74 118.70 125.15 2w3s s GLU 327 Ca -0.08 -0.99 0.00 0.00 0.36 0.00 0.00 54.97 54.27 2w3s s GLU 327 Cb -0.13 -2.89 0.07 0.00 0.26 0.00 0.00 34.13 31.44 2w3s s GLU 327 CO 0.03 -0.38 -0.01 0.45 -0.54 0.00 0.00 175.26 174.82 2w3s s SER 328 N 1.29 4.78 -0.27 -1.70 0.15 0.14 -0.56 113.70 117.52 2w3s s SER 328 Ca 0.00 -1.51 -0.13 0.00 0.70 0.00 0.00 55.95 55.01 2w3s s SER 328 Cb -0.16 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.44 2w3s s SER 328 CO -0.06 -0.28 0.30 -1.00 1.20 0.00 0.00 173.24 173.40 2w3s s HIS 329 N 1.15 3.24 -0.68 3.44 3.76 -0.15 -0.67 115.29 125.38 2w3s s HIS 329 Ca -0.03 0.30 -0.10 0.00 -0.15 0.00 0.00 55.06 55.08 2w3s s HIS 329 Cb -0.20 -2.50 0.18 0.00 1.11 0.00 0.00 32.58 31.17 2w3s s HIS 329 CO -0.04 -0.20 0.58 1.03 -0.85 0.00 0.00 174.74 175.26 2w3s s ARG 330 N 1.95 3.07 -0.07 1.40 1.81 -1.26 -1.19 118.95 124.65 2w3s s ARG 330 Ca 0.12 -2.28 -0.20 0.00 -1.72 0.00 0.00 55.73 51.65 2w3s s ARG 330 Cb -0.16 -4.14 -0.04 0.00 -0.45 0.00 0.00 34.95 30.15 2w3s s ARG 330 CO 0.10 -1.25 0.58 -0.51 -0.68 0.00 0.00 175.30 173.54 2w3s s LEU 331 N 0.47 4.33 -0.07 2.53 1.43 -0.50 -0.88 118.68 125.99 2w3s s LEU 331 Ca 0.14 1.03 -0.25 0.00 -1.03 0.00 0.00 54.13 54.02 2w3s s LEU 331 Cb -0.18 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.13 2w3s s LEU 331 CO -0.05 -0.01 0.76 -0.60 0.23 0.00 0.00 176.35 176.69 2w3s s ARG 332 N 0.45 4.44 0.08 1.70 3.52 -0.53 -1.53 118.95 127.08 2w3s s ARG 332 Ca 0.31 0.99 0.01 0.00 -0.13 0.00 0.00 55.73 56.91 2w3s s ARG 332 Cb -0.17 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 2w3s s ARG 332 CO 0.15 0.00 -0.06 0.95 -0.81 0.00 0.00 175.30 175.53 2w3s s THR 333 N 0.98 0.54 -0.07 4.11 -4.23 -1.08 -4.54 115.64 111.36 2w3s s THR 333 Ca 0.40 -1.72 -0.04 0.00 -1.18 0.00 0.00 61.69 59.14 2w3s s THR 333 Cb -0.18 -1.41 -0.16 0.00 1.34 0.00 0.00 72.50 72.09 2w3s s THR 333 CO 0.19 -0.80 3.16 0.59 -0.54 0.00 0.00 174.62 177.22 2w3s n ASN 334 N 0.31 5.46 -4.07 3.99 4.13 0.14 -1.63 115.26 123.59 2w3s n ASN 334 Ca -0.15 -2.58 -0.24 0.00 1.68 0.00 0.00 54.58 53.29 2w3s n ASN 334 Cb 0.60 -1.33 -0.08 0.00 -1.54 0.00 0.00 39.78 37.42 2w3s n ASN 334 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2w3s s THR 335 N 0.28 0.56 0.05 3.41 -4.23 -1.26 -4.45 115.64 110.00 2w3s s THR 335 Ca 0.52 -2.00 -0.38 0.00 -1.18 0.00 0.00 61.69 58.66 2w3s s THR 335 Cb 0.27 -2.40 -0.19 0.00 1.34 0.00 0.00 72.50 71.52 2w3s s THR 335 CO -0.03 0.00 1.10 0.00 -0.54 0.00 0.00 174.62 175.15 2w3s n GLN 336 N -0.85 0.37 -2.02 3.99 3.00 -1.26 -1.84 117.38 118.77 2w3s n GLN 336 Ca -0.04 0.13 -0.43 0.00 -0.01 0.00 0.00 57.00 56.66 2w3s n GLN 336 Cb 0.65 -1.63 -0.03 0.00 0.00 0.00 0.00 30.24 29.23 2w3s n GLN 336 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2w3s s SER 337 N 0.04 6.25 0.47 1.08 0.15 -1.26 -3.86 113.70 116.57 2w3s s SER 337 Ca 0.86 1.69 -0.17 0.00 0.70 0.00 0.00 55.95 59.03 2w3s s SER 337 Cb -1.13 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 60.56 2w3s s SER 337 CO 0.54 -1.35 0.94 0.20 1.20 0.00 0.00 173.24 174.76 2w3s s ASN 338 N 4.81 6.69 0.00 5.45 0.01 -0.08 -3.44 114.94 128.38 2w3s s ASN 338 Ca 0.76 1.52 0.00 0.00 -0.71 0.00 0.00 52.86 54.44 2w3s s ASN 338 Cb -0.27 -2.48 0.00 0.00 0.41 0.00 0.00 41.25 38.91 2w3s s ASN 338 CO 0.31 -0.49 0.00 1.07 -1.51 0.00 0.00 177.10 176.48 2w3s n THR 339 N -1.26 0.00 -2.16 1.60 5.66 -0.89 -4.27 114.28 112.97 2w3s n THR 339 Ca 0.06 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.64 2w3s n THR 339 Cb 0.54 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.29 2w3s n THR 339 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2w3s s ALA 340 N -1.98 3.59 -0.00 1.79 0.00 -1.26 -4.52 121.76 119.37 2w3s s ALA 340 Ca 0.00 1.15 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 2w3s s ALA 340 Cb 0.00 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.59 2w3s s ALA 340 CO 0.00 -0.61 0.01 0.12 0.00 0.00 0.00 175.76 175.28 2w3s s PHE 341 N 0.73 0.05 -0.28 0.00 5.99 -1.26 -3.26 117.98 119.95 2w3s s PHE 341 Ca 0.62 -0.10 -0.14 0.00 0.00 0.00 0.00 56.93 57.31 2w3s s PHE 341 Cb -0.37 -0.04 -0.08 0.00 0.00 0.00 0.00 43.02 42.52 2w3s s PHE 341 CO 0.34 -0.07 0.91 -2.13 -0.00 0.00 0.00 175.22 174.27 2w3s n ARG 342 N 2.64 0.00 0.00 10.12 0.63 -0.78 0.11 116.66 129.37 2w3s n ARG 342 Ca -0.15 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.78 2w3s n ARG 342 Cb 0.58 -0.57 0.00 0.00 0.45 0.00 0.00 32.46 32.93 2w3s n ARG 342 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w3s n GLY 343 N 2.64 2.12 3.94 5.14 0.00 -1.26 -4.85 105.19 112.92 2w3s n GLY 343 Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 2w3s n GLY 343 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2w3s n PHE 344 N -0.42 -1.84 0.00 1.61 7.35 0.30 -0.91 117.46 123.54 2w3s n PHE 344 Ca 0.00 0.81 0.00 0.00 -0.76 0.00 0.00 57.45 57.50 2w3s n PHE 344 Cb 0.00 -3.80 0.00 0.00 0.35 0.00 0.00 39.48 36.03 2w3s n PHE 344 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2w3s n GLY 345 N -1.74 2.37 0.28 7.13 0.00 -1.26 -4.51 105.19 107.46 2w3s n GLY 345 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 2w3s n GLY 345 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2w3s h GLY 346 N 0.00 1.03 0.80 -0.02 0.00 -1.22 -2.70 103.07 100.97 2w3s h GLY 346 Ca 0.00 -0.54 0.05 0.00 0.00 0.00 0.00 47.33 46.84 2w3s h GLY 346 CO 0.00 0.51 0.62 -2.55 0.00 0.00 0.00 176.54 175.12 2w3s h PRO 347 N 0.91 1.13 -0.09 4.80 0.11 -1.90 -1.72 132.00 135.24 2w3s h PRO 347 Ca 0.22 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 2w3s h PRO 347 Cb 0.17 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 31.02 2w3s h PRO 347 CO -0.02 0.75 0.02 1.96 -0.21 0.00 0.00 178.00 180.50 2w3s h GLN 348 N 1.17 0.14 -0.37 1.05 7.50 -1.91 0.10 115.11 122.79 2w3s h GLN 348 Ca 0.40 -0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.50 2w3s h GLN 348 Cb 0.09 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.58 2w3s h GLN 348 CO -0.15 0.32 0.18 0.78 -1.50 0.00 0.00 178.83 178.46 2w3s h GLY 349 N -0.06 0.57 0.93 3.46 0.00 -1.38 -1.49 103.07 105.10 2w3s h GLY 349 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 2w3s h GLY 349 CO -0.00 0.27 0.12 0.00 0.00 0.00 0.00 176.54 176.93 2w3s h ALA 350 N 1.03 0.31 -0.78 3.60 0.00 -1.17 -2.43 119.26 119.81 2w3s h ALA 350 Ca 0.13 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2w3s h ALA 350 Cb 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2w3s h ALA 350 CO -0.02 -0.14 0.52 1.25 0.00 0.00 0.00 179.25 180.86 2w3s h LEU 351 N 0.26 0.83 -0.31 0.00 5.85 -0.63 -0.37 115.31 120.94 2w3s h LEU 351 Ca 0.08 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.86 2w3s h LEU 351 Cb 0.11 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 40.86 2w3s h LEU 351 CO -0.01 0.57 -0.28 1.23 -0.34 0.00 0.00 178.44 179.61 2w3s h GLY 352 N 0.97 -0.20 0.99 3.75 0.00 -0.80 -1.51 103.07 106.27 2w3s h GLY 352 Ca 0.31 0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.94 2w3s h GLY 352 CO -0.09 -0.21 0.11 1.98 0.00 0.00 0.00 176.54 178.33 2w3s h MET 353 N -0.26 0.86 -0.00 4.80 1.85 -0.90 -2.81 114.93 118.48 2w3s h MET 353 Ca 0.15 -0.22 -0.05 0.00 -0.61 0.00 0.00 59.70 58.98 2w3s h MET 353 Cb 0.50 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.42 2w3s h MET 353 CO -0.46 0.83 -0.23 0.93 -0.40 0.00 0.00 176.91 177.59 2w3s h GLU 354 N 0.75 0.00 0.14 0.39 4.39 -0.88 -1.82 114.58 117.55 2w3s h GLU 354 Ca 0.16 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 2w3s h GLU 354 Cb 0.37 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2w3s h GLU 354 CO 0.01 0.23 -0.07 -0.09 -1.16 0.00 0.00 179.01 177.92 2w3s h ARG 355 N 0.00 -0.18 -0.55 2.33 1.12 -1.13 -2.00 114.38 113.97 2w3s h ARG 355 Ca -0.00 0.01 0.11 0.00 -1.11 0.00 0.00 59.98 58.99 2w3s h ARG 355 Cb 0.40 0.04 -0.11 0.00 -0.01 0.00 0.00 29.97 30.29 2w3s h ARG 355 CO 0.03 0.28 -0.24 0.00 -3.11 0.00 0.00 179.97 176.93 2w3s h ALA 356 N -0.24 0.15 -0.36 2.80 0.00 -1.43 0.19 119.26 120.38 2w3s h ALA 356 Ca -0.02 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2w3s h ALA 356 Cb 0.54 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2w3s h ALA 356 CO 0.03 -0.56 -0.01 0.97 0.00 0.00 0.00 179.25 179.68 2w3s h ILE 357 N -0.10 1.26 -0.75 0.00 2.10 -1.41 0.53 117.51 119.13 2w3s h ILE 357 Ca 0.25 -1.01 0.04 0.00 1.08 0.00 0.00 64.86 65.22 2w3s h ILE 357 Cb 0.50 1.21 -0.04 0.00 -1.09 0.00 0.00 36.82 37.40 2w3s h ILE 357 CO -0.62 0.33 0.50 -0.08 -1.08 0.00 0.00 178.15 177.20 2w3s h GLU 358 N 0.45 0.87 -0.26 2.19 4.57 -1.06 0.60 114.58 121.93 2w3s h GLU 358 Ca 0.10 -0.05 -0.17 0.00 -1.18 0.00 0.00 59.36 58.06 2w3s h GLU 358 Cb 0.48 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 2w3s h GLU 358 CO 0.02 0.57 -0.52 1.25 -1.18 0.00 0.00 179.01 179.16 2w3s h HIS 359 N 0.89 0.94 -0.47 0.92 2.76 -0.12 -2.45 115.15 117.63 2w3s h HIS 359 Ca 0.31 -0.32 -0.11 0.00 -2.20 0.00 0.00 60.37 58.04 2w3s h HIS 359 Cb 0.10 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.86 2w3s h HIS 359 CO -0.00 1.11 -0.14 1.25 -1.30 0.00 0.00 177.93 178.85 2w3s h LEU 360 N 0.59 0.95 -0.68 0.26 5.85 0.97 -1.46 115.31 121.78 2w3s h LEU 360 Ca 0.02 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 2w3s h LEU 360 Cb 1.10 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2w3s h LEU 360 CO 0.11 1.10 0.32 0.00 -0.34 0.00 0.00 178.44 179.63 2w3s h ALA 361 N 0.87 0.88 -0.06 1.25 0.00 0.20 -2.83 119.26 119.58 2w3s h ALA 361 Ca 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2w3s h ALA 361 Cb 0.71 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2w3s h ALA 361 CO 0.05 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2w3s h ARG 362 N 0.95 0.10 -1.22 0.00 2.47 -1.41 -1.72 114.38 113.55 2w3s h ARG 362 Ca 0.23 -0.03 0.35 0.00 -1.26 0.00 0.00 59.98 59.28 2w3s h ARG 362 Cb 0.13 -0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 28.35 2w3s h ARG 362 CO -0.03 0.36 0.83 0.78 0.56 0.00 0.00 179.97 182.47 2w3s h GLY 363 N -0.17 0.76 -1.76 0.04 0.00 -1.06 -1.85 103.07 99.03 2w3s h GLY 363 Ca 0.02 -0.10 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 2w3s h GLY 363 CO 0.00 -0.15 -0.32 1.15 0.00 0.00 0.00 176.54 177.22 2w3s n MET 364 N -4.45 1.89 -2.22 4.80 0.00 -1.08 -4.97 117.12 111.09 2w3s n MET 364 Ca 0.30 -3.34 -0.16 0.00 0.00 0.00 0.00 57.70 54.49 2w3s n MET 364 Cb 1.21 -1.78 -0.02 0.00 0.00 0.00 0.00 33.22 32.63 2w3s n MET 364 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w3s n GLY 365 N -1.08 -0.06 3.42 3.17 0.00 -0.70 -4.93 105.19 105.01 2w3s n GLY 365 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.99 2w3s n GLY 365 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3s s ARG 366 N -4.68 2.29 -0.13 1.61 6.06 -0.66 -5.06 118.95 118.38 2w3s s ARG 366 Ca 0.00 -0.83 -0.29 0.00 -2.50 0.00 0.00 55.73 52.11 2w3s s ARG 366 Cb 0.00 -2.23 -0.05 0.00 0.06 0.00 0.00 34.95 32.73 2w3s s ARG 366 CO 0.00 0.59 1.73 0.34 -2.50 0.00 0.00 175.30 175.46 2w3s s ASP 367 N -0.84 6.40 0.34 -2.12 2.15 -1.26 -4.27 116.67 117.06 2w3s s ASP 367 Ca 0.12 1.99 0.05 0.00 0.43 0.00 0.00 52.55 55.14 2w3s s ASP 367 Cb -0.10 -2.53 0.70 0.00 -0.30 0.00 0.00 42.92 40.69 2w3s s ASP 367 CO 0.01 -1.19 1.91 -0.65 -0.17 0.00 0.00 175.17 175.09 2w3s h PRO 368 N 10.73 0.80 -0.46 4.34 0.11 -1.95 -1.14 132.00 144.42 2w3s h PRO 368 Ca -0.38 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.72 2w3s h PRO 368 Cb 1.18 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 2w3s h PRO 368 CO 0.97 0.53 0.21 0.00 -0.21 0.00 0.00 178.00 179.50 2w3s h ALA 369 N 1.57 0.58 0.31 -0.75 0.00 -1.91 0.20 119.26 119.27 2w3s h ALA 369 Ca 0.39 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 2w3s h ALA 369 Cb 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2w3s h ALA 369 CO -0.15 -0.15 -0.15 1.49 0.00 0.00 0.00 179.25 180.29 2w3s h GLU 370 N 0.43 -0.41 -1.06 0.00 4.22 -1.63 -0.81 114.58 115.32 2w3s h GLU 370 Ca 0.21 0.03 0.29 0.00 0.08 0.00 0.00 59.36 59.96 2w3s h GLU 370 Cb 0.14 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 29.37 2w3s h GLU 370 CO -0.16 -0.11 0.66 1.25 -2.18 0.00 0.00 179.01 178.46 2w3s h LEU 371 N -0.70 0.49 0.40 1.64 5.85 -0.91 0.27 115.31 122.35 2w3s h LEU 371 Ca -0.04 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2w3s h LEU 371 Cb 0.48 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2w3s h LEU 371 CO 0.07 0.04 -0.19 0.03 -0.34 0.00 0.00 178.44 178.05 2w3s h ARG 372 N 0.40 -0.52 -0.56 1.25 3.08 -0.44 -3.08 114.38 114.52 2w3s h ARG 372 Ca 0.65 0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.85 2w3s h ARG 372 Cb 1.57 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.64 2w3s h ARG 372 CO -0.39 -0.21 -0.04 0.00 -1.07 0.00 0.00 179.97 178.26 2w3s h ALA 373 N -0.38 0.50 -0.47 0.04 0.00 0.39 0.24 119.26 119.58 2w3s h ALA 373 Ca -0.05 0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.18 2w3s h ALA 373 Cb 0.54 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2w3s h ALA 373 CO 0.09 -0.41 0.53 1.25 0.00 0.00 0.00 179.25 180.72 2w3s h LEU 374 N 0.08 0.00 -1.51 0.00 5.85 -0.58 -3.17 115.31 115.99 2w3s h LEU 374 Ca 0.29 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.01 2w3s h LEU 374 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2w3s h LEU 374 CO -0.51 0.00 0.00 0.59 -0.34 0.00 0.00 178.44 178.18 2w3s n ASN 375 N -3.63 1.21 -4.66 1.25 3.02 0.78 -4.95 115.26 108.29 2w3s n ASN 375 Ca 0.09 -1.28 -0.37 0.00 -0.03 0.00 0.00 54.58 52.99 2w3s n ASN 375 Cb 0.72 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.96 2w3s n ASN 375 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2w3s n PHE 376 N -0.14 1.20 -1.41 3.10 0.99 -0.75 -1.85 117.46 118.61 2w3s n PHE 376 Ca 0.00 0.42 -0.40 0.00 -0.00 0.00 0.00 57.45 57.48 2w3s n PHE 376 Cb 0.09 -2.18 0.02 0.00 -1.00 0.00 0.00 39.48 36.41 2w3s n PHE 376 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2w3s n TYR 377 N -1.94 -1.16 -2.13 1.38 4.02 -1.20 -4.57 117.16 111.55 2w3s n TYR 377 Ca 0.15 0.50 -0.39 0.00 -0.01 0.00 0.00 57.90 58.15 2w3s n TYR 377 Cb 0.48 -1.90 -0.01 0.00 -0.02 0.00 0.00 39.34 37.89 2w3s n TYR 377 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2w3s s ASP 378 N -1.06 6.41 0.91 7.72 1.01 -1.26 -4.86 116.67 125.55 2w3s s ASP 378 Ca 0.64 2.56 -0.13 0.00 0.71 0.00 0.00 52.55 56.33 2w3s s ASP 378 Cb -0.52 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 40.82 2w3s s ASP 378 CO 0.58 -0.77 0.51 -2.65 0.21 0.00 0.00 175.17 173.05 2w3s n PRO 379 N 0.17 -0.19 -1.83 8.23 -0.02 -1.26 -4.61 135.00 135.49 2w3s n PRO 379 Ca 0.04 -0.01 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 2w3s n PRO 379 Cb 0.44 -1.91 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 2w3s n PRO 379 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2w3s s PRO 380 N -3.60 4.17 0.03 0.52 0.02 -1.25 -4.93 135.00 129.97 2w3s s PRO 380 Ca 0.59 2.49 0.00 0.00 0.02 0.00 0.00 61.00 64.10 2w3s s PRO 380 Cb -0.24 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.18 2w3s s PRO 380 CO 0.65 -0.67 0.00 0.39 -0.33 0.00 0.00 177.00 177.04 2w3s n GLU 381 N 3.77 -1.62 -2.86 5.54 4.71 -1.26 -5.10 120.64 123.82 2w3s n GLU 381 Ca 0.14 1.51 -0.01 0.00 -0.01 0.00 0.00 57.16 58.79 2w3s n GLU 381 Cb 0.37 -1.52 -0.01 0.00 -1.01 0.00 0.00 31.44 29.27 2w3s n GLU 381 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2w3s n LYS 398 N 0.56 -2.65 -2.65 3.49 4.01 -1.26 -5.68 118.16 113.99 2w3s n LYS 398 Ca 0.00 2.24 -0.11 0.00 -0.51 0.00 0.00 58.31 59.93 2w3s n LYS 398 Cb 0.00 -3.73 0.01 0.00 -0.51 0.00 0.00 35.03 30.80 2w3s n LYS 398 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 2w3s n LYS 399 N 1.23 -0.66 -3.05 1.97 0.00 -1.26 -4.98 118.16 111.40 2w3s n LYS 399 Ca -0.08 0.75 -0.40 0.00 -0.00 0.00 0.00 58.31 58.59 2w3s n LYS 399 Cb 0.25 -1.01 -0.05 0.00 -0.00 0.00 0.00 35.03 34.22 2w3s n LYS 399 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 2w3s s THR 400 N -0.87 5.01 0.22 0.58 2.01 -1.26 -5.04 115.64 116.30 2w3s s THR 400 Ca 0.11 1.37 -0.32 0.00 0.31 0.00 0.00 61.69 63.17 2w3s s THR 400 Cb -0.01 -4.02 -0.14 0.00 0.01 0.00 0.00 72.50 68.34 2w3s s THR 400 CO 0.25 0.16 1.42 0.00 -0.69 0.00 0.00 174.62 175.76 2w3s n GLN 401 N 4.48 1.99 -3.86 4.92 6.02 -1.26 -4.77 117.38 124.90 2w3s n GLN 401 Ca -0.00 0.71 -0.22 0.00 -0.01 0.00 0.00 57.00 57.47 2w3s n GLN 401 Cb 0.50 -2.37 -0.02 0.00 1.02 0.00 0.00 30.24 29.37 2w3s n GLN 401 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2w3s s THR 402 N 0.06 5.24 0.82 5.09 -4.23 -1.26 -0.90 115.64 120.46 2w3s s THR 402 Ca 0.70 -0.85 -0.12 0.00 -1.18 0.00 0.00 61.69 60.24 2w3s s THR 402 Cb -0.67 -3.84 0.08 0.00 1.34 0.00 0.00 72.50 69.41 2w3s s THR 402 CO 0.48 -0.33 1.12 0.42 -0.54 0.00 0.00 174.62 175.77 2w3s s THR 403 N -2.00 2.62 -0.52 3.99 -4.23 -0.00 -4.82 115.64 110.67 2w3s s THR 403 Ca 0.35 0.20 0.06 0.00 -1.18 0.00 0.00 61.69 61.12 2w3s s THR 403 Cb -0.09 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.77 2w3s s THR 403 CO 0.30 -0.26 1.08 0.00 -0.54 0.00 0.00 174.62 175.19 2w3s n HIS 404 N -3.45 0.19 -0.31 3.99 1.44 -1.26 0.12 115.22 115.94 2w3s n HIS 404 Ca 0.07 0.10 0.09 0.00 -2.01 0.00 0.00 57.72 55.98 2w3s n HIS 404 Cb 0.58 -0.54 0.26 0.00 0.12 0.00 0.00 29.99 30.41 2w3s n HIS 404 CO 0.00 0.00 0.00 2.48 -2.81 0.00 0.00 176.34 176.01 2w3s n TYR 405 N -1.64 0.80 -2.77 -1.40 0.18 -1.26 -4.57 117.16 106.49 2w3s n TYR 405 Ca -0.00 -0.50 -0.09 0.00 1.88 0.00 0.00 57.90 59.19 2w3s n TYR 405 Cb 0.15 -0.02 0.04 0.00 -0.38 0.00 0.00 39.34 39.13 2w3s n TYR 405 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2w3s n GLY 406 N 1.22 0.19 3.25 -7.48 0.00 0.32 -2.00 105.19 100.68 2w3s n GLY 406 Ca 0.20 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2w3s n GLY 406 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3s s GLN 407 N -5.01 3.22 0.06 1.61 0.74 -1.24 -4.53 119.66 114.50 2w3s s GLN 407 Ca 0.11 -0.72 -0.30 0.00 0.05 0.00 0.00 55.36 54.49 2w3s s GLN 407 Cb -0.05 -2.75 -0.09 0.00 1.10 0.00 0.00 33.01 31.23 2w3s s GLN 407 CO 0.32 -0.11 1.82 -1.21 -0.55 0.00 0.00 175.29 175.55 2w3s s GLU 408 N 1.16 4.16 -0.93 1.67 2.02 -1.26 -0.82 118.70 124.69 2w3s s GLU 408 Ca 0.01 2.49 -0.19 0.00 0.02 0.00 0.00 54.97 57.30 2w3s s GLU 408 Cb -0.14 -3.86 0.12 0.00 0.10 0.00 0.00 34.13 30.35 2w3s s GLU 408 CO -0.05 -0.86 1.15 0.08 0.02 0.00 0.00 175.26 175.60 2w3s s VAL 409 N 3.54 4.62 -2.64 2.63 1.01 -0.08 -4.82 120.40 124.66 2w3s s VAL 409 Ca 0.81 -1.44 0.26 0.00 0.00 0.00 0.00 61.98 61.61 2w3s s VAL 409 Cb -0.42 -4.81 0.31 0.00 0.00 0.00 0.00 36.38 31.47 2w3s s VAL 409 CO 0.36 -1.55 1.45 0.00 0.00 0.00 0.00 175.10 175.36 2w3s n ALA 410 N 6.85 2.64 -0.68 5.51 0.00 -1.26 -4.38 120.51 129.19 2w3s n ALA 410 Ca 0.24 -0.58 0.02 0.00 0.00 0.00 0.00 53.44 53.12 2w3s n ALA 410 Cb 0.49 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 19.01 2w3s n ALA 410 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3s n ASP 411 N 0.65 1.38 -4.62 0.00 5.75 -1.26 -4.44 116.55 114.01 2w3s n ASP 411 Ca 0.15 -1.99 -0.43 0.00 -0.01 0.00 0.00 54.79 52.51 2w3s n ASP 411 Cb 0.48 -0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.43 2w3s n ASP 411 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w3s n VAL 413 N 6.54 1.89 0.11 0.00 0.24 -1.26 -3.90 118.33 121.96 2w3s n VAL 413 Ca 0.17 -1.71 -0.13 0.00 -2.04 0.00 0.00 64.34 60.63 2w3s n VAL 413 Cb 0.46 -0.06 -0.06 0.00 -1.47 0.00 0.00 33.84 32.72 2w3s n VAL 413 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2w3s h LEU 414 N 1.45 -0.92 -0.64 1.34 3.38 -1.91 -1.91 115.31 116.11 2w3s h LEU 414 Ca 0.00 0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.15 2w3s h LEU 414 Cb 1.18 0.35 -0.10 0.00 0.09 0.00 0.00 40.66 42.17 2w3s h LEU 414 CO 0.13 -0.40 -0.54 1.23 0.09 0.00 0.00 178.44 178.95 2w3s h GLY 415 N -0.54 -0.81 0.97 0.83 0.00 -1.89 0.54 103.07 102.18 2w3s h GLY 415 Ca 0.03 0.70 -0.00 0.00 0.00 0.00 0.00 47.33 48.06 2w3s h GLY 415 CO -0.19 -0.08 0.09 -2.09 0.00 0.00 0.00 176.54 174.27 2w3s h GLU 416 N -0.23 0.20 -0.50 4.80 4.81 -1.91 -1.66 114.58 120.09 2w3s h GLU 416 Ca 0.13 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2w3s h GLU 416 Cb 0.54 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 2w3s h GLU 416 CO -0.73 0.18 0.26 1.25 -0.73 0.00 0.00 179.01 179.24 2w3s h LEU 417 N 0.17 0.39 -0.67 1.64 6.46 -0.82 -0.71 115.31 121.78 2w3s h LEU 417 Ca 0.05 0.02 -0.13 0.00 -0.12 0.00 0.00 57.88 57.71 2w3s h LEU 417 Cb 0.03 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 39.89 2w3s h LEU 417 CO -0.01 0.27 -0.34 0.58 -0.62 0.00 0.00 178.44 178.32 2w3s h VAL 418 N 0.52 1.29 -0.23 1.05 2.07 0.48 0.84 116.25 122.27 2w3s h VAL 418 Ca 0.21 -1.48 -0.08 0.00 0.82 0.00 0.00 66.70 66.17 2w3s h VAL 418 Cb 0.10 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2w3s h VAL 418 CO -0.14 0.48 -0.19 0.74 0.02 0.00 0.00 177.57 178.48 2w3s h THR 419 N 0.55 1.32 -1.01 2.57 2.02 -1.15 -0.87 112.91 116.34 2w3s h THR 419 Ca 0.06 -1.33 0.04 0.00 0.77 0.00 0.00 66.41 65.95 2w3s h THR 419 Cb 0.85 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.88 2w3s h THR 419 CO 0.07 0.41 0.66 -0.09 0.37 0.00 0.00 175.52 176.94 2w3s h ARG 420 N 0.22 1.22 -0.09 6.66 2.43 -0.73 -2.01 114.38 122.08 2w3s h ARG 420 Ca 0.04 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 2w3s h ARG 420 Cb 0.72 -0.27 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2w3s h ARG 420 CO 0.05 0.81 -0.01 1.25 -1.51 0.00 0.00 179.97 180.55 2w3s h LEU 421 N 1.25 0.17 -0.87 3.80 5.85 -0.60 -1.51 115.31 123.40 2w3s h LEU 421 Ca 0.41 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.80 2w3s h LEU 421 Cb 0.04 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2w3s h LEU 421 CO -0.14 0.46 0.57 1.56 -0.34 0.00 0.00 178.44 180.55 2w3s h GLN 422 N -0.13 1.15 -0.26 1.25 4.20 -0.91 0.21 115.11 120.63 2w3s h GLN 422 Ca 0.02 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 2w3s h GLN 422 Cb 0.38 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 2w3s h GLN 422 CO 0.01 0.77 -0.22 0.87 -0.67 0.00 0.00 178.83 179.58 2w3s h LYS 423 N 1.18 0.61 0.00 1.46 1.79 -1.34 0.36 116.57 120.63 2w3s h LYS 423 Ca 0.32 -0.31 -0.05 0.00 -2.18 0.00 0.00 60.65 58.43 2w3s h LYS 423 Cb -0.13 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 2w3s h LYS 423 CO -0.07 0.90 -0.26 0.66 -1.08 0.00 0.00 179.45 179.61 2w3s h SER 424 N 0.33 0.00 0.21 0.86 4.64 -1.04 -2.96 113.55 115.59 2w3s h SER 424 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2w3s h SER 424 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2w3s h SER 424 CO 0.06 0.26 -0.14 0.00 -0.87 0.00 0.00 176.83 176.13 2w3s n ALA 425 N -2.23 2.85 -2.80 5.18 0.00 0.73 -4.92 120.51 119.32 2w3s n ALA 425 Ca 0.00 -0.36 -0.19 0.00 0.00 0.00 0.00 53.44 52.89 2w3s n ALA 425 Cb 0.46 -1.22 0.02 0.00 0.00 0.00 0.00 19.45 18.71 2w3s n ALA 425 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2w3s n ASN 426 N -0.59 -5.52 -0.15 0.00 4.05 -0.68 -4.91 115.26 107.46 2w3s n ASN 426 Ca 0.15 -0.20 -0.08 0.00 0.45 0.00 0.00 54.58 54.90 2w3s n ASN 426 Cb 0.32 -4.40 -0.02 0.00 1.23 0.00 0.00 39.78 36.91 2w3s n ASN 426 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 2w3s h PHE 427 N -0.97 -1.02 -0.11 1.20 3.57 -0.59 -2.07 116.94 116.95 2w3s h PHE 427 Ca -0.46 0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.06 2w3s h PHE 427 Cb 1.32 0.51 -0.00 0.00 2.79 0.00 0.00 35.95 40.57 2w3s h PHE 427 CO 0.46 -0.40 -0.13 1.15 -2.23 0.00 0.00 178.31 177.17 2w3s h THR 428 N -0.24 1.36 -0.43 4.41 2.02 -1.91 0.21 112.91 118.32 2w3s h THR 428 Ca 0.18 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 66.07 2w3s h THR 428 Cb 0.55 1.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 2w3s h THR 428 CO -0.60 0.37 0.28 0.74 0.37 0.00 0.00 175.52 176.68 2w3s h THR 429 N -0.12 1.09 -0.18 3.16 2.02 -1.95 -0.34 112.91 116.58 2w3s h THR 429 Ca 0.02 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.02 2w3s h THR 429 Cb 0.66 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 2w3s h THR 429 CO 0.03 0.10 0.06 0.03 0.37 0.00 0.00 175.52 176.12 2w3s h ARG 430 N 0.56 0.15 -0.37 6.66 3.08 -1.21 0.40 114.38 123.64 2w3s h ARG 430 Ca 0.16 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.28 2w3s h ARG 430 Cb -0.04 -0.03 -0.09 0.00 0.08 0.00 0.00 29.97 29.89 2w3s h ARG 430 CO -0.05 0.10 -0.37 -0.09 -1.07 0.00 0.00 179.97 178.49 2w3s h ARG 431 N 0.15 -0.29 0.01 0.04 2.43 -0.38 -0.79 114.38 115.55 2w3s h ARG 431 Ca 0.08 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2w3s h ARG 431 Cb 0.04 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 2w3s h ARG 431 CO -0.07 -0.19 -0.26 0.00 -1.51 0.00 0.00 179.97 177.94 2w3s h ALA 432 N 0.59 -0.36 -0.67 2.80 0.00 -0.43 -2.69 119.26 118.50 2w3s h ALA 432 Ca 0.15 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.20 2w3s h ALA 432 Cb 0.56 0.45 -0.11 0.00 0.00 0.00 0.00 17.79 18.69 2w3s h ALA 432 CO -0.53 -0.76 0.02 0.93 0.00 0.00 0.00 179.25 178.90 2w3s h GLU 433 N -0.40 0.12 -0.42 0.00 5.08 0.12 -2.33 114.58 116.75 2w3s h GLU 433 Ca 0.06 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 2w3s h GLU 433 Cb 0.48 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.65 2w3s h GLU 433 CO -0.22 0.08 0.13 0.82 -1.00 0.00 0.00 179.01 178.82 2w3s h ILE 434 N 0.13 0.84 -0.09 3.13 2.04 -0.83 -0.64 117.51 122.09 2w3s h ILE 434 Ca 0.36 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 66.16 2w3s h ILE 434 Cb 0.60 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 2w3s h ILE 434 CO -0.57 0.05 -0.19 0.00 0.00 0.00 0.00 178.15 177.44 2w3s h ALA 435 N 1.29 -0.17 -0.58 1.87 0.00 -1.16 0.14 119.26 120.65 2w3s h ALA 435 Ca 0.20 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2w3s h ALA 435 Cb 0.21 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2w3s h ALA 435 CO -0.22 -0.66 0.37 0.00 0.00 0.00 0.00 179.25 178.74 2w3s h ALA 436 N 0.71 0.75 -0.51 0.00 0.00 -1.32 -1.61 119.26 117.28 2w3s h ALA 436 Ca 0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2w3s h ALA 436 Cb 0.38 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2w3s h ALA 436 CO -0.24 0.12 0.20 2.35 0.00 0.00 0.00 179.25 181.68 2w3s h TRP 437 N 0.73 0.73 -0.13 0.00 7.01 -0.45 -2.72 115.95 121.11 2w3s h TRP 437 Ca 0.23 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.16 2w3s h TRP 437 Cb -0.02 -0.23 -0.00 0.00 -2.10 0.00 0.00 29.16 26.81 2w3s h TRP 437 CO -0.05 0.57 -0.04 -0.91 -2.79 0.00 0.00 178.44 175.22 2w3s h ASN 438 N 0.73 0.27 -0.08 2.65 2.35 -0.34 -2.80 115.58 118.34 2w3s h ASN 438 Ca 0.17 -0.38 0.02 0.00 -0.55 0.00 0.00 56.30 55.57 2w3s h ASN 438 Cb 0.15 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 2w3s h ASN 438 CO -0.02 0.59 0.33 0.77 -1.65 0.00 0.00 177.43 177.45 2w3s h SER 439 N -0.05 0.00 0.44 5.81 4.64 -1.05 0.22 113.55 123.55 2w3s h SER 439 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2w3s h SER 439 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2w3s h SER 439 CO 0.01 0.00 -0.31 0.41 -0.87 0.00 0.00 176.83 176.07 2w3s n THR 440 N -3.10 0.00 -4.68 2.95 -1.04 -1.05 -4.94 114.28 102.43 2w3s n THR 440 Ca -0.00 -0.05 -0.27 0.00 -2.04 0.00 0.00 64.05 61.69 2w3s n THR 440 Cb 0.40 0.17 -0.14 0.00 -1.82 0.00 0.00 70.33 68.95 2w3s n THR 440 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2w3s s ASN 441 N -2.76 2.74 -0.01 8.00 -0.87 0.78 -5.01 114.94 117.82 2w3s s ASN 441 Ca 0.18 -0.57 0.04 0.00 -1.57 0.00 0.00 52.86 50.94 2w3s s ASN 441 Cb 0.19 -0.23 -0.06 0.00 -0.02 0.00 0.00 41.25 41.13 2w3s s ASN 441 CO 0.59 0.18 0.09 -2.11 -2.57 0.00 0.00 177.10 173.28 2w3s n ARG 442 N 1.70 0.27 -0.13 -0.60 1.85 -1.26 -4.74 116.66 113.75 2w3s n ARG 442 Ca -0.17 -0.04 -0.20 0.00 -1.00 0.00 0.00 57.85 56.44 2w3s n ARG 442 Cb 0.53 -1.10 -0.12 0.00 -1.05 0.00 0.00 32.46 30.73 2w3s n ARG 442 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2w3s n THR 443 N -1.66 1.51 -4.01 8.89 -1.04 -1.26 -4.85 114.28 111.85 2w3s n THR 443 Ca -0.01 -0.54 -0.24 0.00 -2.04 0.00 0.00 64.05 61.22 2w3s n THR 443 Cb 0.13 -1.51 -0.04 0.00 -1.82 0.00 0.00 70.33 67.09 2w3s n THR 443 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w3s s LEU 444 N -6.72 4.12 -0.11 -4.42 1.43 -1.26 0.45 118.68 112.17 2w3s s LEU 444 Ca -0.35 0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 52.66 2w3s s LEU 444 Cb 0.10 -2.69 0.03 0.00 0.03 0.00 0.00 46.19 43.66 2w3s s LEU 444 CO 0.59 0.01 0.29 0.00 0.23 0.00 0.00 176.35 177.47 2w3s s ALA 445 N -1.87 -0.72 0.15 4.21 0.00 -0.94 -4.74 121.76 117.85 2w3s s ALA 445 Ca 0.33 0.87 0.03 0.00 0.00 0.00 0.00 51.96 53.19 2w3s s ALA 445 Cb -0.10 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 2w3s s ALA 445 CO 0.27 -0.15 0.25 1.03 0.00 0.00 0.00 175.76 177.16 2w3s s ARG 446 N 0.30 3.33 0.06 0.00 0.52 -1.26 -0.44 118.95 121.46 2w3s s ARG 446 Ca -0.01 -0.64 0.01 0.00 -0.52 0.00 0.00 55.73 54.56 2w3s s ARG 446 Cb -0.03 -2.91 -0.03 0.00 0.52 0.00 0.00 34.95 32.50 2w3s s ARG 446 CO -0.01 0.52 -0.05 0.20 0.02 0.00 0.00 175.30 175.98 2w3s s GLY 447 N -3.16 0.53 -0.10 -3.53 0.00 0.38 -4.14 107.32 97.29 2w3s s GLY 447 Ca 0.34 -1.06 -0.07 0.00 0.00 0.00 0.00 44.72 43.93 2w3s s GLY 447 CO 0.27 -1.15 0.26 -1.50 0.00 0.00 0.00 173.10 170.99 2w3s s ILE 448 N -2.87 -0.02 -0.03 0.90 2.07 -1.26 -1.17 121.20 118.81 2w3s s ILE 448 Ca 0.01 0.08 -0.13 0.00 -1.41 0.00 0.00 60.65 59.20 2w3s s ILE 448 Cb 0.00 -0.39 0.02 0.00 0.13 0.00 0.00 42.46 42.23 2w3s s ILE 448 CO -0.05 0.03 0.30 0.00 -1.91 0.00 0.00 174.94 173.31 2w3s s ALA 449 N 0.80 -0.75 -0.18 1.50 0.00 -0.28 -4.67 121.76 118.18 2w3s s ALA 449 Ca -0.05 0.39 -0.03 0.00 0.00 0.00 0.00 51.96 52.27 2w3s s ALA 449 Cb -0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 2w3s s ALA 449 CO -0.05 -0.24 -0.06 -1.17 0.00 0.00 0.00 175.76 174.24 2w3s s LEU 450 N -1.06 2.96 0.08 0.00 0.20 -1.26 -1.06 118.68 118.54 2w3s s LEU 450 Ca -0.11 -0.30 0.10 0.00 0.69 0.00 0.00 54.13 54.50 2w3s s LEU 450 Cb -0.05 -1.73 -0.03 0.00 -0.43 0.00 0.00 46.19 43.95 2w3s s LEU 450 CO 0.03 0.07 -0.26 -0.94 -0.29 0.00 0.00 176.35 174.97 2w3s s SER 451 N 0.92 3.11 0.03 3.68 1.04 -0.69 -4.91 113.70 116.87 2w3s s SER 451 Ca -0.01 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.77 2w3s s SER 451 Cb -0.15 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.69 2w3s s SER 451 CO 0.01 0.20 0.13 -2.16 0.98 0.00 0.00 173.24 172.40 2w3s s PRO 452 N -1.61 3.17 -0.12 4.02 0.04 -1.26 -1.43 135.00 137.80 2w3s s PRO 452 Ca 0.12 -0.49 -0.01 0.00 0.04 0.00 0.00 61.00 60.66 2w3s s PRO 452 Cb -0.10 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.51 2w3s s PRO 452 CO 0.04 0.62 -0.10 0.08 0.04 0.00 0.00 177.00 177.68 2w3s s VAL 453 N -1.33 3.31 -0.20 -0.36 1.01 0.77 -4.73 120.40 118.86 2w3s s VAL 453 Ca 0.28 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 2w3s s VAL 453 Cb -0.12 -2.39 0.05 0.00 0.00 0.00 0.00 36.38 33.92 2w3s s VAL 453 CO 0.20 0.53 -0.03 -0.75 0.00 0.00 0.00 175.10 175.04 2w3s s LYS 454 N 0.17 1.35 -0.10 2.72 2.20 -1.26 -2.94 119.74 121.88 2w3s s LYS 454 Ca -0.06 -0.70 0.02 0.00 -0.36 0.00 0.00 55.97 54.87 2w3s s LYS 454 Cb -0.15 -2.28 0.01 0.00 -1.51 0.00 0.00 37.83 33.90 2w3s s LYS 454 CO 0.04 -0.55 -0.14 0.12 -0.36 0.00 0.00 175.35 174.46 2w3s s PHE 455 N 1.58 1.80 0.32 4.03 5.36 0.24 -4.89 117.98 126.43 2w3s s PHE 455 Ca -0.02 -0.80 -0.26 0.00 -0.96 0.00 0.00 56.93 54.89 2w3s s PHE 455 Cb -0.17 -1.32 -0.10 0.00 -0.34 0.00 0.00 43.02 41.09 2w3s s PHE 455 CO -0.07 -0.42 0.94 0.20 -1.46 0.00 0.00 175.22 174.40 2w3s s GLY 456 N 0.93 2.78 -0.23 13.12 0.00 -1.26 -0.84 107.32 121.82 2w3s s GLY 456 Ca -0.08 0.50 0.01 0.00 0.00 0.00 0.00 44.72 45.15 2w3s s GLY 456 CO -0.00 0.94 -0.13 -0.42 0.00 0.00 0.00 173.10 173.49 2w3s s ILE 457 N -1.64 2.33 0.00 0.90 -1.09 -0.60 -4.96 121.20 116.14 2w3s s ILE 457 Ca 0.50 -1.25 0.00 0.00 -2.23 0.00 0.00 60.65 57.67 2w3s s ILE 457 Cb -0.18 -2.20 0.00 0.00 -1.58 0.00 0.00 42.46 38.50 2w3s s ILE 457 CO 0.23 0.21 0.00 -1.20 -1.23 0.00 0.00 174.94 172.95 2w3s n SER 458 N 4.56 0.00 -4.67 3.58 7.64 -1.26 -2.37 113.62 121.09 2w3s n SER 458 Ca -0.17 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.28 2w3s n SER 458 Cb 0.46 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.63 2w3s n SER 458 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2w3s n PHE 459 N -1.50 2.52 0.31 1.43 3.01 -1.26 -4.84 117.46 117.13 2w3s n PHE 459 Ca 0.00 -0.28 0.20 0.00 1.01 0.00 0.00 57.45 58.39 2w3s n PHE 459 Cb 0.00 -2.77 1.00 0.00 -0.01 0.00 0.00 39.48 37.69 2w3s n PHE 459 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2w3s h THR 460 N 5.35 0.00 -2.27 4.37 1.35 -1.98 -3.27 112.91 116.47 2w3s h THR 460 Ca -0.49 -0.20 -0.63 0.00 -0.55 0.00 0.00 66.41 64.54 2w3s h THR 460 Cb 1.24 1.18 -0.14 0.00 -1.73 0.00 0.00 68.15 68.70 2w3s h THR 460 CO 0.94 0.00 0.87 -0.22 -0.25 0.00 0.00 175.52 176.86 2w3s s LEU 461 N -6.09 4.26 0.16 3.87 1.98 -1.26 -4.94 118.68 116.66 2w3s s LEU 461 Ca -0.02 -1.31 -0.28 0.00 -2.89 0.00 0.00 54.13 49.62 2w3s s LEU 461 Cb 0.11 -2.46 -0.02 0.00 0.66 0.00 0.00 46.19 44.48 2w3s s LEU 461 CO 0.45 -1.40 1.48 0.41 -1.89 0.00 0.00 176.35 175.41 2w3s n THR 462 N 6.03 -0.63 0.22 3.68 -1.04 -1.23 -1.22 114.28 120.08 2w3s n THR 462 Ca 0.12 2.32 0.02 0.00 -2.04 0.00 0.00 64.05 64.46 2w3s n THR 462 Cb 0.48 -2.89 0.11 0.00 -1.82 0.00 0.00 70.33 66.21 2w3s n THR 462 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2w3s n HIS 463 N -5.24 0.00 0.41 -1.42 1.44 -1.26 -0.77 115.22 108.38 2w3s n HIS 463 Ca 0.03 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.87 2w3s n HIS 463 Cb 0.27 -0.14 0.31 0.00 0.12 0.00 0.00 29.99 30.55 2w3s n HIS 463 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2w3s h LEU 464 N 0.00 0.00 -6.83 2.39 3.38 -1.49 -3.37 115.31 109.38 2w3s h LEU 464 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2w3s h LEU 464 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2w3s h LEU 464 CO 0.00 0.00 2.40 0.59 0.09 0.00 0.00 178.44 181.52 2w3s n ASN 465 N -2.70 3.62 -3.74 -0.43 3.02 0.05 -4.76 115.26 110.31 2w3s n ASN 465 Ca 0.04 -2.79 -0.14 0.00 -0.03 0.00 0.00 54.58 51.66 2w3s n ASN 465 Cb 0.46 -1.54 -0.09 0.00 -0.61 0.00 0.00 39.78 38.00 2w3s n ASN 465 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w3s s GLN 466 N 4.40 0.67 0.07 3.52 -2.07 -1.26 -2.71 119.66 122.28 2w3s s GLN 466 Ca 0.55 -0.07 -0.12 0.00 -1.82 0.00 0.00 55.36 53.90 2w3s s GLN 466 Cb 0.10 0.30 0.01 0.00 -1.09 0.00 0.00 33.01 32.33 2w3s s GLN 466 CO 0.04 -0.18 0.27 0.00 -1.32 0.00 0.00 175.29 174.10 2w3s s ALA 467 N -1.13 -0.54 0.13 2.60 0.00 0.33 -4.55 121.76 118.60 2w3s s ALA 467 Ca -0.12 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.60 2w3s s ALA 467 Cb -0.04 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 2w3s s ALA 467 CO 0.04 -0.48 -0.01 0.20 0.00 0.00 0.00 175.76 175.51 2w3s s GLY 468 N -2.48 0.94 0.17 0.00 0.00 -1.26 -0.71 107.32 103.99 2w3s s GLY 468 Ca -0.00 -1.45 -0.09 0.00 0.00 0.00 0.00 44.72 43.18 2w3s s GLY 468 CO -0.08 -1.44 0.30 0.00 0.00 0.00 0.00 173.10 171.89 2w3s s ALA 469 N -3.79 0.00 -0.07 3.20 0.00 0.23 -2.07 121.76 119.26 2w3s s ALA 469 Ca 0.19 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 2w3s s ALA 469 Cb 0.07 0.90 0.04 0.00 0.00 0.00 0.00 23.12 24.13 2w3s s ALA 469 CO -0.01 -0.67 0.15 -1.17 0.00 0.00 0.00 175.76 174.07 2w3s s LEU 470 N -2.98 0.42 -0.03 0.00 2.96 0.15 0.77 118.68 119.96 2w3s s LEU 470 Ca 0.18 0.31 0.05 0.00 -0.22 0.00 0.00 54.13 54.45 2w3s s LEU 470 Cb 0.03 0.33 -0.01 0.00 0.50 0.00 0.00 46.19 47.04 2w3s s LEU 470 CO 0.01 -0.18 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.99 2w3s s VAL 471 N 1.60 1.41 -0.08 1.68 1.01 0.46 -1.92 120.40 124.56 2w3s s VAL 471 Ca -0.05 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.24 2w3s s VAL 471 Cb -0.12 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.07 2w3s s VAL 471 CO -0.06 0.41 -0.18 -1.10 0.00 0.00 0.00 175.10 174.17 2w3s s GLN 472 N -0.10 2.33 -0.23 2.72 -1.52 -0.35 -2.23 119.66 120.29 2w3s s GLN 472 Ca -0.01 -0.63 -0.05 0.00 -1.95 0.00 0.00 55.36 52.73 2w3s s GLN 472 Cb -0.10 -1.83 -0.01 0.00 -0.22 0.00 0.00 33.01 30.85 2w3s s GLN 472 CO 0.01 0.09 -0.01 0.42 -0.25 0.00 0.00 175.29 175.55 2w3s s ILE 473 N 0.54 3.62 0.85 1.08 1.01 -0.76 -0.40 121.20 127.13 2w3s s ILE 473 Ca -0.16 -0.41 -0.12 0.00 0.00 0.00 0.00 60.65 59.96 2w3s s ILE 473 Cb -0.17 -2.66 0.10 0.00 0.01 0.00 0.00 42.46 39.74 2w3s s ILE 473 CO 0.06 0.40 1.15 -0.31 0.00 0.00 0.00 174.94 176.24 2w3s s TYR 474 N 1.50 2.77 -1.72 3.97 1.51 -0.47 -4.83 117.35 120.07 2w3s s TYR 474 Ca 0.06 0.84 0.27 0.00 -1.01 0.00 0.00 57.07 57.24 2w3s s TYR 474 Cb -0.14 -3.40 1.51 0.00 -0.11 0.00 0.00 41.96 39.82 2w3s s TYR 474 CO -0.01 -2.01 1.96 0.25 -1.11 0.00 0.00 175.55 174.63 2w3s n THR 475 N -3.51 0.07 1.12 -0.71 -2.24 -1.26 -1.46 114.28 106.28 2w3s n THR 475 Ca 0.07 0.02 0.13 0.00 -2.27 0.00 0.00 64.05 62.00 2w3s n THR 475 Cb 0.60 -0.58 0.41 0.00 -2.10 0.00 0.00 70.33 68.66 2w3s n THR 475 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2w3s n ASP 476 N -1.14 0.48 0.00 3.42 3.85 -1.26 -4.48 116.55 117.42 2w3s n ASP 476 Ca 0.17 -0.27 0.00 0.00 -0.71 0.00 0.00 54.79 53.97 2w3s n ASP 476 Cb 0.15 0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 2w3s n ASP 476 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2w3s n GLY 477 N 1.43 0.74 3.83 6.12 0.00 -0.54 -4.67 105.19 112.10 2w3s n GLY 477 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 2w3s n GLY 477 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w3s s SER 478 N -2.60 5.32 -0.03 1.61 1.04 -1.26 -4.86 113.70 112.92 2w3s s SER 478 Ca 0.00 1.45 0.02 0.00 0.48 0.00 0.00 55.95 57.90 2w3s s SER 478 Cb 0.00 -2.31 0.01 0.00 0.10 0.00 0.00 66.02 63.82 2w3s s SER 478 CO 0.00 -1.46 -0.08 -0.69 0.98 0.00 0.00 173.24 171.99 2w3s s VAL 479 N -3.13 0.75 -0.26 5.02 1.01 0.22 -1.37 120.40 122.64 2w3s s VAL 479 Ca 0.58 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 62.19 2w3s s VAL 479 Cb -0.13 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.57 2w3s s VAL 479 CO 0.54 0.24 0.01 0.00 0.00 0.00 0.00 175.10 175.89 2w3s s ALA 480 N 0.33 2.90 -0.08 5.51 0.00 0.46 -0.22 121.76 130.67 2w3s s ALA 480 Ca -0.05 -1.36 -0.02 0.00 0.00 0.00 0.00 51.96 50.53 2w3s s ALA 480 Cb -0.10 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 2w3s s ALA 480 CO 0.01 -0.73 0.04 -1.17 0.00 0.00 0.00 175.76 173.90 2w3s s LEU 481 N 1.45 3.76 -0.19 0.00 2.96 0.18 -1.21 118.68 125.64 2w3s s LEU 481 Ca 0.03 0.20 -0.10 0.00 -0.22 0.00 0.00 54.13 54.04 2w3s s LEU 481 Cb -0.16 -1.92 0.06 0.00 0.50 0.00 0.00 46.19 44.67 2w3s s LEU 481 CO -0.01 0.37 0.45 0.21 -1.32 0.00 0.00 176.35 176.05 2w3s s ASN 482 N -1.03 -0.56 0.12 3.68 3.84 -0.81 -0.72 114.94 119.47 2w3s s ASN 482 Ca 0.15 0.99 -0.06 0.00 0.21 0.00 0.00 52.86 54.15 2w3s s ASN 482 Cb -0.12 0.90 -0.02 0.00 -0.55 0.00 0.00 41.25 41.47 2w3s s ASN 482 CO 0.04 -0.20 0.16 -1.38 -2.79 0.00 0.00 177.10 172.93 2w3s s HIS 483 N 1.53 0.50 -0.83 0.43 -3.43 -1.26 0.30 115.29 112.52 2w3s s HIS 483 Ca -0.09 -0.90 0.12 0.00 -0.80 0.00 0.00 55.06 53.39 2w3s s HIS 483 Cb -0.08 -0.22 0.55 0.00 -1.43 0.00 0.00 32.58 31.40 2w3s s HIS 483 CO -0.14 -0.58 1.39 0.41 -2.00 0.00 0.00 174.74 173.81 2w3s n GLY 484 N -0.11 -0.88 3.85 -1.38 0.00 -0.88 -4.71 105.19 101.09 2w3s n GLY 484 Ca -0.09 0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2w3s n GLY 484 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w3s s GLY 485 N -3.15 1.89 -0.05 -0.02 0.00 -1.26 -4.88 107.32 99.85 2w3s s GLY 485 Ca 0.03 0.07 0.03 0.00 0.00 0.00 0.00 44.72 44.85 2w3s s GLY 485 CO 0.20 0.34 -0.12 -0.51 0.00 0.00 0.00 173.10 173.01 2w3s s THR 486 N -2.86 3.26 -0.16 0.90 -4.23 -1.26 -4.75 115.64 106.53 2w3s s THR 486 Ca 0.57 -0.67 -0.19 0.00 -1.18 0.00 0.00 61.69 60.23 2w3s s THR 486 Cb -0.10 -2.30 -0.03 0.00 1.34 0.00 0.00 72.50 71.40 2w3s s THR 486 CO 0.41 0.58 0.53 -0.70 -0.54 0.00 0.00 174.62 174.90 2w3s s GLU 487 N -0.79 4.26 -0.01 3.99 2.56 -1.26 -4.88 118.70 122.56 2w3s s GLU 487 Ca 0.12 0.48 0.02 0.00 0.00 0.00 0.00 54.97 55.59 2w3s s GLU 487 Cb -0.11 -3.51 0.03 0.00 2.00 0.00 0.00 34.13 32.54 2w3s s GLU 487 CO 0.01 -0.04 0.85 0.00 -0.56 0.00 0.00 175.26 175.53 2w3s n MET 488 N 4.36 0.38 0.00 4.30 0.00 -1.26 -0.91 117.12 123.99 2w3s n MET 488 Ca -0.05 -1.06 0.00 0.00 0.00 0.00 0.00 57.70 56.59 2w3s n MET 488 Cb 0.51 -0.65 0.00 0.00 0.00 0.00 0.00 33.22 33.07 2w3s n MET 488 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w3s n GLY 489 N -0.20 2.11 0.27 3.17 0.00 -1.26 -3.23 105.19 106.04 2w3s n GLY 489 Ca 0.02 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.22 2w3s n GLY 489 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2w3s h GLN 490 N 0.48 0.00 0.00 1.61 -0.00 -1.93 -3.45 115.11 111.81 2w3s h GLN 490 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2w3s h GLN 490 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 2w3s h GLN 490 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.24 2w3s n GLY 491 N -0.47 1.26 0.14 0.06 0.00 -1.26 -4.90 105.19 100.02 2w3s n GLY 491 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2w3s n GLY 491 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2w3s h LEU 492 N 0.00 0.36 -0.70 0.99 5.85 -1.90 -2.88 115.31 117.03 2w3s h LEU 492 Ca 0.00 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2w3s h LEU 492 Cb 0.00 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2w3s h LEU 492 CO 0.00 0.33 0.26 0.45 -0.34 0.00 0.00 178.44 179.14 2w3s h HIS 493 N 0.36 1.09 -0.08 1.25 3.86 -1.96 -1.42 115.15 118.25 2w3s h HIS 493 Ca 0.10 -0.09 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 2w3s h HIS 493 Cb 0.04 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.15 2w3s h HIS 493 CO -0.04 0.85 -0.13 0.00 0.86 0.00 0.00 177.93 179.47 2w3s h ALA 494 N 1.12 -0.08 -0.75 2.45 0.00 -1.89 0.31 119.26 120.43 2w3s h ALA 494 Ca 0.23 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.27 2w3s h ALA 494 Cb 0.24 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2w3s h ALA 494 CO -0.02 -0.60 0.49 0.87 0.00 0.00 0.00 179.25 180.00 2w3s h LYS 495 N -0.18 0.65 -0.00 0.00 1.57 -1.29 0.27 116.57 117.59 2w3s h LYS 495 Ca 0.07 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.65 2w3s h LYS 495 Cb 0.29 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2w3s h LYS 495 CO -0.19 0.43 -0.77 0.52 -0.57 0.00 0.00 179.45 178.88 2w3s h MET 496 N 0.67 0.04 -0.04 3.15 2.86 -0.62 -1.74 114.93 119.25 2w3s h MET 496 Ca 0.34 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.95 2w3s h MET 496 Cb 0.44 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 2w3s h MET 496 CO -0.12 0.78 0.02 0.28 1.06 0.00 0.00 176.91 178.93 2w3s h VAL 497 N 0.02 1.11 -0.58 -2.22 2.07 0.12 -2.40 116.25 114.37 2w3s h VAL 497 Ca -0.01 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.23 2w3s h VAL 497 Cb 1.35 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 32.32 2w3s h VAL 497 CO 0.10 0.09 0.32 1.56 0.02 0.00 0.00 177.57 179.66 2w3s h GLN 498 N -0.06 0.59 0.41 1.57 4.20 -0.37 0.32 115.11 121.77 2w3s h GLN 498 Ca 0.02 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2w3s h GLN 498 Cb 0.13 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2w3s h GLN 498 CO -0.00 0.39 -0.32 0.28 -0.67 0.00 0.00 178.83 178.50 2w3s h VAL 499 N 0.60 0.33 -0.39 -0.54 2.07 -1.34 -1.81 116.25 115.18 2w3s h VAL 499 Ca 0.25 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.85 2w3s h VAL 499 Cb 0.13 0.33 -0.08 0.00 -1.52 0.00 0.00 31.29 30.16 2w3s h VAL 499 CO -0.16 0.00 -0.12 0.00 0.02 0.00 0.00 177.57 177.31 2w3s h ALA 500 N -0.25 0.21 -0.30 1.67 0.00 -1.01 0.43 119.26 120.01 2w3s h ALA 500 Ca -0.04 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2w3s h ALA 500 Cb 0.63 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2w3s h ALA 500 CO -0.01 -0.48 0.19 0.00 0.00 0.00 0.00 179.25 178.95 2w3s h ALA 501 N 1.32 0.38 0.21 0.00 0.00 -0.85 0.20 119.26 120.52 2w3s h ALA 501 Ca 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2w3s h ALA 501 Cb 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2w3s h ALA 501 CO -0.42 -0.14 -0.10 0.00 0.00 0.00 0.00 179.25 178.59 2w3s h ALA 502 N 1.10 -0.28 -0.18 0.00 0.00 -0.94 0.76 119.26 119.70 2w3s h ALA 502 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2w3s h ALA 502 Cb -0.03 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2w3s h ALA 502 CO -0.02 -0.66 -0.05 0.28 0.00 0.00 0.00 179.25 178.80 2w3s h VAL 503 N -0.29 1.15 -0.00 0.00 2.07 -0.56 -2.11 116.25 116.51 2w3s h VAL 503 Ca -0.03 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2w3s h VAL 503 Cb 0.22 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2w3s h VAL 503 CO 0.05 0.20 -0.51 0.18 0.02 0.00 0.00 177.57 177.51 2w3s n LEU 504 N -4.33 0.76 -0.81 2.57 4.77 0.66 -4.86 117.00 115.75 2w3s n LEU 504 Ca -0.00 -0.16 -0.09 0.00 -0.03 0.00 0.00 56.01 55.73 2w3s n LEU 504 Cb 0.22 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2w3s n LEU 504 CO 0.37 0.17 -0.10 0.61 -1.33 0.00 0.00 177.39 177.11 2w3s n GLY 505 N 1.46 0.65 3.67 -0.72 0.00 0.26 -4.77 105.19 105.74 2w3s n GLY 505 Ca 0.07 -0.59 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 2w3s n GLY 505 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w3s s ILE 506 N -2.38 2.12 0.28 -0.61 -4.36 -0.77 0.90 121.20 116.38 2w3s s ILE 506 Ca 0.00 -1.88 -0.29 0.00 -0.26 0.00 0.00 60.65 58.23 2w3s s ILE 506 Cb 0.00 -3.00 -0.09 0.00 1.25 0.00 0.00 42.46 40.62 2w3s s ILE 506 CO 0.00 0.00 1.00 -0.62 0.24 0.00 0.00 174.94 175.56 2w3s s ASP 507 N -3.79 7.41 0.42 4.36 2.15 -1.26 -4.42 116.67 121.54 2w3s s ASP 507 Ca 0.37 2.04 0.23 0.00 0.43 0.00 0.00 52.55 55.62 2w3s s ASP 507 Cb 0.08 -2.61 1.22 0.00 -0.30 0.00 0.00 42.92 41.31 2w3s s ASP 507 CO 0.20 -0.02 1.73 -0.65 -0.17 0.00 0.00 175.17 176.26 2w3s h PRO 508 N 3.77 0.27 -0.11 4.34 0.10 -1.91 -0.28 132.00 138.18 2w3s h PRO 508 Ca -0.46 -0.02 0.03 0.00 0.10 0.00 0.00 66.00 65.66 2w3s h PRO 508 Cb 1.20 -0.06 -0.00 0.00 0.10 0.00 0.00 31.00 32.24 2w3s h PRO 508 CO 0.67 0.18 0.33 0.28 0.10 0.00 0.00 178.00 179.55 2w3s h VAL 509 N 0.28 0.13 -0.17 3.15 2.07 -1.98 -0.08 116.25 119.66 2w3s h VAL 509 Ca 0.66 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.18 2w3s h VAL 509 Cb 1.85 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 2w3s h VAL 509 CO -0.32 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.27 2w3s n GLN 510 N -3.18 1.47 -3.72 1.57 1.13 -0.12 -4.77 117.38 109.76 2w3s n GLN 510 Ca 0.00 -0.72 -0.30 0.00 -1.94 0.00 0.00 57.00 54.04 2w3s n GLN 510 Cb 0.41 -1.24 -0.15 0.00 0.11 0.00 0.00 30.24 29.37 2w3s n GLN 510 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2w3s s VAL 511 N -1.78 0.80 -0.06 5.09 1.01 -0.05 -0.61 120.40 124.82 2w3s s VAL 511 Ca 0.21 -1.32 -0.19 0.00 0.00 0.00 0.00 61.98 60.68 2w3s s VAL 511 Cb 0.11 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 2w3s s VAL 511 CO 0.16 -0.66 0.54 -0.60 0.00 0.00 0.00 175.10 174.54 2w3s s ARG 512 N 1.66 4.30 -0.24 2.72 6.06 0.70 -4.89 118.95 129.26 2w3s s ARG 512 Ca 0.09 0.61 -0.27 0.00 -2.50 0.00 0.00 55.73 53.66 2w3s s ARG 512 Cb -0.17 -3.38 0.00 0.00 0.06 0.00 0.00 34.95 31.46 2w3s s ARG 512 CO -0.25 0.28 0.94 -1.50 -2.50 0.00 0.00 175.30 172.26 2w3s s ILE 513 N 0.17 4.76 0.46 4.11 1.10 -1.26 0.51 121.20 131.04 2w3s s ILE 513 Ca 0.29 1.81 -0.13 0.00 -0.51 0.00 0.00 60.65 62.10 2w3s s ILE 513 Cb -0.17 -4.22 -0.07 0.00 0.15 0.00 0.00 42.46 38.16 2w3s s ILE 513 CO 0.14 -0.13 0.87 0.42 -2.11 0.00 0.00 174.94 174.14 2w3s s THR 514 N 3.02 4.66 0.86 4.00 -4.23 0.11 -4.94 115.64 119.11 2w3s s THR 514 Ca 0.40 0.91 -0.10 0.00 -1.18 0.00 0.00 61.69 61.71 2w3s s THR 514 Cb -0.15 -3.72 0.11 0.00 1.34 0.00 0.00 72.50 70.07 2w3s s THR 514 CO 0.07 -0.60 1.12 0.00 -0.54 0.00 0.00 174.62 174.67 2w3s s ALA 515 N -2.49 1.77 0.30 3.99 0.00 -1.26 -4.77 121.76 119.31 2w3s s ALA 515 Ca 0.55 0.40 -0.29 0.00 0.00 0.00 0.00 51.96 52.61 2w3s s ALA 515 Cb -0.10 -3.35 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 2w3s s ALA 515 CO 0.31 -2.33 1.31 0.99 0.00 0.00 0.00 175.76 176.05 2w3s s THR 516 N -2.77 2.79 -0.23 0.00 2.01 -0.65 -4.84 115.64 111.95 2w3s s THR 516 Ca 0.64 0.76 -0.06 0.00 0.31 0.00 0.00 61.69 63.35 2w3s s THR 516 Cb -0.20 -3.49 0.12 0.00 0.01 0.00 0.00 72.50 68.94 2w3s s THR 516 CO 0.57 0.17 0.47 -0.62 -0.69 0.00 0.00 174.62 174.52 2w3s s ASP 517 N -0.31 -0.41 0.64 3.53 3.68 -1.26 -0.38 116.67 122.18 2w3s s ASP 517 Ca 0.51 0.91 0.43 0.00 2.13 0.00 0.00 52.55 56.52 2w3s s ASP 517 Cb -0.39 1.54 2.22 0.00 -1.45 0.00 0.00 42.92 44.83 2w3s s ASP 517 CO 0.50 -0.25 2.30 0.71 0.13 0.00 0.00 175.17 178.55 2w3s h THR 518 N 6.13 0.01 -0.01 1.71 1.35 -1.44 -0.94 112.91 119.71 2w3s h THR 518 Ca -0.18 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2w3s h THR 518 Cb 1.12 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2w3s h THR 518 CO 0.16 0.00 -0.00 -1.54 -0.25 0.00 0.00 175.52 173.89 2w3s n SER 519 N -3.09 1.24 -0.04 5.36 3.41 -1.26 -3.92 113.62 115.31 2w3s n SER 519 Ca -0.02 -1.41 -0.08 0.00 -0.26 0.00 0.00 58.87 57.10 2w3s n SER 519 Cb 0.12 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 2w3s n SER 519 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2w3s n LYS 520 N -0.04 0.27 -4.03 4.33 5.02 -0.42 -4.96 118.16 118.34 2w3s n LYS 520 Ca 0.20 0.11 -0.33 0.00 -2.02 0.00 0.00 58.31 56.27 2w3s n LYS 520 Cb 0.31 -0.97 -0.15 0.00 -0.02 0.00 0.00 35.03 34.20 2w3s n LYS 520 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2w3s s VAL 521 N -2.38 2.39 0.41 -0.18 1.01 -0.84 -4.89 120.40 115.92 2w3s s VAL 521 Ca -0.16 -1.43 -0.01 0.00 0.00 0.00 0.00 61.98 60.38 2w3s s VAL 521 Cb 0.04 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2w3s s VAL 521 CO 0.22 0.06 0.64 -2.16 0.00 0.00 0.00 175.10 173.86 2w3s s PRO 522 N 1.18 3.42 -1.54 2.72 0.04 -1.25 -4.41 135.00 135.16 2w3s s PRO 522 Ca -0.05 -0.20 -0.03 0.00 0.04 0.00 0.00 61.00 60.75 2w3s s PRO 522 Cb -0.19 -2.56 0.01 0.00 0.04 0.00 0.00 34.50 31.81 2w3s s PRO 522 CO -0.05 -0.04 0.30 0.09 0.04 0.00 0.00 177.00 177.34 2w3s n ASN 523 N -1.98 -5.47 -4.83 6.66 3.02 -1.26 -4.95 115.26 106.44 2w3s n ASN 523 Ca -0.02 -0.13 -0.31 0.00 -0.03 0.00 0.00 54.58 54.08 2w3s n ASN 523 Cb 0.56 -4.50 0.02 0.00 -0.61 0.00 0.00 39.78 35.24 2w3s n ASN 523 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2w3s s THR 524 N -3.02 4.25 0.42 3.41 -4.23 -1.26 -5.04 115.64 110.17 2w3s s THR 524 Ca 0.16 0.85 0.04 0.00 -1.18 0.00 0.00 61.69 61.56 2w3s s THR 524 Cb -0.08 -3.57 0.01 0.00 1.34 0.00 0.00 72.50 70.20 2w3s s THR 524 CO 0.20 -0.84 0.60 -0.44 -0.54 0.00 0.00 174.62 173.60 2w3s s SER 525 N -3.59 5.73 0.57 3.99 0.01 -1.26 -4.61 113.70 114.54 2w3s s SER 525 Ca 0.58 -0.10 -0.21 0.00 1.31 0.00 0.00 55.95 57.54 2w3s s SER 525 Cb -0.13 -1.10 -0.04 0.00 0.21 0.00 0.00 66.02 64.96 2w3s s SER 525 CO 0.47 -0.71 1.31 0.00 0.41 0.00 0.00 173.24 174.72 2w3s s ALA 526 N -2.42 2.69 -0.83 1.44 0.00 -1.26 -4.88 121.76 116.49 2w3s s ALA 526 Ca 0.51 1.24 -0.25 0.00 0.00 0.00 0.00 51.96 53.45 2w3s s ALA 526 Cb -0.10 -3.54 0.03 0.00 0.00 0.00 0.00 23.12 19.51 2w3s s ALA 526 CO 0.35 -1.36 1.45 0.99 0.00 0.00 0.00 175.76 177.18 2w3s s THR 527 N -1.37 3.73 0.36 0.00 2.01 -0.83 -4.87 115.64 114.66 2w3s s THR 527 Ca 0.75 -0.06 -0.17 0.00 0.31 0.00 0.00 61.69 62.52 2w3s s THR 527 Cb -0.38 -4.80 0.04 0.00 0.01 0.00 0.00 72.50 67.38 2w3s s THR 527 CO 0.43 -1.72 0.76 0.00 -0.69 0.00 0.00 174.62 173.41 2w3s s ALA 528 N 6.16 -0.84 -0.82 7.40 0.00 -1.26 -4.94 121.76 127.46 2w3s s ALA 528 Ca 0.45 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.76 2w3s s ALA 528 Cb -0.06 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.80 2w3s s ALA 528 CO 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 175.76 174.83 2w3s n ALA 529 N -0.51 -0.12 -2.04 0.00 0.00 -1.26 -2.56 120.51 114.03 2w3s n ALA 529 Ca -0.07 0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 2w3s n ALA 529 Cb 0.60 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.57 2w3s n ALA 529 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2w3s n SER 530 N -0.73 -5.19 -0.93 0.00 7.64 -1.26 -4.33 113.62 108.82 2w3s n SER 530 Ca -0.08 0.22 0.09 0.00 1.01 0.00 0.00 58.87 60.12 2w3s n SER 530 Cb 0.46 -4.46 0.19 0.00 -1.01 0.00 0.00 64.21 59.39 2w3s n SER 530 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2w3s n SER 531 N -1.60 3.15 0.39 6.43 3.41 -1.06 -4.59 113.62 119.75 2w3s n SER 531 Ca -0.21 -1.91 -0.15 0.00 -0.26 0.00 0.00 58.87 56.34 2w3s n SER 531 Cb 0.64 -0.24 -0.07 0.00 -0.26 0.00 0.00 64.21 64.28 2w3s n SER 531 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2w3s h GLY 532 N 3.42 -1.04 1.00 5.00 0.00 -1.88 -0.47 103.07 109.10 2w3s h GLY 532 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2w3s h GLY 532 CO 0.00 -0.38 0.06 0.00 0.00 0.00 0.00 176.54 176.23 2w3s h ALA 533 N -1.39 0.13 -0.68 3.60 0.00 -1.93 -0.11 119.26 118.87 2w3s h ALA 533 Ca -0.10 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.89 2w3s h ALA 533 Cb 0.76 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 2w3s h ALA 533 CO 0.17 -0.38 -0.45 -0.44 0.00 0.00 0.00 179.25 178.15 2w3s h ASP 534 N 0.13 -1.57 0.29 0.00 5.19 -1.80 0.17 116.42 118.83 2w3s h ASP 534 Ca 0.04 0.26 -0.32 0.00 -0.62 0.00 0.00 57.03 56.39 2w3s h ASP 534 Cb -0.01 0.73 -0.06 0.00 0.18 0.00 0.00 39.33 40.17 2w3s h ASP 534 CO -0.01 -0.32 -1.98 0.23 -3.12 0.00 0.00 179.24 174.05 2w3s n MET 535 N -5.40 0.66 0.00 3.56 2.81 -0.19 -3.45 117.12 115.11 2w3s n MET 535 Ca 0.03 0.19 -0.18 0.00 -1.81 0.00 0.00 57.70 55.93 2w3s n MET 535 Cb 0.35 -1.69 -0.10 0.00 -0.71 0.00 0.00 33.22 31.07 2w3s n MET 535 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2w3s h ASN 536 N 0.00 0.68 -0.63 7.83 2.35 -0.93 -2.75 115.58 122.13 2w3s h ASN 536 Ca -0.39 -0.72 0.13 0.00 -0.55 0.00 0.00 56.30 54.77 2w3s h ASN 536 Cb 2.09 -0.20 -0.11 0.00 0.05 0.00 0.00 38.32 40.14 2w3s h ASN 536 CO 0.06 1.30 -0.06 1.23 -1.65 0.00 0.00 177.43 178.31 2w3s h GLY 537 N 0.11 0.59 0.92 2.83 0.00 -0.80 0.54 103.07 107.27 2w3s h GLY 537 Ca -0.08 0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.43 2w3s h GLY 537 CO 0.14 -0.23 0.60 -0.33 0.00 0.00 0.00 176.54 176.73 2w3s h MET 538 N 0.07 1.09 0.06 4.80 2.86 -1.59 0.56 114.93 122.77 2w3s h MET 538 Ca 0.32 -0.07 -0.24 0.00 -2.06 0.00 0.00 59.70 57.66 2w3s h MET 538 Cb 0.52 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 2w3s h MET 538 CO -0.59 0.72 -1.08 0.00 1.06 0.00 0.00 176.91 177.02 2w3s h ALA 539 N 1.48 0.27 -0.10 6.32 0.00 -0.69 0.41 119.26 126.94 2w3s h ALA 539 Ca 0.38 -0.86 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2w3s h ALA 539 Cb 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2w3s h ALA 539 CO -0.12 1.06 0.04 0.28 0.00 0.00 0.00 179.25 180.51 2w3s h VAL 540 N 0.05 1.13 -0.30 0.00 2.07 0.21 -2.30 116.25 117.12 2w3s h VAL 540 Ca -0.07 -0.39 0.06 0.00 0.82 0.00 0.00 66.70 67.12 2w3s h VAL 540 Cb 1.81 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.73 2w3s h VAL 540 CO 0.16 0.12 -0.04 0.50 0.02 0.00 0.00 177.57 178.33 2w3s h LYS 541 N 0.02 0.04 -0.55 1.57 3.64 -0.83 0.21 116.57 120.67 2w3s h LYS 541 Ca 0.03 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.52 2w3s h LYS 541 Cb 0.14 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 31.86 2w3s h LYS 541 CO -0.00 0.03 -0.05 0.22 -2.27 0.00 0.00 179.45 177.37 2w3s h ASP 542 N 0.04 -0.34 -0.13 4.20 3.58 -0.80 0.77 116.42 123.74 2w3s h ASP 542 Ca 0.14 0.15 -0.08 0.00 0.42 0.00 0.00 57.03 57.66 2w3s h ASP 542 Cb 0.21 0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.53 2w3s h ASP 542 CO -0.27 -0.13 -0.21 0.00 -2.88 0.00 0.00 179.24 175.75 2w3s h ALA 543 N 1.52 0.20 -0.37 -0.78 0.00 -1.10 -3.00 119.26 115.72 2w3s h ALA 543 Ca 0.28 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2w3s h ALA 543 Cb 0.43 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2w3s h ALA 543 CO -0.50 0.15 0.14 0.00 0.00 0.00 0.00 179.25 179.04 2w3s h GLU 545 N 0.53 0.72 -0.89 0.00 5.08 -0.90 -1.02 114.58 118.10 2w3s h GLU 545 Ca 0.13 -0.24 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2w3s h GLU 545 Cb 0.12 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 2w3s h GLU 545 CO -0.01 0.82 0.59 1.15 -1.00 0.00 0.00 179.01 180.56 2w3s h THR 546 N 0.54 1.13 0.00 1.13 2.02 -1.18 0.76 112.91 117.31 2w3s h THR 546 Ca 0.11 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2w3s h THR 546 Cb 0.52 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2w3s h THR 546 CO 0.03 0.20 -0.00 -0.07 0.37 0.00 0.00 175.52 176.04 2w3s h LEU 547 N 1.09 -0.00 -0.78 2.58 3.38 -1.33 -1.51 115.31 118.74 2w3s h LEU 547 Ca 0.36 -0.44 0.14 0.00 0.09 0.00 0.00 57.88 58.03 2w3s h LEU 547 Cb 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.72 2w3s h LEU 547 CO -0.12 0.44 0.35 -0.09 0.09 0.00 0.00 178.44 179.11 2w3s h ARG 548 N -0.44 0.51 -0.70 1.13 2.43 0.27 -1.08 114.38 116.49 2w3s h ARG 548 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2w3s h ARG 548 Cb 0.44 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2w3s h ARG 548 CO 0.00 0.33 0.44 0.78 -1.51 0.00 0.00 179.97 180.02 2w3s h GLY 549 N 0.52 1.00 1.15 2.80 0.00 0.56 0.02 103.07 109.13 2w3s h GLY 549 Ca 0.42 -0.40 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 2w3s h GLY 549 CO -0.37 0.39 -0.35 3.21 0.00 0.00 0.00 176.54 179.41 2w3s h ARG 550 N 0.95 0.93 -0.66 4.80 3.08 -0.54 -2.43 114.38 120.50 2w3s h ARG 550 Ca 0.25 -0.47 -0.07 0.00 0.07 0.00 0.00 59.98 59.76 2w3s h ARG 550 Cb -0.07 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 2w3s h ARG 550 CO -0.05 1.13 0.14 -0.07 -1.07 0.00 0.00 179.97 180.05 2w3s h LEU 551 N 0.77 1.02 0.82 3.04 3.38 -0.53 -1.81 115.31 122.01 2w3s h LEU 551 Ca 0.07 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2w3s h LEU 551 Cb 0.94 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.42 2w3s h LEU 551 CO 0.09 1.00 -0.42 0.00 0.09 0.00 0.00 178.44 179.20 2w3s h ALA 552 N 1.06 -1.15 -0.76 1.53 0.00 -1.01 -0.86 119.26 118.07 2w3s h ALA 552 Ca 0.21 -0.25 0.17 0.00 0.00 0.00 0.00 54.91 55.04 2w3s h ALA 552 Cb 0.39 0.47 -0.14 0.00 0.00 0.00 0.00 17.79 18.52 2w3s h ALA 552 CO 0.01 -1.15 -0.05 0.78 0.00 0.00 0.00 179.25 178.83 2w3s h GLY 553 N -1.14 0.76 0.25 0.00 0.00 -1.39 0.81 103.07 102.36 2w3s h GLY 553 Ca -0.11 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2w3s h GLY 553 CO 0.17 -0.30 -0.46 -2.75 0.00 0.00 0.00 176.54 173.21 2w3s h PHE 554 N 0.06 -1.30 -0.35 5.60 3.57 -1.17 -1.33 116.94 122.02 2w3s h PHE 554 Ca 0.40 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.95 2w3s h PHE 554 Cb 0.69 0.53 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 2w3s h PHE 554 CO -0.48 -0.55 0.23 0.28 -2.23 0.00 0.00 178.31 175.56 2w3s h VAL 555 N -0.75 1.03 0.45 1.41 2.07 0.63 -1.54 116.25 119.55 2w3s h VAL 555 Ca -0.03 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 2w3s h VAL 555 Cb 0.71 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2w3s h VAL 555 CO -0.17 0.07 -0.22 0.00 0.02 0.00 0.00 177.57 177.27 2w3s h ALA 556 N 1.80 -0.61 -0.77 1.67 0.00 0.74 0.10 119.26 122.19 2w3s h ALA 556 Ca 0.14 -0.14 0.18 0.00 0.00 0.00 0.00 54.91 55.09 2w3s h ALA 556 Cb 0.11 0.24 -0.12 0.00 0.00 0.00 0.00 17.79 18.01 2w3s h ALA 556 CO -0.03 -0.57 0.12 0.00 0.00 0.00 0.00 179.25 178.77 2w3s h ALA 557 N -1.15 0.94 0.63 0.00 0.00 -1.15 0.47 119.26 119.00 2w3s h ALA 557 Ca -0.06 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2w3s h ALA 557 Cb 0.47 0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.59 2w3s h ALA 557 CO 0.10 -0.40 -0.30 -0.09 0.00 0.00 0.00 179.25 178.57 2w3s h ARG 558 N 0.19 -0.81 -0.95 0.00 2.43 -1.27 -2.62 114.38 111.36 2w3s h ARG 558 Ca 0.44 0.06 -0.15 0.00 -0.81 0.00 0.00 59.98 59.51 2w3s h ARG 558 Cb 0.79 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 30.43 2w3s h ARG 558 CO -0.59 -0.51 0.20 0.39 -1.51 0.00 0.00 179.97 177.94 2w3s n GLU 559 N -5.42 1.85 -1.64 0.20 -0.58 0.35 -4.93 120.64 110.47 2w3s n GLU 559 Ca -0.13 -1.27 -0.09 0.00 -0.42 0.00 0.00 57.16 55.25 2w3s n GLU 559 Cb 0.35 -1.59 0.01 0.00 -0.57 0.00 0.00 31.44 29.64 2w3s n GLU 559 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2w3s n GLY 560 N -0.06 0.05 0.43 0.62 0.00 0.16 -4.92 105.19 101.47 2w3s n GLY 560 Ca 0.21 0.27 -0.00 0.00 0.00 0.00 0.00 46.02 46.49 2w3s n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s ALA 562 N -1.12 3.16 0.15 0.00 0.00 -1.26 -4.33 121.76 118.36 2w3s s ALA 562 Ca 0.02 0.13 -0.09 0.00 0.00 0.00 0.00 51.96 52.03 2w3s s ALA 562 Cb -0.00 -2.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 2w3s s ALA 562 CO 0.01 -0.02 1.46 0.00 0.00 0.00 0.00 175.76 177.21 2w3s h ALA 563 N 1.41 0.58 0.00 0.00 0.00 -1.95 -3.03 119.26 116.26 2w3s h ALA 563 Ca -0.48 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.95 2w3s h ALA 563 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2w3s h ALA 563 CO 0.62 0.68 0.00 2.89 0.00 0.00 0.00 179.25 183.44 2w3s n ARG 564 N -4.02 0.09 0.00 0.00 1.85 -1.26 -1.06 116.66 112.27 2w3s n ARG 564 Ca -0.03 0.21 0.13 0.00 -1.00 0.00 0.00 57.85 57.16 2w3s n ARG 564 Cb 0.59 -1.50 0.34 0.00 -1.05 0.00 0.00 32.46 30.84 2w3s n ARG 564 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2w3s n ASP 565 N -1.26 1.53 -4.59 2.89 8.00 -1.15 -4.83 116.55 117.15 2w3s n ASP 565 Ca 0.03 -1.29 -0.42 0.00 0.71 0.00 0.00 54.79 53.81 2w3s n ASP 565 Cb 0.04 0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.21 2w3s n ASP 565 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w3s s VAL 566 N -2.28 4.79 -0.18 2.53 1.01 -0.22 -4.34 120.40 121.70 2w3s s VAL 566 Ca 0.28 0.88 -0.09 0.00 0.00 0.00 0.00 61.98 63.05 2w3s s VAL 566 Cb 0.20 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2w3s s VAL 566 CO 0.44 -0.36 0.12 -0.63 0.00 0.00 0.00 175.10 174.67 2w3s s ILE 567 N 2.97 5.32 -0.34 2.22 1.01 0.16 -4.90 121.20 127.64 2w3s s ILE 567 Ca 0.30 0.15 -0.03 0.00 0.00 0.00 0.00 60.65 61.07 2w3s s ILE 567 Cb -0.14 -3.40 0.06 0.00 0.01 0.00 0.00 42.46 39.00 2w3s s ILE 567 CO 0.15 0.48 0.07 -0.36 0.00 0.00 0.00 174.94 175.29 2w3s s PHE 568 N 0.08 3.36 -0.05 3.97 0.40 -1.26 0.33 117.98 124.80 2w3s s PHE 568 Ca 0.09 -1.96 -0.07 0.00 -0.60 0.00 0.00 56.93 54.39 2w3s s PHE 568 Cb -0.11 -2.45 0.02 0.00 0.51 0.00 0.00 43.02 40.98 2w3s s PHE 568 CO -0.01 -0.84 0.19 0.34 0.70 0.00 0.00 175.22 175.60 2w3s s ASP 569 N 1.43 -0.15 -1.65 1.36 -1.08 -0.74 -4.37 116.67 111.47 2w3s s ASP 569 Ca -0.01 0.25 -0.15 0.00 -0.52 0.00 0.00 52.55 52.12 2w3s s ASP 569 Cb -0.21 0.35 0.13 0.00 -1.46 0.00 0.00 42.92 41.73 2w3s s ASP 569 CO -0.01 -0.15 0.71 0.00 0.52 0.00 0.00 175.17 176.24 2w3s n ALA 570 N 2.58 -1.40 -1.05 3.66 0.00 -0.06 -1.10 120.51 123.15 2w3s n ALA 570 Ca -0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.21 2w3s n ALA 570 Cb 0.58 -3.10 -0.01 0.00 0.00 0.00 0.00 19.45 16.92 2w3s n ALA 570 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3s n GLY 571 N -1.53 0.50 3.31 0.00 0.00 0.26 -4.90 105.19 102.83 2w3s n GLY 571 Ca 0.00 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 2w3s n GLY 571 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3s s GLN 572 N -1.09 1.22 -0.09 1.61 -0.21 -0.26 -2.17 119.66 118.67 2w3s s GLN 572 Ca 0.00 -1.36 0.03 0.00 0.02 0.00 0.00 55.36 54.05 2w3s s GLN 572 Cb 0.00 -1.26 -0.01 0.00 1.00 0.00 0.00 33.01 32.74 2w3s s GLN 572 CO 0.00 0.25 -0.20 0.08 -2.12 0.00 0.00 175.29 173.30 2w3s s VAL 573 N -2.02 2.43 -0.00 1.09 1.01 -0.16 -1.79 120.40 120.96 2w3s s VAL 573 Ca 0.14 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2w3s s VAL 573 Cb -0.06 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2w3s s VAL 573 CO 0.06 0.55 -0.13 -1.10 0.00 0.00 0.00 175.10 174.48 2w3s s GLN 574 N 0.13 1.03 -0.19 2.72 -0.21 0.15 -2.17 119.66 121.13 2w3s s GLN 574 Ca -0.10 -0.49 -0.32 0.00 0.02 0.00 0.00 55.36 54.46 2w3s s GLN 574 Cb -0.16 -1.00 0.15 0.00 1.00 0.00 0.00 33.01 32.99 2w3s s GLN 574 CO 0.06 0.27 1.18 0.00 -2.12 0.00 0.00 175.29 174.68 2w3s s ALA 575 N -0.36 -2.04 -1.62 6.09 0.00 -0.91 0.40 121.76 123.32 2w3s s ALA 575 Ca 0.05 1.62 -0.13 0.00 0.00 0.00 0.00 51.96 53.49 2w3s s ALA 575 Cb -0.05 -0.48 0.11 0.00 0.00 0.00 0.00 23.12 22.70 2w3s s ALA 575 CO -0.00 -0.47 0.68 0.43 0.00 0.00 0.00 175.76 176.40 2w3s n SER 576 N 0.18 -2.51 -1.40 0.00 7.64 -1.26 0.02 113.62 116.29 2w3s n SER 576 Ca -0.02 -1.01 -0.18 0.00 1.01 0.00 0.00 58.87 58.67 2w3s n SER 576 Cb 0.59 -2.85 -0.08 0.00 -1.01 0.00 0.00 64.21 60.86 2w3s n SER 576 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w3s n GLY 577 N -1.60 1.70 3.36 0.23 0.00 -1.26 -4.98 105.19 102.64 2w3s n GLY 577 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2w3s n GLY 577 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3s s LYS 578 N -3.50 1.65 0.07 1.61 1.02 0.10 -5.14 119.74 115.54 2w3s s LYS 578 Ca 0.00 -1.19 0.08 0.00 0.02 0.00 0.00 55.97 54.88 2w3s s LYS 578 Cb 0.00 -1.93 -0.03 0.00 -0.52 0.00 0.00 37.83 35.35 2w3s s LYS 578 CO 0.00 0.48 -0.21 0.45 -0.92 0.00 0.00 175.35 175.15 2w3s s SER 579 N -1.52 2.59 0.05 2.83 0.15 -1.26 -2.15 113.70 114.38 2w3s s SER 579 Ca 0.12 -0.61 -0.14 0.00 0.70 0.00 0.00 55.95 56.02 2w3s s SER 579 Cb -0.10 -0.18 0.02 0.00 -1.71 0.00 0.00 66.02 64.05 2w3s s SER 579 CO 0.03 0.12 0.31 0.26 1.20 0.00 0.00 173.24 175.16 2w3s s TRP 580 N -0.97 -0.10 0.26 3.44 0.51 -0.92 -5.00 118.94 116.16 2w3s s TRP 580 Ca 0.08 -0.05 -0.30 0.00 -2.12 0.00 0.00 56.10 53.71 2w3s s TRP 580 Cb -0.09 0.10 -0.09 0.00 -0.81 0.00 0.00 33.47 32.57 2w3s s TRP 580 CO 0.03 -0.52 1.04 1.03 -0.51 0.00 0.00 176.95 178.02 2w3s s ARG 581 N -2.65 4.73 0.30 4.98 0.52 -1.26 -0.99 118.95 124.58 2w3s s ARG 581 Ca -0.04 1.68 0.02 0.00 -0.52 0.00 0.00 55.73 56.86 2w3s s ARG 581 Cb -0.01 -3.22 0.74 0.00 0.52 0.00 0.00 34.95 32.98 2w3s s ARG 581 CO -0.04 0.33 1.60 0.35 0.02 0.00 0.00 175.30 177.56 2w3s h PHE 582 N 3.94 0.08 -0.47 -0.53 3.57 -1.75 0.30 116.94 122.08 2w3s h PHE 582 Ca -0.46 0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.18 2w3s h PHE 582 Cb 1.21 0.12 -0.07 0.00 2.79 0.00 0.00 35.95 40.00 2w3s h PHE 582 CO 0.60 -0.37 0.08 0.00 -2.23 0.00 0.00 178.31 176.39 2w3s h ALA 583 N 1.91 0.51 -0.14 2.41 0.00 -1.86 -1.44 119.26 120.64 2w3s h ALA 583 Ca 0.58 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.60 2w3s h ALA 583 Cb 1.20 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2w3s h ALA 583 CO -0.83 -0.33 0.09 0.93 0.00 0.00 0.00 179.25 179.12 2w3s h GLU 584 N 0.21 0.16 -0.04 0.00 5.08 -0.76 0.82 114.58 120.04 2w3s h GLU 584 Ca 0.24 -0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 58.39 2w3s h GLU 584 Cb 0.32 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.55 2w3s h GLU 584 CO -0.32 0.11 -0.72 0.82 -1.00 0.00 0.00 179.01 177.89 2w3s h ILE 585 N 0.16 1.36 -0.88 3.13 1.08 -1.15 -0.96 117.51 120.25 2w3s h ILE 585 Ca 0.05 -2.06 0.00 0.00 -0.39 0.00 0.00 64.86 62.46 2w3s h ILE 585 Cb 0.02 2.39 -0.04 0.00 -3.07 0.00 0.00 36.82 36.12 2w3s h ILE 585 CO -0.01 0.62 0.56 0.58 -0.69 0.00 0.00 178.15 179.21 2w3s h VAL 586 N 0.15 1.23 0.38 1.67 2.07 -0.25 0.35 116.25 121.86 2w3s h VAL 586 Ca -0.08 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 2w3s h VAL 586 Cb 1.40 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2w3s h VAL 586 CO 0.14 0.23 -0.18 0.00 0.02 0.00 0.00 177.57 177.78 2w3s h ALA 587 N 1.31 -0.52 -0.62 1.67 0.00 -0.88 0.34 119.26 120.56 2w3s h ALA 587 Ca 0.32 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.14 2w3s h ALA 587 Cb -0.10 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2w3s h ALA 587 CO -0.06 -0.69 0.28 0.00 0.00 0.00 0.00 179.25 178.78 2w3s h ALA 588 N -0.19 0.82 -0.65 0.00 0.00 -0.89 -1.24 119.26 117.11 2w3s h ALA 588 Ca -0.05 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2w3s h ALA 588 Cb 0.50 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2w3s h ALA 588 CO 0.09 -0.10 0.41 0.00 0.00 0.00 0.00 179.25 179.64 2w3s h ALA 589 N 1.38 0.85 0.22 0.00 0.00 -0.01 0.12 119.26 121.82 2w3s h ALA 589 Ca 0.30 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2w3s h ALA 589 Cb 0.30 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2w3s h ALA 589 CO -0.25 0.17 -0.46 -0.92 0.00 0.00 0.00 179.25 177.79 2w3s h TYR 590 N 0.80 -1.30 -0.95 0.00 3.20 0.44 -1.22 116.97 117.94 2w3s h TYR 590 Ca 0.26 0.03 0.29 0.00 3.14 0.00 0.00 58.73 62.44 2w3s h TYR 590 Cb 0.01 0.54 -0.15 0.00 1.54 0.00 0.00 36.73 38.67 2w3s h TYR 590 CO -0.05 -0.57 0.39 0.52 -1.64 0.00 0.00 178.16 176.81 2w3s h MET 591 N -0.76 0.23 0.00 1.82 2.86 -0.87 0.37 114.93 118.58 2w3s h MET 591 Ca -0.01 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2w3s h MET 591 Cb 0.74 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.35 2w3s h MET 591 CO -0.20 0.15 0.00 0.00 1.06 0.00 0.00 176.91 177.92 2w3s n ALA 592 N -2.52 2.54 -2.98 6.32 0.00 0.37 -4.91 120.51 119.34 2w3s n ALA 592 Ca 0.27 -0.17 -0.13 0.00 0.00 0.00 0.00 53.44 53.42 2w3s n ALA 592 Cb 0.86 -1.43 0.06 0.00 0.00 0.00 0.00 19.45 18.93 2w3s n ALA 592 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2w3s n ARG 593 N -0.97 -2.54 -4.48 0.00 1.74 0.12 -5.05 116.66 105.48 2w3s n ARG 593 Ca 0.20 0.71 -0.33 0.00 -0.77 0.00 0.00 57.85 57.66 2w3s n ARG 593 Cb 0.09 -5.09 -0.15 0.00 -1.02 0.00 0.00 32.46 26.29 2w3s n ARG 593 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2w3s s ILE 594 N -3.31 2.71 0.01 0.55 1.01 -0.95 -5.05 121.20 116.15 2w3s s ILE 594 Ca 0.30 -0.75 -0.36 0.00 0.00 0.00 0.00 60.65 59.84 2w3s s ILE 594 Cb -0.04 -2.15 -0.15 0.00 0.01 0.00 0.00 42.46 40.13 2w3s s ILE 594 CO 0.60 0.51 1.56 -0.24 0.00 0.00 0.00 174.94 177.37 2w3s n SER 595 N 4.11 2.41 -2.08 3.58 2.88 -1.26 -4.65 113.62 118.61 2w3s n SER 595 Ca -0.19 1.08 -0.27 0.00 -1.33 0.00 0.00 58.87 58.16 2w3s n SER 595 Cb 0.52 -1.26 0.05 0.00 -0.75 0.00 0.00 64.21 62.76 2w3s n SER 595 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2w3s n LEU 596 N 3.91 5.82 -3.85 2.46 4.77 -1.26 -4.94 117.00 123.91 2w3s n LEU 596 Ca 0.20 -4.55 -0.24 0.00 -0.03 0.00 0.00 56.01 51.39 2w3s n LEU 596 Cb 0.22 -0.57 -0.17 0.00 -2.33 0.00 0.00 43.42 40.57 2w3s n LEU 596 CO 0.68 1.86 -0.41 -0.55 -1.33 0.00 0.00 177.39 177.64 2w3s s SER 597 N -2.96 1.69 -0.02 -1.43 0.15 -1.26 -1.84 113.70 108.04 2w3s s SER 597 Ca 0.55 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.03 2w3s s SER 597 Cb 0.44 -0.59 0.02 0.00 -1.71 0.00 0.00 66.02 64.18 2w3s s SER 597 CO 0.02 -0.14 0.01 0.00 1.20 0.00 0.00 173.24 174.34 2w3s s ALA 598 N 1.65 0.15 0.21 5.45 0.00 -0.95 -5.02 121.76 123.25 2w3s s ALA 598 Ca 0.01 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 52.00 2w3s s ALA 598 Cb -0.13 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.72 2w3s s ALA 598 CO -0.05 -0.06 0.60 0.95 0.00 0.00 0.00 175.76 177.20 2w3s s THR 599 N 0.71 4.82 0.05 0.00 -4.23 -1.26 -0.40 115.64 115.33 2w3s s THR 599 Ca -0.06 0.77 0.04 0.00 -1.18 0.00 0.00 61.69 61.26 2w3s s THR 599 Cb -0.09 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.04 2w3s s THR 599 CO -0.02 0.07 -0.11 -0.83 -0.54 0.00 0.00 174.62 173.19 2w3s s GLY 600 N -2.01 0.69 0.04 3.99 0.00 0.23 -4.46 107.32 105.79 2w3s s GLY 600 Ca 0.44 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 44.33 2w3s s GLY 600 CO 0.20 -0.85 -0.05 -0.12 0.00 0.00 0.00 173.10 172.27 2w3s s PHE 601 N -1.14 0.47 -0.05 1.90 5.36 -1.26 0.74 117.98 124.00 2w3s s PHE 601 Ca -0.04 -0.61 -0.05 0.00 -0.96 0.00 0.00 56.93 55.27 2w3s s PHE 601 Cb -0.09 -0.31 0.01 0.00 -0.34 0.00 0.00 43.02 42.30 2w3s s PHE 601 CO 0.01 -0.18 0.13 -0.47 -1.46 0.00 0.00 175.22 173.26 2w3s s TYR 602 N -1.89 -0.13 -0.08 10.12 5.04 0.11 -4.65 117.35 125.87 2w3s s TYR 602 Ca -0.09 0.32 0.03 0.00 -2.44 0.00 0.00 57.07 54.88 2w3s s TYR 602 Cb -0.07 0.04 0.01 0.00 0.35 0.00 0.00 41.96 42.29 2w3s s TYR 602 CO -0.02 -0.09 -0.16 0.00 -1.34 0.00 0.00 175.55 173.94 2w3s s ALA 603 N -0.05 1.59 0.02 3.97 0.00 -1.26 -0.51 121.76 125.52 2w3s s ALA 603 Ca -0.01 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.02 2w3s s ALA 603 Cb -0.02 -0.68 -0.07 0.00 0.00 0.00 0.00 23.12 22.36 2w3s s ALA 603 CO 0.00 0.12 1.54 0.99 0.00 0.00 0.00 175.76 178.42 2w3s s THR 604 N 0.64 3.40 0.69 0.00 2.01 -1.10 -5.02 115.64 116.26 2w3s s THR 604 Ca -0.14 0.78 -0.02 0.00 0.31 0.00 0.00 61.69 62.61 2w3s s THR 604 Cb -0.16 -3.50 0.09 0.00 0.01 0.00 0.00 72.50 68.94 2w3s s THR 604 CO 0.04 -0.01 0.96 -2.16 -0.69 0.00 0.00 174.62 172.76 2w3s s PRO 605 N 2.74 1.93 0.00 4.92 0.04 -1.26 -4.56 135.00 138.81 2w3s s PRO 605 Ca 0.69 -0.81 0.00 0.00 0.04 0.00 0.00 61.00 60.93 2w3s s PRO 605 Cb -0.35 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 31.88 2w3s s PRO 605 CO 0.29 -1.29 0.00 1.63 0.04 0.00 0.00 177.00 177.68 2w3s n LYS 606 N -2.79 0.00 -3.45 4.56 5.02 -1.26 -4.85 118.16 115.39 2w3s n LYS 606 Ca 0.12 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 56.06 2w3s n LYS 606 Cb 0.60 -3.21 -0.06 0.00 -0.02 0.00 0.00 35.03 32.35 2w3s n LYS 606 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2w3s s LEU 607 N 0.00 4.33 0.00 -0.35 1.43 -1.26 -4.83 118.68 117.99 2w3s s LEU 607 Ca 0.00 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.05 2w3s s LEU 607 Cb 0.00 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 43.03 2w3s s LEU 607 CO 0.00 0.11 0.00 -0.24 0.23 0.00 0.00 176.35 176.45 2w3s n SER 608 N 0.76 0.00 -3.60 2.29 2.88 0.62 -4.99 113.62 111.58 2w3s n SER 608 Ca -0.06 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.40 2w3s n SER 608 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 2w3s n SER 608 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2w3s s TRP 609 N -0.74 -0.28 -0.30 0.66 1.48 -1.26 0.44 118.94 118.94 2w3s s TRP 609 Ca 0.00 0.48 -0.18 0.00 -1.06 0.00 0.00 56.10 55.34 2w3s s TRP 609 Cb 0.00 0.46 -0.02 0.00 -1.16 0.00 0.00 33.47 32.75 2w3s s TRP 609 CO 0.00 -0.25 0.49 0.34 -4.06 0.00 0.00 176.95 173.47 2w3s s ASP 610 N -1.05 6.36 0.15 -2.66 3.68 0.65 -4.94 116.67 118.85 2w3s s ASP 610 Ca 0.01 0.26 -0.07 0.00 2.13 0.00 0.00 52.55 54.88 2w3s s ASP 610 Cb -0.01 -2.26 -0.03 0.00 -1.45 0.00 0.00 42.92 39.17 2w3s s ASP 610 CO -0.01 -0.35 1.39 -0.09 0.13 0.00 0.00 175.17 176.24 2w3s h ARG 611 N 8.23 0.62 -0.12 4.34 2.43 -1.97 -1.26 114.38 126.64 2w3s h ARG 611 Ca -0.29 -0.47 -0.18 0.00 -0.81 0.00 0.00 59.98 58.23 2w3s h ARG 611 Cb 1.14 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.77 2w3s h ARG 611 CO 0.73 1.10 -0.67 -0.07 -1.51 0.00 0.00 179.97 179.54 2w3s h LEU 612 N 0.43 0.57 0.00 3.80 3.38 -1.95 -3.10 115.31 118.45 2w3s h LEU 612 Ca -0.03 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2w3s h LEU 612 Cb 1.30 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2w3s h LEU 612 CO 0.14 1.08 -0.59 0.03 0.09 0.00 0.00 178.44 179.19 2w3s h ARG 613 N 0.35 0.00 -3.74 1.13 3.08 -1.94 -3.47 114.38 109.78 2w3s h ARG 613 Ca -0.02 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 2w3s h ARG 613 Cb 1.24 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.37 2w3s h ARG 613 CO 0.12 0.00 -0.37 0.41 -1.07 0.00 0.00 179.97 179.06 2w3s n GLY 614 N 1.26 0.06 2.91 0.04 0.00 -0.76 -4.82 105.19 103.88 2w3s n GLY 614 Ca 0.03 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2w3s n GLY 614 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3s s GLN 615 N -4.66 0.06 0.00 1.61 -1.52 -0.55 -4.44 119.66 110.17 2w3s s GLN 615 Ca 0.00 0.17 0.00 0.00 -1.95 0.00 0.00 55.36 53.58 2w3s s GLN 615 Cb -0.00 -0.06 0.00 0.00 -0.22 0.00 0.00 33.01 32.73 2w3s s GLN 615 CO 0.35 -0.07 0.00 0.41 -0.25 0.00 0.00 175.29 175.73 2w3s n GLY 616 N 3.48 0.78 3.01 3.09 0.00 -0.85 0.24 105.19 114.94 2w3s n GLY 616 Ca -0.18 -1.77 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 2w3s n GLY 616 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w3s s ARG 617 N -1.73 2.36 0.11 1.61 3.52 0.17 -4.12 118.95 120.88 2w3s s ARG 617 Ca 0.00 -2.75 0.26 0.00 -0.13 0.00 0.00 55.73 53.11 2w3s s ARG 617 Cb 0.00 -3.53 0.97 0.00 -1.56 0.00 0.00 34.95 30.83 2w3s s ARG 617 CO 0.00 -1.17 1.79 -0.35 -0.81 0.00 0.00 175.30 174.76 2w3s n PRO 618 N 3.01 0.13 -5.00 5.12 -0.04 -1.26 -0.27 135.00 136.69 2w3s n PRO 618 Ca 0.09 0.16 -0.27 0.00 -0.04 0.00 0.00 63.50 63.45 2w3s n PRO 618 Cb 0.35 -1.66 -0.16 0.00 -0.04 0.00 0.00 33.50 31.99 2w3s n PRO 618 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2w3s s PHE 619 N -3.08 1.87 0.15 0.54 0.40 -1.26 -4.65 117.98 111.95 2w3s s PHE 619 Ca 0.11 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 55.89 2w3s s PHE 619 Cb 0.14 -1.21 0.03 0.00 0.51 0.00 0.00 43.02 42.49 2w3s s PHE 619 CO 0.51 -0.07 1.71 1.25 0.70 0.00 0.00 175.22 179.32 2w3s h LEU 620 N 5.78 0.67 -8.00 -0.37 5.85 -1.80 -3.47 115.31 113.96 2w3s h LEU 620 Ca -0.37 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.21 2w3s h LEU 620 Cb 1.15 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.01 2w3s h LEU 620 CO 0.48 0.64 0.36 -0.72 -0.34 0.00 0.00 178.44 178.85 2w3s s TYR 621 N -5.60 0.14 0.08 1.25 -0.85 -1.26 -4.97 117.35 106.15 2w3s s TYR 621 Ca -0.13 -0.78 0.09 0.00 -0.52 0.00 0.00 57.07 55.73 2w3s s TYR 621 Cb 0.11 0.82 -0.03 0.00 0.38 0.00 0.00 41.96 43.25 2w3s s TYR 621 CO 0.77 -1.46 -0.25 -0.06 -1.52 0.00 0.00 175.55 173.03 2w3s s PHE 622 N -2.08 2.17 0.02 -3.49 0.40 -1.26 -1.56 117.98 112.18 2w3s s PHE 622 Ca 0.18 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 2w3s s PHE 622 Cb -0.04 -1.24 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 2w3s s PHE 622 CO 0.10 0.20 0.02 0.00 0.70 0.00 0.00 175.22 176.24 2w3s s ALA 623 N -0.93 3.34 0.28 5.36 0.00 -0.02 -4.91 121.76 124.88 2w3s s ALA 623 Ca 0.11 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.13 2w3s s ALA 623 Cb -0.10 -1.34 -0.06 0.00 0.00 0.00 0.00 23.12 21.62 2w3s s ALA 623 CO 0.04 0.67 0.04 0.71 0.00 0.00 0.00 175.76 177.21 2w3s s TYR 624 N -1.17 1.78 0.00 0.00 1.51 -1.26 -0.59 117.35 117.63 2w3s s TYR 624 Ca 0.22 -0.96 0.00 0.00 -1.01 0.00 0.00 57.07 55.32 2w3s s TYR 624 Cb -0.12 -1.10 0.00 0.00 -0.11 0.00 0.00 41.96 40.63 2w3s s TYR 624 CO 0.13 -0.03 0.00 0.41 -1.11 0.00 0.00 175.55 174.95 2w3s n GLY 625 N -0.57 1.31 3.38 0.71 0.00 -1.15 -1.42 105.19 107.45 2w3s n GLY 625 Ca -0.03 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 2w3s n GLY 625 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s ALA 626 N -2.00 -0.80 -0.13 4.61 0.00 -0.88 -0.16 121.76 122.41 2w3s s ALA 626 Ca 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 51.96 51.68 2w3s s ALA 626 Cb 0.00 0.75 0.05 0.00 0.00 0.00 0.00 23.12 23.93 2w3s s ALA 626 CO 0.00 -0.69 0.29 0.00 0.00 0.00 0.00 175.76 175.36 2w3s s ALA 627 N -3.85 -0.69 -0.23 0.00 0.00 -0.51 -2.73 121.76 113.75 2w3s s ALA 627 Ca 0.07 1.12 -0.09 0.00 0.00 0.00 0.00 51.96 53.05 2w3s s ALA 627 Cb 0.01 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 2w3s s ALA 627 CO -0.08 -0.32 0.13 0.42 0.00 0.00 0.00 175.76 175.91 2w3s s ILE 628 N 1.57 5.08 0.04 0.00 1.01 -0.37 -1.71 121.20 126.82 2w3s s ILE 628 Ca -0.07 0.08 0.09 0.00 0.00 0.00 0.00 60.65 60.75 2w3s s ILE 628 Cb -0.10 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.98 2w3s s ILE 628 CO -0.10 0.37 -0.24 -0.89 0.00 0.00 0.00 174.94 174.08 2w3s s THR 629 N 1.00 2.30 -0.07 2.92 2.01 -0.23 -0.56 115.64 123.02 2w3s s THR 629 Ca 0.06 -1.30 0.02 0.00 0.31 0.00 0.00 61.69 60.78 2w3s s THR 629 Cb -0.14 -1.91 0.01 0.00 0.01 0.00 0.00 72.50 70.48 2w3s s THR 629 CO 0.04 0.38 -0.13 -0.70 -0.69 0.00 0.00 174.62 173.52 2w3s s GLU 630 N -1.22 1.83 0.09 4.92 2.12 0.55 -1.13 118.70 125.86 2w3s s GLU 630 Ca 0.12 -0.45 0.05 0.00 0.36 0.00 0.00 54.97 55.05 2w3s s GLU 630 Cb -0.10 -1.51 -0.03 0.00 0.26 0.00 0.00 34.13 32.74 2w3s s GLU 630 CO 0.02 0.02 -0.13 0.14 -0.54 0.00 0.00 175.26 174.77 2w3s s VAL 631 N 0.72 1.10 -0.04 3.70 -7.23 -0.32 0.06 120.40 118.40 2w3s s VAL 631 Ca -0.13 -1.51 0.02 0.00 -1.81 0.00 0.00 61.98 58.55 2w3s s VAL 631 Cb -0.16 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.49 2w3s s VAL 631 CO 0.03 -0.38 -0.08 0.68 -0.31 0.00 0.00 175.10 175.04 2w3s s VAL 632 N -1.85 3.60 0.37 1.32 -7.23 -0.37 -0.47 120.40 115.77 2w3s s VAL 632 Ca 0.03 -0.64 0.06 0.00 -1.81 0.00 0.00 61.98 59.62 2w3s s VAL 632 Cb -0.07 -2.50 -0.07 0.00 0.56 0.00 0.00 36.38 34.30 2w3s s VAL 632 CO 0.02 0.51 0.01 0.27 -0.31 0.00 0.00 175.10 175.60 2w3s s ILE 633 N -0.88 1.76 -0.28 -0.62 -4.36 0.42 -1.70 121.20 115.54 2w3s s ILE 633 Ca 0.14 -2.03 -0.03 0.00 -0.26 0.00 0.00 60.65 58.48 2w3s s ILE 633 Cb -0.11 -2.87 0.03 0.00 1.25 0.00 0.00 42.46 40.76 2w3s s ILE 633 CO 0.04 -0.04 -0.01 -0.62 0.24 0.00 0.00 174.94 174.55 2w3s s ASP 634 N -3.62 4.67 0.24 4.36 2.15 -0.74 -2.22 116.67 121.52 2w3s s ASP 634 Ca 0.35 -1.00 0.19 0.00 0.43 0.00 0.00 52.55 52.51 2w3s s ASP 634 Cb 0.09 -1.72 0.92 0.00 -0.30 0.00 0.00 42.92 41.91 2w3s s ASP 634 CO 0.17 -0.19 1.57 0.54 -0.17 0.00 0.00 175.17 177.08 2w3s n ARG 635 N 4.69 0.13 -0.09 4.34 1.74 0.17 -1.47 116.66 126.17 2w3s n ARG 635 Ca -0.15 0.54 -0.12 0.00 -0.77 0.00 0.00 57.85 57.35 2w3s n ARG 635 Cb 0.46 -1.84 -0.04 0.00 -1.02 0.00 0.00 32.46 30.01 2w3s n ARG 635 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2w3s n LEU 636 N -2.10 1.89 -0.01 0.55 4.77 -1.26 -4.80 117.00 116.04 2w3s n LEU 636 Ca -0.00 0.45 -0.19 0.00 -0.03 0.00 0.00 56.01 56.24 2w3s n LEU 636 Cb 0.09 -0.82 -0.14 0.00 -2.33 0.00 0.00 43.42 40.22 2w3s n LEU 636 CO 0.11 -0.17 -0.81 0.35 -1.33 0.00 0.00 177.39 175.54 2w3s n THR 637 N -4.49 1.74 0.00 -5.08 -2.24 -1.23 -5.00 114.28 97.98 2w3s n THR 637 Ca -0.19 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 2w3s n THR 637 Cb 0.49 -1.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 2w3s n THR 637 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3s n GLY 638 N 1.95 0.69 3.41 3.38 0.00 -0.54 -4.56 105.19 109.53 2w3s n GLY 638 Ca -0.31 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 2w3s n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w3s n GLU 639 N -1.09 -1.01 -3.61 1.61 1.02 -1.26 -4.32 120.64 111.98 2w3s n GLU 639 Ca 0.00 -0.26 -0.03 0.00 -0.02 0.00 0.00 57.16 56.85 2w3s n GLU 639 Cb 0.00 -1.90 -0.01 0.00 -0.02 0.00 0.00 31.44 29.50 2w3s n GLU 639 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2w3s s ASN 640 N -2.08 -0.14 -0.26 1.62 2.20 -1.26 -1.79 114.94 113.24 2w3s s ASN 640 Ca 0.59 -0.08 -0.18 0.00 -0.94 0.00 0.00 52.86 52.25 2w3s s ASN 640 Cb -0.19 0.21 0.07 0.00 -2.00 0.00 0.00 41.25 39.34 2w3s s ASN 640 CO 0.66 -0.36 0.65 -0.60 -2.94 0.00 0.00 177.10 174.51 2w3s s ARG 641 N -2.58 0.70 -0.65 3.55 3.00 -0.69 -5.00 118.95 117.29 2w3s s ARG 641 Ca 0.11 1.06 -0.23 0.00 -1.00 0.00 0.00 55.73 55.67 2w3s s ARG 641 Cb 0.01 0.22 0.07 0.00 0.00 0.00 0.00 34.95 35.25 2w3s s ARG 641 CO -0.04 -0.13 0.95 0.42 0.00 0.00 0.00 175.30 176.50 2w3s s ILE 642 N 1.10 4.34 0.10 4.11 1.01 -1.26 -1.23 121.20 129.37 2w3s s ILE 642 Ca -0.06 -0.32 -0.14 0.00 0.00 0.00 0.00 60.65 60.13 2w3s s ILE 642 Cb -0.05 -4.67 -0.11 0.00 0.01 0.00 0.00 42.46 37.64 2w3s s ILE 642 CO -0.11 -1.42 1.36 -0.07 0.00 0.00 0.00 174.94 174.70 2w3s h LEU 643 N 11.29 0.85 -7.26 2.97 3.38 -0.72 -2.92 115.31 122.91 2w3s h LEU 643 Ca -0.29 -0.55 -0.12 0.00 0.09 0.00 0.00 57.88 57.01 2w3s h LEU 643 Cb 1.07 -0.25 -0.26 0.00 0.09 0.00 0.00 40.66 41.31 2w3s h LEU 643 CO 1.17 1.25 -0.30 -0.60 0.09 0.00 0.00 178.44 180.05 2w3s s ARG 644 N -4.05 0.39 -0.08 1.13 3.52 -1.01 -1.16 118.95 117.69 2w3s s ARG 644 Ca -0.11 0.71 0.03 0.00 -0.13 0.00 0.00 55.73 56.23 2w3s s ARG 644 Cb 0.09 0.03 0.01 0.00 -1.56 0.00 0.00 34.95 33.51 2w3s s ARG 644 CO 0.87 -0.13 -0.16 0.99 -0.81 0.00 0.00 175.30 176.05 2w3s s THR 645 N 1.11 1.42 -0.20 4.11 2.01 0.59 -0.33 115.64 124.35 2w3s s THR 645 Ca -0.07 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.30 2w3s s THR 645 Cb -0.07 -1.27 0.03 0.00 0.01 0.00 0.00 72.50 71.20 2w3s s THR 645 CO -0.09 0.42 -0.17 -1.81 -0.69 0.00 0.00 174.62 172.27 2w3s s ASP 646 N 0.57 3.53 -0.06 3.53 1.01 0.28 -0.10 116.67 125.42 2w3s s ASP 646 Ca -0.16 -0.88 0.06 0.00 0.71 0.00 0.00 52.55 52.28 2w3s s ASP 646 Cb -0.16 -1.50 -0.01 0.00 1.01 0.00 0.00 42.92 42.26 2w3s s ASP 646 CO 0.05 -0.06 -0.25 -0.63 0.21 0.00 0.00 175.17 174.50 2w3s s ILE 647 N 1.23 2.09 -0.20 0.77 1.01 0.53 -1.24 121.20 125.39 2w3s s ILE 647 Ca 0.01 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.62 2w3s s ILE 647 Cb -0.15 -1.76 0.04 0.00 0.01 0.00 0.00 42.46 40.60 2w3s s ILE 647 CO -0.10 0.57 -0.14 -0.22 0.00 0.00 0.00 174.94 175.04 2w3s s LEU 648 N -0.14 2.48 0.10 2.97 2.96 -1.11 0.21 118.68 126.15 2w3s s LEU 648 Ca -0.04 -0.91 0.09 0.00 -0.22 0.00 0.00 54.13 53.06 2w3s s LEU 648 Cb -0.14 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 2w3s s LEU 648 CO 0.04 -0.10 -0.24 -2.28 -1.32 0.00 0.00 176.35 172.45 2w3s s HIS 649 N 1.29 2.07 -0.47 5.38 5.65 0.39 -2.06 115.29 127.53 2w3s s HIS 649 Ca -0.01 -0.40 -0.16 0.00 0.25 0.00 0.00 55.06 54.75 2w3s s HIS 649 Cb -0.16 -1.15 0.07 0.00 -1.18 0.00 0.00 32.58 30.16 2w3s s HIS 649 CO -0.09 0.23 0.40 0.34 -0.65 0.00 0.00 174.74 174.97 2w3s s ASP 650 N -1.79 6.15 -0.34 9.88 2.15 -0.51 0.71 116.67 132.92 2w3s s ASP 650 Ca 0.10 -1.30 0.08 0.00 0.43 0.00 0.00 52.55 51.87 2w3s s ASP 650 Cb -0.10 -2.19 0.66 0.00 -0.30 0.00 0.00 42.92 40.99 2w3s s ASP 650 CO 0.04 -0.65 1.74 0.00 -0.17 0.00 0.00 175.17 176.14 2w3s n ALA 651 N 5.24 4.71 -0.79 3.66 0.00 -1.26 -4.35 120.51 127.72 2w3s n ALA 651 Ca -0.12 -2.67 0.00 0.00 0.00 0.00 0.00 53.44 50.65 2w3s n ALA 651 Cb 0.44 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.72 2w3s n ALA 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w3s n GLY 652 N -0.68 1.76 3.55 0.00 0.00 -1.26 -1.34 105.19 107.21 2w3s n GLY 652 Ca 0.44 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2w3s n GLY 652 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s ALA 653 N -1.79 3.20 -0.07 4.61 0.00 0.16 -3.12 121.76 124.75 2w3s s ALA 653 Ca 0.00 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 2w3s s ALA 653 Cb 0.00 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 2w3s s ALA 653 CO 0.00 -2.21 1.16 0.45 0.00 0.00 0.00 175.76 175.17 2w3s s SER 654 N 2.51 7.09 0.45 0.00 0.15 -1.24 -2.71 113.70 119.94 2w3s s SER 654 Ca 0.34 1.75 0.19 0.00 0.70 0.00 0.00 55.95 58.93 2w3s s SER 654 Cb -0.11 -2.56 1.14 0.00 -1.71 0.00 0.00 66.02 62.79 2w3s s SER 654 CO 0.23 -0.56 1.92 -0.07 1.20 0.00 0.00 173.24 175.96 2w3s h LEU 655 N 8.19 0.31 -6.08 3.45 3.38 -1.89 -3.34 115.31 119.32 2w3s h LEU 655 Ca -0.33 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.67 2w3s h LEU 655 Cb 1.16 -0.04 -0.23 0.00 0.09 0.00 0.00 40.66 41.64 2w3s h LEU 655 CO 0.88 0.15 -0.37 0.21 0.09 0.00 0.00 178.44 179.40 2w3s s ASN 656 N -5.90 -1.11 0.41 -0.43 3.84 -1.26 0.14 114.94 110.63 2w3s s ASN 656 Ca -0.07 0.37 0.13 0.00 0.21 0.00 0.00 52.86 53.50 2w3s s ASN 656 Cb 0.21 1.88 0.86 0.00 -0.55 0.00 0.00 41.25 43.66 2w3s s ASN 656 CO 0.77 -0.29 1.92 -0.65 -2.79 0.00 0.00 177.10 176.05 2w3s h PRO 657 N 8.04 0.05 -0.06 0.43 0.11 -1.76 -1.80 132.00 137.00 2w3s h PRO 657 Ca -0.12 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.91 2w3s h PRO 657 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2w3s h PRO 657 CO 0.22 0.28 -0.25 0.00 -0.21 0.00 0.00 178.00 178.04 2w3s h ALA 658 N 1.72 0.11 0.00 -0.75 0.00 -1.87 -1.86 119.26 116.61 2w3s h ALA 658 Ca 0.01 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 2w3s h ALA 658 Cb 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2w3s h ALA 658 CO 0.03 0.11 -0.34 -0.07 0.00 0.00 0.00 179.25 178.98 2w3s h LEU 659 N -0.26 0.00 -0.03 0.00 3.38 -1.78 -1.69 115.31 114.93 2w3s h LEU 659 Ca -0.02 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 2w3s h LEU 659 Cb 0.90 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.67 2w3s h LEU 659 CO 0.05 0.34 -0.78 0.44 0.09 0.00 0.00 178.44 178.58 2w3s h ASP 660 N 0.00 0.73 -0.32 -0.43 5.19 -1.29 -1.49 116.42 118.80 2w3s h ASP 660 Ca -0.00 -0.73 0.03 0.00 -0.62 0.00 0.00 57.03 55.71 2w3s h ASP 660 Cb 0.69 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.95 2w3s h ASP 660 CO 0.04 1.36 0.12 0.40 -3.12 0.00 0.00 179.24 178.04 2w3s h ILE 661 N 0.17 0.92 -0.55 0.35 1.08 -1.20 -1.64 117.51 116.64 2w3s h ILE 661 Ca -0.09 -0.09 0.11 0.00 -0.39 0.00 0.00 64.86 64.40 2w3s h ILE 661 Cb 1.45 0.64 -0.10 0.00 -3.07 0.00 0.00 36.82 35.74 2w3s h ILE 661 CO 0.15 0.05 -0.12 1.23 -0.69 0.00 0.00 178.15 178.78 2w3s h GLY 662 N 0.26 0.43 1.12 5.37 0.00 -1.29 0.15 103.07 109.11 2w3s h GLY 662 Ca 0.14 0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.67 2w3s h GLY 662 CO -0.14 -0.21 0.53 1.46 0.00 0.00 0.00 176.54 178.18 2w3s h GLN 663 N 0.02 0.97 0.36 4.80 1.08 -0.75 -2.05 115.11 119.53 2w3s h GLN 663 Ca 0.27 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.39 2w3s h GLN 663 Cb 0.41 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2w3s h GLN 663 CO -0.55 0.64 -0.17 0.82 -0.95 0.00 0.00 178.83 178.62 2w3s h ILE 664 N 1.00 0.42 -0.70 2.54 2.04 -0.32 -0.75 117.51 121.74 2w3s h ILE 664 Ca 0.31 -0.71 0.15 0.00 1.00 0.00 0.00 64.86 65.62 2w3s h ILE 664 Cb 0.01 0.66 -0.11 0.00 -0.74 0.00 0.00 36.82 36.64 2w3s h ILE 664 CO -0.09 0.09 0.13 -0.33 0.00 0.00 0.00 178.15 177.95 2w3s h GLU 665 N -0.98 0.22 -0.13 2.37 5.08 -0.66 0.27 114.58 120.75 2w3s h GLU 665 Ca -0.05 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2w3s h GLU 665 Cb 0.52 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2w3s h GLU 665 CO 0.08 0.15 -0.08 0.78 -1.00 0.00 0.00 179.01 178.94 2w3s h GLY 666 N 0.23 0.31 0.99 -3.84 0.00 -1.39 -2.57 103.07 96.79 2w3s h GLY 666 Ca 0.39 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 2w3s h GLY 666 CO -0.51 0.26 0.30 0.00 0.00 0.00 0.00 176.54 176.60 2w3s h ALA 667 N 0.64 0.65 -0.52 3.60 0.00 -0.53 0.88 119.26 123.98 2w3s h ALA 667 Ca 0.03 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.96 2w3s h ALA 667 Cb 0.56 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 2w3s h ALA 667 CO 0.02 0.14 0.10 -0.92 0.00 0.00 0.00 179.25 178.59 2w3s h TYR 668 N 0.68 0.15 -0.56 0.00 3.20 -0.87 0.88 116.97 120.45 2w3s h TYR 668 Ca 0.18 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.03 2w3s h TYR 668 Cb -0.00 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 2w3s h TYR 668 CO -0.03 -0.02 0.13 0.28 -1.64 0.00 0.00 178.16 176.89 2w3s h VAL 669 N 0.23 1.25 -0.61 1.81 2.07 -1.01 -0.42 116.25 119.57 2w3s h VAL 669 Ca 0.27 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 2w3s h VAL 669 Cb 0.37 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2w3s h VAL 669 CO -0.35 0.33 0.25 -0.61 0.02 0.00 0.00 177.57 177.20 2w3s h GLN 670 N 0.81 0.88 -0.24 1.57 4.15 0.72 -1.43 115.11 121.58 2w3s h GLN 670 Ca 0.18 -0.14 -0.18 0.00 0.77 0.00 0.00 58.65 59.28 2w3s h GLN 670 Cb 0.35 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 2w3s h GLN 670 CO 0.00 0.72 -0.58 0.78 -1.93 0.00 0.00 178.83 177.82 2w3s h GLY 671 N 0.98 0.84 1.03 2.39 0.00 0.11 -2.31 103.07 106.12 2w3s h GLY 671 Ca 0.21 -1.01 -0.15 0.00 0.00 0.00 0.00 47.33 46.39 2w3s h GLY 671 CO -0.02 0.90 -0.39 0.00 0.00 0.00 0.00 176.54 177.03 2w3s h ALA 672 N 0.76 0.43 -0.57 3.60 0.00 -1.01 -2.78 119.26 119.70 2w3s h ALA 672 Ca 0.00 -0.45 0.11 0.00 0.00 0.00 0.00 54.91 54.58 2w3s h ALA 672 Cb 1.17 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.79 2w3s h ALA 672 CO 0.12 0.53 0.02 0.78 0.00 0.00 0.00 179.25 180.70 2w3s h GLY 673 N 0.51 0.62 0.35 0.00 0.00 -1.26 -0.82 103.07 102.47 2w3s h GLY 673 Ca 0.03 0.06 0.15 0.00 0.00 0.00 0.00 47.33 47.57 2w3s h GLY 673 CO 0.09 -0.17 0.62 -0.25 0.00 0.00 0.00 176.54 176.83 2w3s h TRP 674 N 0.14 1.05 -0.50 5.60 7.01 -1.13 -1.77 115.95 126.34 2w3s h TRP 674 Ca 0.30 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.33 2w3s h TRP 674 Cb 0.46 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.20 2w3s h TRP 674 CO -0.33 0.34 0.00 1.28 -2.79 0.00 0.00 178.44 176.94 2w3s n LEU 675 N -4.66 3.84 0.00 0.65 4.77 -0.50 -4.61 117.00 116.49 2w3s n LEU 675 Ca 0.20 -2.29 0.00 0.00 -0.03 0.00 0.00 56.01 53.90 2w3s n LEU 675 Cb 0.46 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2w3s n LEU 675 CO 0.26 0.80 0.00 0.35 -1.33 0.00 0.00 177.39 177.46 2w3s n THR 676 N 0.77 0.00 0.04 -5.08 -2.24 -0.43 -1.05 114.28 106.29 2w3s n THR 676 Ca 0.20 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.97 2w3s n THR 676 Cb 0.68 -0.21 -0.08 0.00 -2.10 0.00 0.00 70.33 68.61 2w3s n THR 676 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2w3s h THR 677 N 0.00 0.60 -2.92 4.28 1.35 -1.74 -2.84 112.91 111.63 2w3s h THR 677 Ca 0.00 -2.13 -0.57 0.00 -0.55 0.00 0.00 66.41 63.16 2w3s h THR 677 Cb 0.00 2.13 -0.04 0.00 -1.73 0.00 0.00 68.15 68.52 2w3s h THR 677 CO 0.00 0.34 1.08 -1.61 -0.25 0.00 0.00 175.52 175.08 2w3s s GLU 678 N -2.88 3.79 -0.05 4.72 2.02 -1.03 -4.46 118.70 120.81 2w3s s GLU 678 Ca -0.02 1.46 -0.00 0.00 0.02 0.00 0.00 54.97 56.42 2w3s s GLU 678 Cb 0.09 -4.00 0.03 0.00 0.10 0.00 0.00 34.13 30.35 2w3s s GLU 678 CO 0.81 -1.30 -0.00 -2.00 0.02 0.00 0.00 175.26 172.79 2w3s s GLU 679 N 4.60 0.47 -0.01 1.61 2.12 -1.26 -4.68 118.70 121.55 2w3s s GLU 679 Ca 0.66 0.07 -0.17 0.00 0.36 0.00 0.00 54.97 55.90 2w3s s GLU 679 Cb -0.21 -0.71 -0.06 0.00 0.26 0.00 0.00 34.13 33.42 2w3s s GLU 679 CO 0.28 -0.19 0.47 -0.51 -0.54 0.00 0.00 175.26 174.77 2w3s s LEU 680 N 1.38 4.44 -0.06 2.70 1.43 -1.26 -4.83 118.68 122.48 2w3s s LEU 680 Ca -0.04 1.01 0.03 0.00 -1.03 0.00 0.00 54.13 54.10 2w3s s LEU 680 Cb -0.13 -2.70 0.01 0.00 0.03 0.00 0.00 46.19 43.40 2w3s s LEU 680 CO -0.02 0.23 -0.15 -0.69 0.23 0.00 0.00 176.35 175.95 2w3s s VAL 681 N -0.67 1.32 0.03 -1.59 1.01 -1.26 -5.02 120.40 114.21 2w3s s VAL 681 Ca 0.26 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2w3s s VAL 681 Cb -0.17 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2w3s s VAL 681 CO 0.14 0.39 -0.06 0.26 0.00 0.00 0.00 175.10 175.84 2w3s s TRP 682 N 0.45 2.89 0.75 5.22 0.51 -1.26 0.22 118.94 127.73 2w3s s TRP 682 Ca -0.12 -0.05 -0.01 0.00 -2.12 0.00 0.00 56.10 53.80 2w3s s TRP 682 Cb -0.15 -1.58 0.14 0.00 -0.81 0.00 0.00 33.47 31.08 2w3s s TRP 682 CO 0.04 0.40 1.03 0.16 -0.51 0.00 0.00 176.95 178.07 2w3s s ASP 683 N -1.66 4.18 0.60 2.95 1.47 -0.37 -4.89 116.67 118.95 2w3s s ASP 683 Ca 0.19 -0.44 0.29 0.00 1.18 0.00 0.00 52.55 53.77 2w3s s ASP 683 Cb -0.11 0.14 1.41 0.00 -0.34 0.00 0.00 42.92 44.02 2w3s s ASP 683 CO 0.10 -1.99 1.82 1.12 0.68 0.00 0.00 175.17 176.90 2w3s h HIS 684 N -0.63 0.00 -0.00 2.11 2.07 -2.01 0.25 115.15 116.93 2w3s h HIS 684 Ca -0.35 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.17 2w3s h HIS 684 Cb 1.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.24 2w3s h HIS 684 CO -0.31 0.00 -0.41 0.00 -3.07 0.00 0.00 177.93 174.14 2w3s n GLY 686 N 1.49 0.50 3.73 0.00 0.00 0.86 -4.39 105.19 107.38 2w3s n GLY 686 Ca 0.06 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 2w3s n GLY 686 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3s s ARG 687 N -1.49 4.54 -0.41 1.61 0.52 -1.26 -4.48 118.95 117.98 2w3s s ARG 687 Ca 0.00 1.18 -0.29 0.00 -0.52 0.00 0.00 55.73 56.10 2w3s s ARG 687 Cb 0.00 -3.40 0.01 0.00 0.52 0.00 0.00 34.95 32.09 2w3s s ARG 687 CO 0.00 0.17 1.30 -1.17 0.02 0.00 0.00 175.30 175.62 2w3s s LEU 688 N 0.29 3.66 0.39 2.53 2.96 -1.26 -1.23 118.68 126.02 2w3s s LEU 688 Ca 0.42 0.79 0.26 0.00 -0.22 0.00 0.00 54.13 55.38 2w3s s LEU 688 Cb -0.21 -3.54 0.72 0.00 0.50 0.00 0.00 46.19 43.66 2w3s s LEU 688 CO 0.24 -1.30 1.73 0.24 -1.32 0.00 0.00 176.35 175.95 2w3s h MET 689 N 9.94 0.00 -3.37 1.98 2.86 -0.57 -3.37 114.93 122.40 2w3s h MET 689 Ca -0.26 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.69 2w3s h MET 689 Cb 1.09 0.00 -0.36 0.00 0.06 0.00 0.00 31.60 32.39 2w3s h MET 689 CO 1.09 0.00 -0.24 0.95 1.06 0.00 0.00 176.91 179.77 2w3s s THR 690 N -3.28 3.98 -0.14 2.22 -4.23 -1.23 -4.86 115.64 108.09 2w3s s THR 690 Ca 0.06 -3.64 0.15 0.00 -1.18 0.00 0.00 61.69 57.08 2w3s s THR 690 Cb 0.08 -3.52 0.33 0.00 1.34 0.00 0.00 72.50 70.73 2w3s s THR 690 CO 0.60 -1.01 1.17 0.00 -0.54 0.00 0.00 174.62 174.84 2w3s n HIS 691 N 2.64 0.00 -3.47 3.99 1.44 -1.26 -4.77 115.22 113.79 2w3s n HIS 691 Ca 0.17 -1.09 -0.13 0.00 -2.01 0.00 0.00 57.72 54.66 2w3s n HIS 691 Cb 0.37 -0.18 -0.03 0.00 0.12 0.00 0.00 29.99 30.27 2w3s n HIS 691 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w3s s ALA 692 N -2.59 -1.52 0.63 1.59 0.00 -1.26 -4.18 121.76 114.43 2w3s s ALA 692 Ca 0.32 0.54 0.31 0.00 0.00 0.00 0.00 51.96 53.13 2w3s s ALA 692 Cb 0.30 0.72 1.66 0.00 0.00 0.00 0.00 23.12 25.80 2w3s s ALA 692 CO -0.03 -0.69 1.99 -1.35 0.00 0.00 0.00 175.76 175.68 2w3s h PRO 693 N 2.23 0.00 0.00 0.00 0.11 -1.97 0.28 132.00 132.64 2w3s h PRO 693 Ca -0.33 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 2w3s h PRO 693 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2w3s h PRO 693 CO 0.39 0.00 -0.26 1.03 -0.21 0.00 0.00 178.00 178.95 2w3s h SER 694 N 0.00 0.00 0.00 -2.05 0.87 -2.02 -3.35 113.55 107.00 2w3s h SER 694 Ca 0.07 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 2w3s h SER 694 Cb 0.71 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2w3s h SER 694 CO -0.00 0.26 -1.24 0.35 -0.53 0.00 0.00 176.83 175.67 2w3s n THR 695 N -3.69 0.10 -3.70 2.23 -2.24 0.75 -4.96 114.28 102.77 2w3s n THR 695 Ca -0.01 -0.13 -0.37 0.00 -2.27 0.00 0.00 64.05 61.27 2w3s n THR 695 Cb 0.38 -0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.44 2w3s n THR 695 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w3s s TYR 696 N -2.25 3.20 -0.77 4.78 5.04 0.08 -4.92 117.35 122.52 2w3s s TYR 696 Ca -0.02 -0.04 -0.09 0.00 -2.44 0.00 0.00 57.07 54.49 2w3s s TYR 696 Cb 0.02 -2.28 0.20 0.00 0.35 0.00 0.00 41.96 40.25 2w3s s TYR 696 CO 0.19 -0.15 0.66 0.15 -1.34 0.00 0.00 175.55 175.06 2w3s s LYS 697 N 1.43 3.23 0.79 4.97 -0.14 -1.26 -4.36 119.74 124.39 2w3s s LYS 697 Ca 0.06 -2.59 -0.11 0.00 -1.36 0.00 0.00 55.97 51.98 2w3s s LYS 697 Cb -0.15 -4.14 0.07 0.00 -1.68 0.00 0.00 37.83 31.93 2w3s s LYS 697 CO 0.06 -1.24 1.09 0.96 -0.76 0.00 0.00 175.35 175.46 2w3s s ILE 698 N -0.11 3.20 0.16 2.17 -4.36 -1.26 -3.43 121.20 117.58 2w3s s ILE 698 Ca 0.19 0.39 -0.34 0.00 -0.26 0.00 0.00 60.65 60.63 2w3s s ILE 698 Cb -0.14 -2.85 -0.15 0.00 1.25 0.00 0.00 42.46 40.58 2w3s s ILE 698 CO -0.07 -0.51 1.39 -2.65 0.24 0.00 0.00 174.94 173.34 2w3s n PRO 699 N -3.60 1.66 -3.80 0.37 -0.02 -1.26 -5.00 135.00 123.35 2w3s n PRO 699 Ca 0.09 0.60 -0.21 0.00 -2.02 0.00 0.00 63.50 61.96 2w3s n PRO 699 Cb 0.53 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 2w3s n PRO 699 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s s ALA 700 N 0.33 3.93 0.27 3.55 0.00 -1.26 -4.99 121.76 123.60 2w3s s ALA 700 Ca 0.76 -1.47 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 2w3s s ALA 700 Cb -0.78 -1.45 0.57 0.00 0.00 0.00 0.00 23.12 21.46 2w3s s ALA 700 CO 0.46 0.09 1.43 0.34 0.00 0.00 0.00 175.76 178.07 2w3s n PHE 701 N -1.42 0.46 0.24 0.00 7.35 -1.26 -0.26 117.46 122.57 2w3s n PHE 701 Ca -0.04 1.11 0.13 0.00 -0.76 0.00 0.00 57.45 57.89 2w3s n PHE 701 Cb 0.58 -1.11 0.50 0.00 0.35 0.00 0.00 39.48 39.80 2w3s n PHE 701 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2w3s h SER 702 N 0.00 0.00 0.26 -2.13 4.64 -2.02 -3.02 113.55 111.28 2w3s h SER 702 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2w3s h SER 702 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2w3s h SER 702 CO -0.90 0.10 0.00 0.47 -0.87 0.00 0.00 176.83 175.63 2w3s n ASP 703 N -3.20 0.00 -4.75 4.97 8.00 0.64 -4.71 116.55 117.49 2w3s n ASP 703 Ca 0.01 0.48 -0.41 0.00 0.71 0.00 0.00 54.79 55.58 2w3s n ASP 703 Cb 0.40 -0.49 -0.02 0.00 -0.02 0.00 0.00 41.12 40.99 2w3s n ASP 703 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w3s s ARG 704 N -2.98 4.20 0.03 -1.24 1.70 -1.14 -4.80 118.95 114.72 2w3s s ARG 704 Ca 0.04 2.42 -0.38 0.00 -0.47 0.00 0.00 55.73 57.34 2w3s s ARG 704 Cb 0.05 -3.07 -0.20 0.00 -0.57 0.00 0.00 34.95 31.16 2w3s s ARG 704 CO 0.14 -0.51 1.00 -2.30 -1.08 0.00 0.00 175.30 172.54 2w3s n PRO 705 N 2.23 0.00 0.05 3.89 -0.02 -1.26 -4.82 135.00 135.08 2w3s n PRO 705 Ca 0.07 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.54 2w3s n PRO 705 Cb 0.39 -1.43 0.26 0.00 -0.02 0.00 0.00 33.50 32.69 2w3s n PRO 705 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s h ARG 706 N 2.73 0.37 -4.94 -0.52 2.47 -1.04 -3.35 114.38 110.11 2w3s h ARG 706 Ca -0.48 -0.13 -0.66 0.00 -1.26 0.00 0.00 59.98 57.45 2w3s h ARG 706 Cb 1.43 -0.03 -0.36 0.00 -1.65 0.00 0.00 29.97 29.37 2w3s h ARG 706 CO 0.64 0.60 -0.84 0.42 0.56 0.00 0.00 179.97 181.34 2w3s s ILE 707 N -4.50 1.98 -0.42 2.04 1.01 -0.31 -5.00 121.20 115.99 2w3s s ILE 707 Ca -0.06 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.61 2w3s s ILE 707 Cb 0.14 -1.86 0.12 0.00 0.01 0.00 0.00 42.46 40.87 2w3s s ILE 707 CO 0.77 0.41 0.16 0.12 0.00 0.00 0.00 174.94 176.40 2w3s s PHE 708 N 1.30 3.15 -0.42 3.97 5.99 -1.26 -0.30 117.98 130.41 2w3s s PHE 708 Ca 0.02 -2.91 -0.09 0.00 0.00 0.00 0.00 56.93 53.95 2w3s s PHE 708 Cb -0.14 -2.67 0.08 0.00 0.00 0.00 0.00 43.02 40.29 2w3s s PHE 708 CO -0.11 -0.84 0.26 -0.80 -0.00 0.00 0.00 175.22 173.73 2w3s s ASN 709 N 0.39 5.62 -0.16 6.13 0.01 0.85 -5.02 114.94 122.78 2w3s s ASN 709 Ca 0.14 -1.54 -0.01 0.00 -0.71 0.00 0.00 52.86 50.74 2w3s s ASN 709 Cb -0.22 -1.98 -0.01 0.00 0.41 0.00 0.00 41.25 39.45 2w3s s ASN 709 CO -0.05 -0.54 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.18 2w3s s VAL 710 N 1.41 2.93 0.15 1.60 1.01 -1.26 0.20 120.40 126.44 2w3s s VAL 710 Ca 0.03 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.37 2w3s s VAL 710 Cb -0.23 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2w3s s VAL 710 CO 0.02 0.50 -0.09 0.00 0.00 0.00 0.00 175.10 175.53 2w3s s ALA 711 N 0.74 1.47 0.04 5.51 0.00 0.13 -4.98 121.76 124.67 2w3s s ALA 711 Ca -0.05 -1.51 0.05 0.00 0.00 0.00 0.00 51.96 50.44 2w3s s ALA 711 Cb -0.15 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2w3s s ALA 711 CO 0.01 -0.11 -0.09 -0.51 0.00 0.00 0.00 175.76 175.06 2w3s s LEU 712 N -3.18 3.07 -0.84 0.00 1.43 -1.26 -0.46 118.68 117.44 2w3s s LEU 712 Ca 0.17 -0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 52.86 2w3s s LEU 712 Cb 0.03 -1.80 0.16 0.00 0.03 0.00 0.00 46.19 44.61 2w3s s LEU 712 CO 0.01 0.25 0.93 0.86 0.23 0.00 0.00 176.35 178.62 2w3s s TRP 713 N -1.06 3.36 -0.69 0.29 -0.11 0.22 -4.82 118.94 116.13 2w3s s TRP 713 Ca 0.18 -1.57 -0.27 0.00 1.22 0.00 0.00 56.10 55.66 2w3s s TRP 713 Cb -0.11 -4.06 0.03 0.00 -1.50 0.00 0.00 33.47 27.82 2w3s s TRP 713 CO 0.09 -1.27 1.31 0.34 -4.62 0.00 0.00 176.95 172.80 2w3s s ASP 714 N 3.05 6.16 -0.30 5.86 -1.08 -1.26 -4.21 116.67 124.89 2w3s s ASP 714 Ca 0.24 -0.24 -0.10 0.00 -0.52 0.00 0.00 52.55 51.93 2w3s s ASP 714 Cb -0.10 -2.56 0.14 0.00 -1.46 0.00 0.00 42.92 38.95 2w3s s ASP 714 CO -0.07 -1.79 0.70 -1.58 0.52 0.00 0.00 175.17 172.95 2w3s s GLN 715 N 5.64 0.53 0.55 4.34 0.74 -1.18 -4.99 119.66 125.29 2w3s s GLN 715 Ca 0.40 1.27 -0.20 0.00 0.05 0.00 0.00 55.36 56.88 2w3s s GLN 715 Cb -0.08 0.76 -0.07 0.00 1.10 0.00 0.00 33.01 34.72 2w3s s GLN 715 CO 0.18 -0.24 0.88 -2.30 -0.55 0.00 0.00 175.29 173.25 2w3s n PRO 716 N 5.38 0.92 -2.24 1.67 -0.02 -1.26 -3.44 135.00 136.02 2w3s n PRO 716 Ca -0.10 0.35 -0.40 0.00 -2.02 0.00 0.00 63.50 61.33 2w3s n PRO 716 Cb 0.50 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 2w3s n PRO 716 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2w3s s ASN 717 N -1.10 6.88 0.45 2.55 3.84 -1.09 -4.78 114.94 121.68 2w3s s ASN 717 Ca 0.71 2.53 0.15 0.00 0.21 0.00 0.00 52.86 56.46 2w3s s ASN 717 Cb -0.46 -2.64 1.00 0.00 -0.55 0.00 0.00 41.25 38.60 2w3s s ASN 717 CO 0.51 -0.44 1.98 0.03 -2.79 0.00 0.00 177.10 176.39 2w3s h ARG 718 N 3.41 0.00 -7.02 0.43 3.08 -1.93 -3.44 114.38 108.90 2w3s h ARG 718 Ca -0.48 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.07 2w3s h ARG 718 Cb 1.22 0.00 0.04 0.00 0.08 0.00 0.00 29.97 31.31 2w3s h ARG 718 CO 0.65 0.19 0.18 -1.21 -1.07 0.00 0.00 179.97 178.71 2w3s s GLU 719 N -4.60 3.57 -1.23 0.04 0.41 -1.26 -4.98 118.70 110.65 2w3s s GLU 719 Ca -0.04 0.33 -0.04 0.00 -0.41 0.00 0.00 54.97 54.81 2w3s s GLU 719 Cb 0.16 -2.31 0.19 0.00 -1.78 0.00 0.00 34.13 30.38 2w3s s GLU 719 CO 0.69 -0.28 2.18 0.39 -0.49 0.00 0.00 175.26 177.75 2w3s n GLU 720 N -2.32 4.80 -2.41 1.61 1.02 -1.26 -4.74 120.64 117.33 2w3s n GLU 720 Ca 0.02 -3.84 -0.32 0.00 -0.02 0.00 0.00 57.16 52.99 2w3s n GLU 720 Cb 0.55 -2.60 -0.04 0.00 -0.02 0.00 0.00 31.44 29.34 2w3s n GLU 720 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2w3s s THR 721 N -2.04 4.53 -0.17 2.62 -4.23 -1.26 -4.92 115.64 110.17 2w3s s THR 721 Ca 0.48 1.22 -0.40 0.00 -1.18 0.00 0.00 61.69 61.81 2w3s s THR 721 Cb 0.18 -3.72 -0.17 0.00 1.34 0.00 0.00 72.50 70.14 2w3s s THR 721 CO -0.09 -0.68 1.57 0.00 -0.54 0.00 0.00 174.62 174.88 2w3s n ILE 722 N -1.55 0.17 -3.18 2.99 0.13 -1.26 0.33 119.36 116.99 2w3s n ILE 722 Ca 0.07 -0.03 -0.16 0.00 -1.10 0.00 0.00 62.75 61.52 2w3s n ILE 722 Cb 0.54 -0.98 -0.03 0.00 -0.84 0.00 0.00 39.64 38.33 2w3s n ILE 722 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 2w3s n PHE 723 N 4.18 -1.55 -3.23 9.51 3.01 -1.26 -1.42 117.46 126.70 2w3s n PHE 723 Ca 0.24 0.26 -0.22 0.00 1.01 0.00 0.00 57.45 58.74 2w3s n PHE 723 Cb 0.13 -1.26 0.01 0.00 -0.01 0.00 0.00 39.48 38.34 2w3s n PHE 723 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2w3s n ARG 724 N -2.95 -3.69 -2.19 -1.08 5.12 0.15 -4.63 116.66 107.40 2w3s n ARG 724 Ca 0.05 0.58 -0.27 0.00 -1.93 0.00 0.00 57.85 56.28 2w3s n ARG 724 Cb 0.45 -5.32 0.05 0.00 -1.16 0.00 0.00 32.46 26.47 2w3s n ARG 724 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2w3s s SER 725 N -2.68 5.28 0.09 0.55 1.04 -0.51 0.38 113.70 117.86 2w3s s SER 725 Ca 0.35 0.75 0.10 0.00 0.48 0.00 0.00 55.95 57.64 2w3s s SER 725 Cb -0.18 -1.58 -0.04 0.00 0.10 0.00 0.00 66.02 64.33 2w3s s SER 725 CO 0.43 -1.32 -0.27 -0.54 0.98 0.00 0.00 173.24 172.52 2w3s s LYS 726 N -5.19 1.58 0.22 4.02 1.02 -0.45 -4.72 119.74 116.21 2w3s s LYS 726 Ca 0.57 -1.25 -0.32 0.00 0.02 0.00 0.00 55.97 54.99 2w3s s LYS 726 Cb -0.11 -1.93 -0.13 0.00 -0.52 0.00 0.00 37.83 35.14 2w3s s LYS 726 CO 0.47 0.48 1.64 0.00 -0.92 0.00 0.00 175.35 177.02 2w3s n ALA 727 N 1.29 2.31 -0.01 5.17 0.00 -1.26 -4.59 120.51 123.42 2w3s n ALA 727 Ca -0.18 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2w3s n ALA 727 Cb 0.53 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.52 2w3s n ALA 727 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2w3s n VAL 728 N 3.34 0.00 0.37 0.00 3.14 -1.26 -4.79 118.33 119.13 2w3s n VAL 728 Ca 0.15 -0.49 -0.17 0.00 -2.96 0.00 0.00 64.34 60.87 2w3s n VAL 728 Cb 0.33 1.01 -0.08 0.00 -1.06 0.00 0.00 33.84 34.04 2w3s n VAL 728 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2w3s h GLY 729 N 0.00 -0.98 0.09 7.55 0.00 -1.92 -3.40 103.07 104.41 2w3s h GLY 729 Ca 0.00 0.36 -0.27 0.00 0.00 0.00 0.00 47.33 47.42 2w3s h GLY 729 CO 0.00 -0.35 -1.47 1.18 0.00 0.00 0.00 176.54 175.90 2w3s n GLU 730 N -5.45 0.60 -0.25 4.80 1.02 -1.26 -4.59 120.64 115.50 2w3s n GLU 730 Ca -0.13 0.51 0.05 0.00 -0.02 0.00 0.00 57.16 57.57 2w3s n GLU 730 Cb 0.39 -1.72 0.17 0.00 -0.02 0.00 0.00 31.44 30.25 2w3s n GLU 730 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2w3s h PRO 731 N -0.83 0.13 0.00 3.49 0.11 -1.87 0.25 132.00 133.28 2w3s h PRO 731 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2w3s h PRO 731 Cb 1.44 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.52 2w3s h PRO 731 CO -0.18 0.09 0.00 -0.35 -0.21 0.00 0.00 178.00 177.35 2w3s n PRO 732 N -5.30 0.48 0.08 1.05 -0.04 -1.26 -1.22 135.00 128.79 2w3s n PRO 732 Ca 0.14 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.57 2w3s n PRO 732 Cb 0.48 -1.28 0.19 0.00 -0.04 0.00 0.00 33.50 32.84 2w3s n PRO 732 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2w3s h PHE 733 N 0.00 0.31 0.00 0.54 3.57 -0.74 -3.01 116.94 117.61 2w3s h PHE 733 Ca 0.00 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2w3s h PHE 733 Cb 0.00 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2w3s h PHE 733 CO 0.00 0.68 0.00 -0.07 -2.23 0.00 0.00 178.31 176.69 2w3s h LEU 734 N 0.21 0.00 -2.59 0.59 4.07 -1.33 -2.68 115.31 113.58 2w3s h LEU 734 Ca 0.01 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.98 2w3s h LEU 734 Cb 0.90 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.64 2w3s h LEU 734 CO 0.07 0.00 0.05 -0.07 -1.08 0.00 0.00 178.44 177.41 2w3s h LEU 735 N 0.00 0.00 0.00 1.67 3.38 -1.68 -1.07 115.31 117.61 2w3s h LEU 735 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2w3s h LEU 735 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2w3s h LEU 735 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2w3s n GLY 736 N -1.25 -0.94 0.19 0.83 0.00 -1.01 -2.73 105.19 100.29 2w3s n GLY 736 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2w3s n GLY 736 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2w3s h ILE 737 N 0.00 1.29 -0.43 -0.61 2.04 -1.43 -2.08 117.51 116.29 2w3s h ILE 737 Ca 0.00 -1.40 0.04 0.00 1.00 0.00 0.00 64.86 64.51 2w3s h ILE 737 Cb 0.20 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2w3s h ILE 737 CO 0.00 0.41 0.29 0.77 0.00 0.00 0.00 178.15 179.62 2w3s h SER 738 N 0.11 0.36 -0.51 1.72 4.64 -1.74 -0.69 113.55 117.45 2w3s h SER 738 Ca 0.01 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.25 2w3s h SER 738 Cb 0.73 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 2w3s h SER 738 CO 0.05 0.24 0.00 0.00 -0.87 0.00 0.00 176.83 176.26 2w3s h ALA 739 N 1.76 0.68 -0.24 5.18 0.00 -1.59 -0.25 119.26 124.80 2w3s h ALA 739 Ca 0.18 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2w3s h ALA 739 Cb 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2w3s h ALA 739 CO -0.04 0.49 0.09 0.35 0.00 0.00 0.00 179.25 180.14 2w3s h PHE 740 N 0.76 0.38 -0.18 0.00 3.57 -1.43 -1.99 116.94 118.05 2w3s h PHE 740 Ca 0.14 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2w3s h PHE 740 Cb 0.51 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 2w3s h PHE 740 CO 0.04 0.41 0.06 -0.07 -2.23 0.00 0.00 178.31 176.52 2w3s h LEU 741 N 0.23 0.26 -0.65 0.59 4.07 -0.97 -0.84 115.31 118.00 2w3s h LEU 741 Ca 0.08 -0.19 0.02 0.00 0.08 0.00 0.00 57.88 57.88 2w3s h LEU 741 Cb 0.20 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 41.83 2w3s h LEU 741 CO -0.01 0.37 0.41 0.00 -1.08 0.00 0.00 178.44 178.14 2w3s h ALA 742 N 0.89 0.84 -0.85 1.53 0.00 -1.09 0.24 119.26 120.81 2w3s h ALA 742 Ca 0.06 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2w3s h ALA 742 Cb 0.20 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2w3s h ALA 742 CO -0.00 0.19 0.56 1.25 0.00 0.00 0.00 179.25 181.24 2w3s h LEU 743 N 0.82 0.84 -0.55 0.00 5.85 -1.13 0.45 115.31 121.58 2w3s h LEU 743 Ca 0.25 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.82 2w3s h LEU 743 Cb -0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 2w3s h LEU 743 CO -0.09 0.54 -0.66 -0.74 -0.34 0.00 0.00 178.44 177.15 2w3s h HIS 744 N 0.95 0.36 -0.28 1.25 -0.00 -0.03 -2.42 115.15 114.98 2w3s h HIS 744 Ca 0.37 -0.15 -0.04 0.00 -0.00 0.00 0.00 60.37 60.55 2w3s h HIS 744 Cb 0.21 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 2w3s h HIS 744 CO -0.00 0.85 0.01 0.22 -0.00 0.00 0.00 177.93 179.01 2w3s h ASP 745 N 0.19 0.48 -0.83 3.26 3.58 0.17 0.83 116.42 124.10 2w3s h ASP 745 Ca -0.02 -0.29 0.17 0.00 0.42 0.00 0.00 57.03 57.31 2w3s h ASP 745 Cb 1.20 -0.13 -0.06 0.00 1.72 0.00 0.00 39.33 42.06 2w3s h ASP 745 CO 0.11 0.66 0.55 0.00 -2.88 0.00 0.00 179.24 177.67 2w3s h ALA 746 N 0.84 2.09 0.06 -0.78 0.00 -0.20 -2.16 119.26 119.11 2w3s h ALA 746 Ca 0.08 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2w3s h ALA 746 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2w3s h ALA 746 CO 0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 179.25 178.91 2w3s h ALA 748 N 0.36 1.00 0.00 0.00 0.00 -0.27 -0.08 119.26 120.27 2w3s h ALA 748 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2w3s h ALA 748 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2w3s h ALA 748 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.26 2w3s h ALA 749 N 2.01 1.00 0.00 0.00 0.00 -1.38 -3.31 119.26 117.59 2w3s h ALA 749 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2w3s h ALA 749 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2w3s h ALA 749 CO 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 179.25 178.54 2w3s s GLY 751 N -4.33 0.02 0.00 0.00 0.00 -1.25 -4.40 107.32 97.37 2w3s s GLY 751 Ca 0.02 -0.28 0.26 0.00 0.00 0.00 0.00 44.72 44.72 2w3s s GLY 751 CO 0.76 0.47 1.89 -1.55 0.00 0.00 0.00 173.10 174.66 2w3s n PRO 752 N -0.54 1.29 -3.97 2.90 -0.04 -1.22 -4.75 135.00 128.68 2w3s n PRO 752 Ca -0.05 -0.43 -0.25 0.00 -0.04 0.00 0.00 63.50 62.73 2w3s n PRO 752 Cb 0.60 -1.44 -0.03 0.00 -0.04 0.00 0.00 33.50 32.59 2w3s n PRO 752 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2w3s s HIS 753 N -1.97 3.42 -0.13 0.54 3.76 -1.07 -5.05 115.29 114.80 2w3s s HIS 753 Ca 0.39 0.07 -0.29 0.00 -0.15 0.00 0.00 55.06 55.07 2w3s s HIS 753 Cb 0.19 -1.62 -0.05 0.00 1.11 0.00 0.00 32.58 32.21 2w3s s HIS 753 CO 0.31 0.50 1.80 -0.46 -0.85 0.00 0.00 174.74 176.04 2w3s s TRP 754 N -1.80 1.75 0.16 1.40 -0.11 -1.26 -4.33 118.94 114.75 2w3s s TRP 754 Ca 0.34 0.26 0.29 0.00 1.22 0.00 0.00 56.10 58.20 2w3s s TRP 754 Cb -0.10 -4.02 1.19 0.00 -1.50 0.00 0.00 33.47 29.04 2w3s s TRP 754 CO 0.28 -3.88 1.93 -1.35 -4.62 0.00 0.00 176.95 169.31 2w3s h PRO 755 N 11.17 0.00 -6.97 5.86 0.11 -1.87 -3.40 132.00 136.92 2w3s h PRO 755 Ca -0.39 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.12 2w3s h PRO 755 Cb 1.19 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.18 2w3s h PRO 755 CO 0.97 0.12 -0.98 -3.47 -0.21 0.00 0.00 178.00 174.43 2w3s n ASP 756 N -3.29 -1.26 -4.77 -2.05 2.03 -1.26 -4.29 116.55 101.65 2w3s n ASP 756 Ca 0.00 -1.26 -0.41 0.00 0.52 0.00 0.00 54.79 53.64 2w3s n ASP 756 Cb 0.35 -1.78 -0.01 0.00 -0.72 0.00 0.00 41.12 38.97 2w3s n ASP 756 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2w3s s LEU 757 N -7.37 4.34 0.46 -2.67 2.96 -1.26 -4.83 118.68 110.31 2w3s s LEU 757 Ca 0.20 2.96 0.07 0.00 -0.22 0.00 0.00 54.13 57.15 2w3s s LEU 757 Cb -0.11 -3.66 0.00 0.00 0.50 0.00 0.00 46.19 42.92 2w3s s LEU 757 CO 0.98 -0.80 0.44 -1.10 -1.32 0.00 0.00 176.35 174.54 2w3s s GLN 758 N -1.86 2.47 -0.09 1.98 -1.52 -1.26 -4.94 119.66 114.44 2w3s s GLN 758 Ca 0.53 -1.62 -0.01 0.00 -1.95 0.00 0.00 55.36 52.31 2w3s s GLN 758 Cb -0.45 -2.37 -0.03 0.00 -0.22 0.00 0.00 33.01 29.94 2w3s s GLN 758 CO 0.59 -0.35 -0.06 0.00 -0.25 0.00 0.00 175.29 175.23 2w3s s ALA 759 N -2.54 3.00 0.33 6.09 0.00 -0.71 -2.74 121.76 125.19 2w3s s ALA 759 Ca 0.47 -0.86 -0.27 0.00 0.00 0.00 0.00 51.96 51.30 2w3s s ALA 759 Cb -0.04 -1.33 -0.09 0.00 0.00 0.00 0.00 23.12 21.66 2w3s s ALA 759 CO 0.28 0.47 1.00 -1.25 0.00 0.00 0.00 175.76 176.27 2w3s s PRO 760 N -0.48 4.51 -1.27 0.00 0.04 -1.26 -2.98 135.00 133.56 2w3s s PRO 760 Ca 0.07 1.49 -0.19 0.00 0.04 0.00 0.00 61.00 62.41 2w3s s PRO 760 Cb -0.12 -2.85 0.02 0.00 0.04 0.00 0.00 34.50 31.59 2w3s s PRO 760 CO 0.02 0.17 1.80 0.00 0.04 0.00 0.00 177.00 179.04 2w3s n ALA 761 N 0.60 3.01 -1.95 8.56 0.00 -0.21 -4.71 120.51 125.81 2w3s n ALA 761 Ca 0.02 -3.59 -0.28 0.00 0.00 0.00 0.00 53.44 49.59 2w3s n ALA 761 Cb 0.49 -3.57 0.06 0.00 0.00 0.00 0.00 19.45 16.42 2w3s n ALA 761 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w3s s THR 762 N 6.38 3.01 0.32 0.00 -4.23 -1.07 -4.39 115.64 115.66 2w3s s THR 762 Ca 0.59 0.13 0.09 0.00 -1.18 0.00 0.00 61.69 61.32 2w3s s THR 762 Cb 0.03 -3.29 0.31 0.00 1.34 0.00 0.00 72.50 70.89 2w3s s THR 762 CO 0.10 -0.35 1.74 -0.65 -0.54 0.00 0.00 174.62 174.92 2w3s h PRO 763 N -0.60 0.59 0.05 3.99 0.11 -1.86 0.25 132.00 134.52 2w3s h PRO 763 Ca -0.45 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2w3s h PRO 763 Cb 1.28 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2w3s h PRO 763 CO 0.63 0.39 -0.02 1.49 -0.21 0.00 0.00 178.00 180.27 2w3s h GLU 764 N 0.61 -0.06 -1.00 1.05 4.81 -1.85 -2.28 114.58 115.86 2w3s h GLU 764 Ca 0.63 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.96 2w3s h GLU 764 Cb 1.18 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.50 2w3s h GLU 764 CO -0.45 0.01 0.64 0.00 -0.73 0.00 0.00 179.01 178.48 2w3s h ALA 765 N 0.84 1.48 -0.01 2.92 0.00 -0.90 -0.46 119.26 123.12 2w3s h ALA 765 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2w3s h ALA 765 Cb 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2w3s h ALA 765 CO 0.01 0.32 0.01 0.28 0.00 0.00 0.00 179.25 179.86 2w3s h VAL 766 N 1.07 1.08 -0.69 0.00 2.07 -0.83 -1.49 116.25 117.46 2w3s h VAL 766 Ca 0.47 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.77 2w3s h VAL 766 Cb 0.36 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 2w3s h VAL 766 CO -0.22 0.06 0.46 0.25 0.02 0.00 0.00 177.57 178.13 2w3s h LEU 767 N -0.08 0.78 -0.10 2.57 5.85 -0.82 0.34 115.31 123.85 2w3s h LEU 767 Ca 0.00 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.73 2w3s h LEU 767 Cb 0.09 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2w3s h LEU 767 CO -0.00 0.56 -0.02 0.00 -0.34 0.00 0.00 178.44 178.63 2w3s h ALA 768 N 1.58 0.07 -0.43 1.25 0.00 -0.82 -1.59 119.26 119.32 2w3s h ALA 768 Ca 0.26 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 2w3s h ALA 768 Cb -0.08 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2w3s h ALA 768 CO -0.06 -0.49 -0.14 0.00 0.00 0.00 0.00 179.25 178.56 2w3s h ALA 769 N 1.10 0.94 0.23 0.00 0.00 -0.46 -2.06 119.26 119.00 2w3s h ALA 769 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2w3s h ALA 769 Cb 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2w3s h ALA 769 CO -0.11 0.62 -0.22 0.28 0.00 0.00 0.00 179.25 179.82 2w3s h VAL 770 N 0.71 0.53 0.00 0.00 2.07 -0.18 -2.01 116.25 117.37 2w3s h VAL 770 Ca 0.11 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.59 2w3s h VAL 770 Cb 0.64 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2w3s h VAL 770 CO 0.04 0.00 -0.22 0.03 0.02 0.00 0.00 177.57 177.44 2w3s h ARG 771 N -0.47 0.00 -0.46 1.57 3.08 -1.21 0.20 114.38 117.08 2w3s h ARG 771 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 2w3s h ARG 771 Cb 0.44 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2w3s h ARG 771 CO -0.05 0.22 -0.23 0.00 -1.07 0.00 0.00 179.97 178.85 2w3s h ARG 772 N 0.00 0.96 0.13 0.04 3.08 -1.25 0.21 114.38 117.55 2w3s h ARG 772 Ca -0.00 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.63 2w3s h ARG 772 Cb 0.41 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2w3s h ARG 772 CO 0.03 1.08 -0.06 0.00 -1.07 0.00 0.00 179.97 179.94 2w3s h ALA 773 N 0.90 -0.18 0.00 0.04 0.00 -0.47 -2.62 119.26 116.93 2w3s h ALA 773 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2w3s h ALA 773 Cb 0.80 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2w3s h ALA 773 CO 0.07 -0.39 0.02 0.39 0.00 0.00 0.00 179.25 179.34 2w3s n GLU 774 N -4.98 0.00 -1.98 0.00 1.02 0.57 -2.58 120.64 112.69 2w3s n GLU 774 Ca -0.09 0.41 -0.11 0.00 -0.02 0.00 0.00 57.16 57.35 2w3s n GLU 774 Cb 0.24 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 30.12 2w3s n GLU 774 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3s n GLY 775 N -1.41 0.26 3.54 0.62 0.00 -0.50 -4.96 105.19 102.73 2w3s n GLY 775 Ca 0.00 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 2w3s n GLY 775 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w3s s ARG 776 N -4.14 3.81 0.00 1.61 0.52 0.62 -5.01 118.95 116.35 2w3s s ARG 776 Ca 0.00 -0.41 0.00 0.00 -0.52 0.00 0.00 55.73 54.80 2w3s s ARG 776 Cb 0.00 -3.58 0.00 0.00 0.52 0.00 0.00 34.95 31.89 2w3s s ARG 776 CO 0.00 -0.21 0.00 0.00 0.02 0.00 0.00 175.30 175.11